*HEADER    HYDROLASE                               17-MAY-01   1J7M              
*TITLE     THE THIRD 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: THIRD FIBRONECTIN TYPE II MODULE;                          
*COMPND   5 SYNONYM: 72 KDA TYPE IV COLLAGENASE, GELATINASE A;                   
*COMPND   6 EC: 3.4.24.24;                                                       
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PMED23                                    
*KEYWDS    BETA SHEET, ALPHA HELIX                                               
*EXPDTA    NMR, 50 STRUCTURES                                                    
*AUTHOR    K.BRIKNAROVA, M.GEHRMANN, L.BANYAI, H.TORDAI, L.PATTHY,               
*AUTHOR   2 M.LLINAS                                                             
*REVDAT   1   30-MAY-01 1J7M    0                                                
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HB1  )    2.8   0.8   0.8
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HG1  )    2.9   0.9   0.9
ASSIGN (RESID   3 AND NAME HN   ) (RESID   3 AND NAME HG2  )    3.1   0.9   0.9
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID   3 AND NAME HA   ) (RESID   3 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID   3 AND NAME HA   ) (RESID   4 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HA   )    2.3   0.7   0.7
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HB1  )    3.0   0.9   0.9
ASSIGN (RESID   4 AND NAME HN   ) (RESID   4 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID   4 AND NAME HA   ) (RESID   5 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID   4 AND NAME HA   ) (RESID  14 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID   4 AND NAME HB1  ) (RESID   5 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID   4 AND NAME HB2  ) (RESID   5 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID   5 AND NAME HN   ) (RESID   5 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID   5 AND NAME HN   ) (RESID   5 AND NAME HB   )    2.7   0.8   0.8
ASSIGN (RESID   5 AND NAME HN   ) (RESID   5 AND NAME HG1  )    2.2   0.7   0.7
ASSIGN (RESID   5 AND NAME HN   ) (RESID   5 AND NAME HG2* )    3.0   0.9   0.9
ASSIGN (RESID   5 AND NAME HA   ) (RESID   5 AND NAME HB   )    2.8   0.8   0.8
ASSIGN (RESID   5 AND NAME HA   ) (RESID   5 AND NAME HG2* )    2.5   0.8   0.8
ASSIGN (RESID   5 AND NAME HA   ) (RESID   6 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID   5 AND NAME HB   ) (RESID   5 AND NAME HG1  )    2.6   0.8   0.8
ASSIGN (RESID   5 AND NAME HB   ) (RESID   5 AND NAME HG2* )    2.5   0.8   0.8
ASSIGN (RESID   5 AND NAME HB   ) (RESID   6 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID   5 AND NAME HB   ) (RESID  54 AND NAME HA*  )    2.3   0.7   0.7
ASSIGN (RESID   5 AND NAME HG1  ) (RESID   5 AND NAME HG2* )    2.6   0.8   0.8
ASSIGN (RESID   5 AND NAME HG2* ) (RESID   6 AND NAME HN   )    3.5   1.1   1.1
ASSIGN (RESID   5 AND NAME HG2* ) (RESID  15 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID   5 AND NAME HG2* ) (RESID  43 AND NAME HG2* )    4.4   1.3   1.3
ASSIGN (RESID   5 AND NAME HG2* ) (RESID  54 AND NAME HA*  )    3.1   0.9   0.9
ASSIGN (RESID   6 AND NAME HN   ) (RESID   6 AND NAME HB   )    2.6   0.8   0.8
ASSIGN (RESID   6 AND NAME HN   ) (RESID   6 AND NAME HG1* )    4.0   1.2   1.2
ASSIGN (RESID   6 AND NAME HN   ) (RESID   6 AND NAME HG2* )    3.1   0.9   0.9
ASSIGN (RESID   6 AND NAME HN   ) (RESID  54 AND NAME HA*  )    3.0   0.9   0.9
ASSIGN (RESID   6 AND NAME HN   ) (RESID  55 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID   6 AND NAME HA   ) (RESID   6 AND NAME HB   )    2.4   0.7   0.7
ASSIGN (RESID   6 AND NAME HA   ) (RESID   6 AND NAME HG1* )    3.0   0.9   0.9
ASSIGN (RESID   6 AND NAME HA   ) (RESID   6 AND NAME HG2* )    3.8   1.1   1.1
ASSIGN (RESID   6 AND NAME HA   ) (RESID   7 AND NAME HN   )    1.9   0.6   0.6
ASSIGN (RESID   6 AND NAME HB   ) (RESID   7 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID   6 AND NAME HG1* ) (RESID   7 AND NAME HN   )    3.9   1.2   1.2
ASSIGN (RESID   6 AND NAME HG1* ) (RESID  55 AND NAME HD*  )    4.2   1.3   1.3
ASSIGN (RESID   6 AND NAME HG2* ) (RESID   7 AND NAME HN   )    4.1   1.2   1.2
ASSIGN (RESID   6 AND NAME HG2* ) (RESID  55 AND NAME HB1  )    3.2   1.0   1.0
ASSIGN (RESID   6 AND NAME HG2* ) (RESID  55 AND NAME HB2  )    3.0   0.9   0.9
ASSIGN (RESID   6 AND NAME HG2* ) (RESID  55 AND NAME HD*  )    3.8   1.1   1.1
ASSIGN (RESID   7 AND NAME HN   ) (RESID   7 AND NAME HA2  )    2.1   0.6   0.6
ASSIGN (RESID   7 AND NAME HA1  ) (RESID   7 AND NAME HA2  )    1.8   0.5   0.5
ASSIGN (RESID   7 AND NAME HA1  ) (RESID   8 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID   7 AND NAME HA1  ) (RESID  55 AND NAME HD*  )    2.6   0.8   0.8
ASSIGN (RESID   7 AND NAME HA1  ) (RESID  55 AND NAME HE*  )    3.1   0.9   0.9
ASSIGN (RESID   7 AND NAME HA2  ) (RESID   8 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID   7 AND NAME HA2  ) (RESID  55 AND NAME HD*  )    2.8   0.8   0.8
ASSIGN (RESID   8 AND NAME HN   ) (RESID   8 AND NAME HA1  )    2.3   0.7   0.7
ASSIGN (RESID   8 AND NAME HN   ) (RESID   8 AND NAME HA2  )    2.1   0.6   0.6
ASSIGN (RESID   8 AND NAME HN   ) (RESID  55 AND NAME HD*  )    3.3   1.0   1.0
ASSIGN (RESID   8 AND NAME HN   ) (RESID  55 AND NAME HE*  )    3.3   1.0   1.0
ASSIGN (RESID   8 AND NAME HA1  ) (RESID   8 AND NAME HA2  )    1.8   0.5   0.5
ASSIGN (RESID   8 AND NAME HA1  ) (RESID   9 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID   8 AND NAME HA1  ) (RESID  54 AND NAME HA*  )    2.3   0.7   0.7
ASSIGN (RESID   8 AND NAME HA2  ) (RESID   9 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID   8 AND NAME HA2  ) (RESID  53 AND NAME HH2  )    2.9   0.9   0.9
ASSIGN (RESID   8 AND NAME HA2  ) (RESID  54 AND NAME HA*  )    3.0   0.9   0.9
ASSIGN (RESID   9 AND NAME HN   ) (RESID   9 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID   9 AND NAME HN   ) (RESID  10 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID   9 AND NAME HN   ) (RESID  53 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID   9 AND NAME HA   ) (RESID   9 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID   9 AND NAME HA   ) (RESID   9 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID   9 AND NAME HA   ) (RESID  10 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID   9 AND NAME HB1  ) (RESID   9 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID   9 AND NAME HB1  ) (RESID   9 AND NAME HD21 )    2.4   0.7   0.7
ASSIGN (RESID   9 AND NAME HB1  ) (RESID   9 AND NAME HD22 )    3.3   1.0   1.0
ASSIGN (RESID   9 AND NAME HB2  ) (RESID   9 AND NAME HD21 )    2.4   0.7   0.7
ASSIGN (RESID   9 AND NAME HD21 ) (RESID   9 AND NAME HD22 )    1.8   0.5   0.5
ASSIGN (RESID   9 AND NAME HD21 ) (RESID  10 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID   9 AND NAME HD21 ) (RESID  52 AND NAME HA   )    2.9   0.9   0.9
ASSIGN (RESID   9 AND NAME HD22 ) (RESID  52 AND NAME HA   )    2.2   0.7   0.7
ASSIGN (RESID   9 AND NAME HD22 ) (RESID  52 AND NAME HG1  )    3.3   1.0   1.0
ASSIGN (RESID   9 AND NAME HD22 ) (RESID  53 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID   9 AND NAME HD22 ) (RESID  53 AND NAME HE1  )    3.1   0.9   0.9
ASSIGN (RESID  10 AND NAME HN   ) (RESID  10 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID  10 AND NAME HN   ) (RESID  10 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  10 AND NAME HN   ) (RESID  10 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  10 AND NAME HN   ) (RESID  10 AND NAME HG   )    2.5   0.8   0.8
ASSIGN (RESID  10 AND NAME HN   ) (RESID  11 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  10 AND NAME HA   ) (RESID  10 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  10 AND NAME HB1  ) (RESID  10 AND NAME HB2  )    2.0   0.6   0.6
ASSIGN (RESID  10 AND NAME HB1  ) (RESID  13 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  10 AND NAME HB1  ) (RESID  13 AND NAME HB*  )    2.6   0.8   0.8
ASSIGN (RESID  10 AND NAME HB1  ) (RESID  43 AND NAME HG2* )    2.9   0.9   0.9
ASSIGN (RESID  10 AND NAME HB2  ) (RESID  13 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  10 AND NAME HB2  ) (RESID  13 AND NAME HB*  )    3.1   0.9   0.9
ASSIGN (RESID  11 AND NAME HN   ) (RESID  11 AND NAME HA*  )    2.4   0.7   0.7
ASSIGN (RESID  11 AND NAME HA*  ) (RESID  12 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  12 AND NAME HN   ) (RESID  12 AND NAME HA1  )    2.5   0.8   0.8
ASSIGN (RESID  12 AND NAME HN   ) (RESID  12 AND NAME HA2  )    2.3   0.7   0.7
ASSIGN (RESID  12 AND NAME HN   ) (RESID  13 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  12 AND NAME HA1  ) (RESID  13 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  12 AND NAME HA2  ) (RESID  13 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  13 AND NAME HN   ) (RESID  13 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  13 AND NAME HN   ) (RESID  13 AND NAME HB*  )    2.5   0.8   0.8
ASSIGN (RESID  13 AND NAME HN   ) (RESID  43 AND NAME HG2* )    4.2   1.3   1.3
ASSIGN (RESID  13 AND NAME HA   ) (RESID  13 AND NAME HB*  )    2.2   0.7   0.7
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HD2  )    2.2   0.7   0.7
ASSIGN (RESID  13 AND NAME HA   ) (RESID  14 AND NAME HD1  )    2.0   0.6   0.6
ASSIGN (RESID  13 AND NAME HB*  ) (RESID  14 AND NAME HD2  )    2.6   0.8   0.8
ASSIGN (RESID  13 AND NAME HB*  ) (RESID  14 AND NAME HD1  )    3.0   0.9   0.9
ASSIGN (RESID  13 AND NAME HB*  ) (RESID  43 AND NAME HG1  )    3.5   1.1   1.1
ASSIGN (RESID  13 AND NAME HB*  ) (RESID  43 AND NAME HG2* )    3.3   1.0   1.0
ASSIGN (RESID  14 AND NAME HA   ) (RESID  14 AND NAME HB*  )    2.5   0.8   0.8
ASSIGN (RESID  14 AND NAME HA   ) (RESID  15 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  14 AND NAME HB*  ) (RESID  15 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  14 AND NAME HG*  ) (RESID  14 AND NAME HD2  )    2.3   0.7   0.7
ASSIGN (RESID  14 AND NAME HG*  ) (RESID  14 AND NAME HD1  )    2.5   0.8   0.8
ASSIGN (RESID  14 AND NAME HD2  ) (RESID  14 AND NAME HD1  )    2.2   0.7   0.7
ASSIGN (RESID  15 AND NAME HN   ) (RESID  15 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  15 AND NAME HA   ) (RESID  15 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  15 AND NAME HA   ) (RESID  15 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  15 AND NAME HA   ) (RESID  16 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  15 AND NAME HA   ) (RESID  43 AND NAME HA   )    2.3   0.7   0.7
ASSIGN (RESID  15 AND NAME HA   ) (RESID  43 AND NAME HG2* )    2.8   0.8   0.8
ASSIGN (RESID  15 AND NAME HB1  ) (RESID  17 AND NAME HE*  )    3.2   1.0   1.0
ASSIGN (RESID  15 AND NAME HB1  ) (RESID  17 AND NAME HZ   )    2.5   0.8   0.8
ASSIGN (RESID  15 AND NAME HB2  ) (RESID  17 AND NAME HE*  )    3.0   0.9   0.9
ASSIGN (RESID  15 AND NAME HB2  ) (RESID  17 AND NAME HZ   )    2.7   0.8   0.8
ASSIGN (RESID  16 AND NAME HN   ) (RESID  16 AND NAME HB   )    2.2   0.7   0.7
ASSIGN (RESID  16 AND NAME HN   ) (RESID  43 AND NAME HA   )    2.2   0.7   0.7
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HB   )    2.4   0.7   0.7
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HG1* )    2.4   0.7   0.7
ASSIGN (RESID  16 AND NAME HA   ) (RESID  16 AND NAME HG2* )    2.5   0.8   0.8
ASSIGN (RESID  16 AND NAME HB   ) (RESID  16 AND NAME HG1* )    2.3   0.7   0.7
ASSIGN (RESID  16 AND NAME HB   ) (RESID  16 AND NAME HG2* )    2.2   0.7   0.7
ASSIGN (RESID  16 AND NAME HG1* ) (RESID  45 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  16 AND NAME HG1* ) (RESID  45 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  16 AND NAME HG1* ) (RESID  45 AND NAME HB*  )    3.1   0.9   0.9
ASSIGN (RESID  16 AND NAME HG2* ) (RESID  44 AND NAME HN   )    3.6   1.1   1.1
ASSIGN (RESID  16 AND NAME HG2* ) (RESID  45 AND NAME HN   )    3.4   1.0   1.0
ASSIGN (RESID  17 AND NAME HN   ) (RESID  17 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  17 AND NAME HN   ) (RESID  17 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  17 AND NAME HN   ) (RESID  17 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  17 AND NAME HA   ) (RESID  17 AND NAME HD*  )    2.4   0.7   0.7
ASSIGN (RESID  17 AND NAME HB1  ) (RESID  17 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  17 AND NAME HB1  ) (RESID  17 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  17 AND NAME HB2  ) (RESID  17 AND NAME HD*  )    2.4   0.7   0.7
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  19 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  27 AND NAME HA   )    2.9   0.9   0.9
ASSIGN (RESID  17 AND NAME HD*  ) (RESID  28 AND NAME HA   )    3.3   1.0   1.0
ASSIGN (RESID  17 AND NAME HE*  ) (RESID  17 AND NAME HZ   )    2.2   0.7   0.7
ASSIGN (RESID  17 AND NAME HE*  ) (RESID  29 AND NAME HN   )    3.3   1.0   1.0
ASSIGN (RESID  17 AND NAME HE*  ) (RESID  29 AND NAME HA   )    3.1   0.9   0.9
ASSIGN (RESID  17 AND NAME HE*  ) (RESID  41 AND NAME HB1  )    2.9   0.9   0.9
ASSIGN (RESID  17 AND NAME HE*  ) (RESID  41 AND NAME HB2  )    3.0   0.9   0.9
ASSIGN (RESID  17 AND NAME HZ   ) (RESID  29 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  17 AND NAME HZ   ) (RESID  41 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  17 AND NAME HZ   ) (RESID  41 AND NAME HB2  )    2.8   0.8   0.8
ASSIGN (RESID  18 AND NAME HA   ) (RESID  18 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  18 AND NAME HA   ) (RESID  18 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  18 AND NAME HA   ) (RESID  18 AND NAME HG*  )    3.1   0.9   0.9
ASSIGN (RESID  18 AND NAME HA   ) (RESID  19 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  18 AND NAME HB1  ) (RESID  18 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  18 AND NAME HB1  ) (RESID  18 AND NAME HG*  )    2.4   0.7   0.7
ASSIGN (RESID  18 AND NAME HB1  ) (RESID  19 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  18 AND NAME HB2  ) (RESID  19 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  18 AND NAME HG*  ) (RESID  18 AND NAME HD2  )    2.2   0.7   0.7
ASSIGN (RESID  18 AND NAME HG*  ) (RESID  18 AND NAME HD1  )    2.1   0.6   0.6
ASSIGN (RESID  19 AND NAME HN   ) (RESID  19 AND NAME HA   )    2.8   0.8   0.8
ASSIGN (RESID  19 AND NAME HN   ) (RESID  19 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  19 AND NAME HN   ) (RESID  26 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  19 AND NAME HA   ) (RESID  19 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  19 AND NAME HA   ) (RESID  19 AND NAME HB2  )    2.1   0.6   0.6
ASSIGN (RESID  19 AND NAME HA   ) (RESID  20 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  19 AND NAME HA   ) (RESID  45 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  19 AND NAME HB1  ) (RESID  19 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  19 AND NAME HB1  ) (RESID  42 AND NAME HB*  )    2.8   0.8   0.8
ASSIGN (RESID  19 AND NAME HB2  ) (RESID  20 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  19 AND NAME HB2  ) (RESID  42 AND NAME HB*  )    2.6   0.8   0.8
ASSIGN (RESID  19 AND NAME HZ   ) (RESID  30 AND NAME HG2* )    2.6   0.8   0.8
ASSIGN (RESID  19 AND NAME HZ   ) (RESID  41 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  20 AND NAME HN   ) (RESID  20 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  20 AND NAME HN   ) (RESID  47 AND NAME HN   )    3.3   1.0   1.0
ASSIGN (RESID  20 AND NAME HA   ) (RESID  20 AND NAME HB   )    2.5   0.8   0.8
ASSIGN (RESID  20 AND NAME HA   ) (RESID  20 AND NAME HG2* )    2.7   0.8   0.8
ASSIGN (RESID  20 AND NAME HA   ) (RESID  21 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  20 AND NAME HA   ) (RESID  26 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  20 AND NAME HA   ) (RESID  26 AND NAME HD*  )    3.2   1.0   1.0
ASSIGN (RESID  20 AND NAME HB   ) (RESID  20 AND NAME HG2* )    2.4   0.7   0.7
ASSIGN (RESID  20 AND NAME HB   ) (RESID  46 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  20 AND NAME HB   ) (RESID  46 AND NAME HD21 )    3.3   1.0   1.0
ASSIGN (RESID  20 AND NAME HB   ) (RESID  47 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  20 AND NAME HG2* ) (RESID  21 AND NAME HA   )    4.1   1.2   1.2
ASSIGN (RESID  20 AND NAME HG2* ) (RESID  46 AND NAME HD21 )    3.8   1.1   1.1
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HA   )    2.9   0.9   0.9
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  21 AND NAME HN   ) (RESID  21 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  21 AND NAME HN   ) (RESID  24 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  21 AND NAME HN   ) (RESID  25 AND NAME HA   )    3.0   0.9   0.9
ASSIGN (RESID  21 AND NAME HN   ) (RESID  26 AND NAME HD*  )    2.9   0.9   0.9
ASSIGN (RESID  21 AND NAME HN   ) (RESID  26 AND NAME HE*  )    2.9   0.9   0.9
ASSIGN (RESID  21 AND NAME HA   ) (RESID  21 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  21 AND NAME HA   ) (RESID  21 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  21 AND NAME HA   ) (RESID  22 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  21 AND NAME HA   ) (RESID  23 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  21 AND NAME HA   ) (RESID  48 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  21 AND NAME HB1  ) (RESID  21 AND NAME HB2  )    2.1   0.6   0.6
ASSIGN (RESID  21 AND NAME HB1  ) (RESID  21 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  21 AND NAME HB1  ) (RESID  26 AND NAME HD*  )    3.0   0.9   0.9
ASSIGN (RESID  21 AND NAME HB2  ) (RESID  26 AND NAME HD*  )    3.3   1.0   1.0
ASSIGN (RESID  21 AND NAME HB2  ) (RESID  26 AND NAME HE*  )    2.8   0.8   0.8
ASSIGN (RESID  21 AND NAME HB2  ) (RESID  40 AND NAME HH2  )    2.9   0.9   0.9
ASSIGN (RESID  21 AND NAME HD*  ) (RESID  22 AND NAME HG   )    3.3   1.0   1.0
ASSIGN (RESID  21 AND NAME HD*  ) (RESID  22 AND NAME HD2* )    3.4   1.0   1.0
ASSIGN (RESID  21 AND NAME HD*  ) (RESID  22 AND NAME HD1* )    4.1   1.2   1.2
ASSIGN (RESID  21 AND NAME HD*  ) (RESID  32 AND NAME HB*  )    3.4   1.0   1.0
ASSIGN (RESID  21 AND NAME HD*  ) (RESID  40 AND NAME HZ2  )    3.1   0.9   0.9
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  22 AND NAME HG   )    3.2   1.0   1.0
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  22 AND NAME HD2* )    3.4   1.0   1.0
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  22 AND NAME HD1* )    4.0   1.2   1.2
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  32 AND NAME HB*  )    3.1   0.9   0.9
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  33 AND NAME HA1  )    2.7   0.8   0.8
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  33 AND NAME HA2  )    3.6   1.1   1.1
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  40 AND NAME HZ2  )    2.8   0.8   0.8
ASSIGN (RESID  21 AND NAME HE*  ) (RESID  47 AND NAME HE*  )    3.5   1.1   1.1
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HA   )    2.0   0.6   0.6
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HB2  )    1.9   0.6   0.6
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HG   )    2.7   0.8   0.8
ASSIGN (RESID  22 AND NAME HN   ) (RESID  22 AND NAME HD1* )    3.1   0.9   0.9
ASSIGN (RESID  22 AND NAME HN   ) (RESID  23 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  22 AND NAME HA   ) (RESID  22 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  22 AND NAME HA   ) (RESID  22 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  22 AND NAME HA   ) (RESID  22 AND NAME HG   )    2.8   0.8   0.8
ASSIGN (RESID  22 AND NAME HA   ) (RESID  22 AND NAME HD1* )    2.5   0.8   0.8
ASSIGN (RESID  22 AND NAME HB1  ) (RESID  22 AND NAME HD2* )    2.7   0.8   0.8
ASSIGN (RESID  22 AND NAME HB1  ) (RESID  22 AND NAME HD1* )    2.7   0.8   0.8
ASSIGN (RESID  22 AND NAME HB2  ) (RESID  22 AND NAME HG   )    2.3   0.7   0.7
ASSIGN (RESID  22 AND NAME HB2  ) (RESID  22 AND NAME HD2* )    2.4   0.7   0.7
ASSIGN (RESID  22 AND NAME HB2  ) (RESID  22 AND NAME HD1* )    3.7   1.1   1.1
ASSIGN (RESID  22 AND NAME HB2  ) (RESID  24 AND NAME HD21 )    3.5   1.1   1.1
ASSIGN (RESID  22 AND NAME HG   ) (RESID  22 AND NAME HD2* )    2.1   0.6   0.6
ASSIGN (RESID  22 AND NAME HG   ) (RESID  22 AND NAME HD1* )    2.4   0.7   0.7
ASSIGN (RESID  22 AND NAME HD1* ) (RESID  23 AND NAME HN   )    4.0   1.2   1.2
ASSIGN (RESID  23 AND NAME HN   ) (RESID  23 AND NAME HA2  )    2.1   0.6   0.6
ASSIGN (RESID  23 AND NAME HN   ) (RESID  24 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  23 AND NAME HA1  ) (RESID  23 AND NAME HA2  )    1.8   0.5   0.5
ASSIGN (RESID  23 AND NAME HA2  ) (RESID  24 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HB1  )    2.8   0.8   0.8
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  24 AND NAME HN   ) (RESID  24 AND NAME HD22 )    3.0   0.9   0.9
ASSIGN (RESID  24 AND NAME HN   ) (RESID  26 AND NAME HE*  )    3.3   1.0   1.0
ASSIGN (RESID  24 AND NAME HA   ) (RESID  24 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  24 AND NAME HA   ) (RESID  24 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  24 AND NAME HA   ) (RESID  25 AND NAME HN   )    1.9   0.6   0.6
ASSIGN (RESID  24 AND NAME HA   ) (RESID  25 AND NAME HG*  )    3.3   1.0   1.0
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  24 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  24 AND NAME HD21 )    2.8   0.8   0.8
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  25 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  24 AND NAME HB1  ) (RESID  26 AND NAME HE*  )    3.1   0.9   0.9
ASSIGN (RESID  24 AND NAME HB2  ) (RESID  24 AND NAME HD21 )    2.2   0.7   0.7
ASSIGN (RESID  24 AND NAME HB2  ) (RESID  24 AND NAME HD22 )    2.6   0.8   0.8
ASSIGN (RESID  24 AND NAME HB2  ) (RESID  26 AND NAME HE*  )    2.7   0.8   0.8
ASSIGN (RESID  24 AND NAME HD21 ) (RESID  24 AND NAME HD22 )    1.8   0.5   0.5
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HB1  )    2.4   0.7   0.7
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HG*  )    3.2   1.0   1.0
ASSIGN (RESID  25 AND NAME HN   ) (RESID  25 AND NAME HD*  )    3.1   0.9   0.9
ASSIGN (RESID  25 AND NAME HA   ) (RESID  25 AND NAME HB1  )    2.4   0.7   0.7
ASSIGN (RESID  25 AND NAME HA   ) (RESID  25 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  25 AND NAME HA   ) (RESID  25 AND NAME HG*  )    2.9   0.9   0.9
ASSIGN (RESID  25 AND NAME HA   ) (RESID  26 AND NAME HN   )    1.8   0.5   0.5
ASSIGN (RESID  25 AND NAME HB1  ) (RESID  26 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID  25 AND NAME HG*  ) (RESID  25 AND NAME HE*  )    3.4   1.0   1.0
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HB1  )    2.8   0.8   0.8
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HD*  )    2.6   0.8   0.8
ASSIGN (RESID  26 AND NAME HN   ) (RESID  26 AND NAME HE*  )    3.9   1.2   1.2
ASSIGN (RESID  26 AND NAME HA   ) (RESID  26 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  26 AND NAME HA   ) (RESID  26 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  26 AND NAME HA   ) (RESID  26 AND NAME HD*  )    2.7   0.8   0.8
ASSIGN (RESID  26 AND NAME HA   ) (RESID  27 AND NAME HN   )    1.8   0.5   0.5
ASSIGN (RESID  26 AND NAME HA   ) (RESID  28 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  26 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  26 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  27 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  26 AND NAME HB1  ) (RESID  28 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  26 AND NAME HB2  ) (RESID  26 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  27 AND NAME HN   )    3.4   1.0   1.0
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  30 AND NAME HB   )    2.8   0.8   0.8
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  30 AND NAME HG1  )    3.4   1.0   1.0
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  30 AND NAME HG2* )    3.8   1.1   1.1
ASSIGN (RESID  26 AND NAME HD*  ) (RESID  32 AND NAME HB*  )    4.1   1.2   1.2
ASSIGN (RESID  26 AND NAME HE*  ) (RESID  30 AND NAME HB   )    2.9   0.9   0.9
ASSIGN (RESID  26 AND NAME HE*  ) (RESID  30 AND NAME HG1  )    3.0   0.9   0.9
ASSIGN (RESID  26 AND NAME HE*  ) (RESID  30 AND NAME HG2* )    4.2   1.3   1.3
ASSIGN (RESID  26 AND NAME HE*  ) (RESID  32 AND NAME HB*  )    3.8   1.1   1.1
ASSIGN (RESID  27 AND NAME HN   ) (RESID  27 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  27 AND NAME HN   ) (RESID  27 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  27 AND NAME HN   ) (RESID  27 AND NAME HG1  )    2.5   0.8   0.8
ASSIGN (RESID  27 AND NAME HN   ) (RESID  27 AND NAME HG2  )    3.1   0.9   0.9
ASSIGN (RESID  27 AND NAME HN   ) (RESID  28 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  27 AND NAME HA   ) (RESID  27 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  27 AND NAME HA   ) (RESID  27 AND NAME HG2  )    2.6   0.8   0.8
ASSIGN (RESID  27 AND NAME HB1  ) (RESID  27 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  27 AND NAME HB2  ) (RESID  27 AND NAME HG1  )    2.0   0.6   0.6
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  28 AND NAME HN   ) (RESID  28 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  28 AND NAME HA   ) (RESID  28 AND NAME HB1  )    3.4   1.0   1.0
ASSIGN (RESID  28 AND NAME HA   ) (RESID  28 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  28 AND NAME HA   ) (RESID  29 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  28 AND NAME HB1  ) (RESID  28 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  28 AND NAME HB1  ) (RESID  29 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  29 AND NAME HN   ) (RESID  29 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  29 AND NAME HA   ) (RESID  29 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  29 AND NAME HA   ) (RESID  29 AND NAME HB2  )    3.0   0.9   0.9
ASSIGN (RESID  29 AND NAME HA   ) (RESID  30 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  29 AND NAME HA   ) (RESID  30 AND NAME HG2* )    3.6   1.1   1.1
ASSIGN (RESID  29 AND NAME HB1  ) (RESID  29 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  29 AND NAME HB1  ) (RESID  30 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  29 AND NAME HB1  ) (RESID  39 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  29 AND NAME HB1  ) (RESID  40 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  29 AND NAME HB2  ) (RESID  30 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HN   ) (RESID  30 AND NAME HG2* )    2.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HN   ) (RESID  40 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  30 AND NAME HA   ) (RESID  30 AND NAME HG1  )    2.0   0.6   0.6
ASSIGN (RESID  30 AND NAME HA   ) (RESID  30 AND NAME HG2* )    3.4   1.0   1.0
ASSIGN (RESID  30 AND NAME HB   ) (RESID  30 AND NAME HG1  )    2.1   0.6   0.6
ASSIGN (RESID  30 AND NAME HB   ) (RESID  30 AND NAME HG2* )    2.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HG1  ) (RESID  30 AND NAME HG2* )    3.3   1.0   1.0
ASSIGN (RESID  30 AND NAME HG1  ) (RESID  31 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HG1  ) (RESID  32 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  30 AND NAME HG1  ) (RESID  32 AND NAME HB*  )    3.2   1.0   1.0
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  31 AND NAME HN   )    3.8   1.1   1.1
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  32 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  32 AND NAME HB*  )    3.1   0.9   0.9
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  40 AND NAME HN   )    4.0   1.2   1.2
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  40 AND NAME HD1  )    3.5   1.1   1.1
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  40 AND NAME HE1  )    3.1   0.9   0.9
ASSIGN (RESID  30 AND NAME HG2* ) (RESID  40 AND NAME HZ2  )    3.5   1.1   1.1
ASSIGN (RESID  31 AND NAME HN   ) (RESID  31 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID  31 AND NAME HN   ) (RESID  32 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  31 AND NAME HA   ) (RESID  31 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  31 AND NAME HA   ) (RESID  31 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  31 AND NAME HA   ) (RESID  40 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  31 AND NAME HA   ) (RESID  40 AND NAME HD1  )    2.0   0.6   0.6
ASSIGN (RESID  31 AND NAME HA   ) (RESID  40 AND NAME HE1  )    3.0   0.9   0.9
ASSIGN (RESID  31 AND NAME HB1  ) (RESID  31 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  31 AND NAME HB1  ) (RESID  39 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  32 AND NAME HN   ) (RESID  32 AND NAME HB*  )    2.5   0.8   0.8
ASSIGN (RESID  32 AND NAME HN   ) (RESID  40 AND NAME HE1  )    3.1   0.9   0.9
ASSIGN (RESID  32 AND NAME HA   ) (RESID  32 AND NAME HB*  )    2.5   0.8   0.8
ASSIGN (RESID  32 AND NAME HA   ) (RESID  33 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  32 AND NAME HA   ) (RESID  34 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  32 AND NAME HB*  ) (RESID  33 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  32 AND NAME HB*  ) (RESID  40 AND NAME HE1  )    3.8   1.1   1.1
ASSIGN (RESID  33 AND NAME HN   ) (RESID  33 AND NAME HA2  )    2.3   0.7   0.7
ASSIGN (RESID  33 AND NAME HN   ) (RESID  34 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  33 AND NAME HA1  ) (RESID  33 AND NAME HA2  )    1.8   0.5   0.5
ASSIGN (RESID  33 AND NAME HA2  ) (RESID  34 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HG1  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HN   ) (RESID  34 AND NAME HG2  )    3.0   0.9   0.9
ASSIGN (RESID  34 AND NAME HA   ) (RESID  34 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  34 AND NAME HA   ) (RESID  34 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HA   ) (RESID  35 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HB1  ) (RESID  34 AND NAME HG1  )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HB1  ) (RESID  34 AND NAME HG2  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HB1  ) (RESID  34 AND NAME HE   )    2.4   0.7   0.7
ASSIGN (RESID  34 AND NAME HB1  ) (RESID  36 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HB2  ) (RESID  34 AND NAME HG1  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HB2  ) (RESID  34 AND NAME HG2  )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HB2  ) (RESID  34 AND NAME HD1  )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HB2  ) (RESID  34 AND NAME HE   )    2.8   0.8   0.8
ASSIGN (RESID  34 AND NAME HB2  ) (RESID  36 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  34 AND NAME HG1  ) (RESID  34 AND NAME HD1  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HG1  ) (RESID  34 AND NAME HD2  )    2.2   0.7   0.7
ASSIGN (RESID  34 AND NAME HG1  ) (RESID  40 AND NAME HD1  )    2.9   0.9   0.9
ASSIGN (RESID  34 AND NAME HG1  ) (RESID  40 AND NAME HE1  )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HG2  ) (RESID  34 AND NAME HD1  )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HG2  ) (RESID  34 AND NAME HD2  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HG2  ) (RESID  40 AND NAME HD1  )    2.9   0.9   0.9
ASSIGN (RESID  34 AND NAME HG2  ) (RESID  40 AND NAME HE1  )    3.3   1.0   1.0
ASSIGN (RESID  34 AND NAME HD1  ) (RESID  34 AND NAME HD2  )    1.8   0.5   0.5
ASSIGN (RESID  34 AND NAME HD1  ) (RESID  34 AND NAME HE   )    2.3   0.7   0.7
ASSIGN (RESID  34 AND NAME HD1  ) (RESID  38 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HD1  ) (RESID  39 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HD2  ) (RESID  34 AND NAME HE   )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HD2  ) (RESID  34 AND NAME HH*  )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HD2  ) (RESID  40 AND NAME HD1  )    2.5   0.8   0.8
ASSIGN (RESID  34 AND NAME HE   ) (RESID  34 AND NAME HH*  )    3.7   1.1   1.1
ASSIGN (RESID  34 AND NAME HE   ) (RESID  38 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  34 AND NAME HE   ) (RESID  38 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  34 AND NAME HE   ) (RESID  55 AND NAME HE*  )    3.2   1.0   1.0
ASSIGN (RESID  34 AND NAME HH*  ) (RESID  55 AND NAME HE*  )    3.9   1.2   1.2
ASSIGN (RESID  34 AND NAME HH*  ) (RESID  55 AND NAME HZ   )    3.5   1.1   1.1
ASSIGN (RESID  35 AND NAME HN   ) (RESID  36 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  35 AND NAME HB1  ) (RESID  35 AND NAME HB2  )    1.9   0.6   0.6
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  36 AND NAME HN   ) (RESID  36 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  36 AND NAME HN   ) (RESID  37 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID  36 AND NAME HA   ) (RESID  36 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  36 AND NAME HA   ) (RESID  36 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  36 AND NAME HA   ) (RESID  37 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  36 AND NAME HB1  ) (RESID  36 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  36 AND NAME HB1  ) (RESID  37 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  37 AND NAME HN   ) (RESID  37 AND NAME HA1  )    2.4   0.7   0.7
ASSIGN (RESID  37 AND NAME HN   ) (RESID  37 AND NAME HA2  )    2.0   0.6   0.6
ASSIGN (RESID  37 AND NAME HN   ) (RESID  38 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  37 AND NAME HA1  ) (RESID  37 AND NAME HA2  )    1.8   0.5   0.5
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HB1  )    2.8   0.8   0.8
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HG1  )    2.4   0.7   0.7
ASSIGN (RESID  38 AND NAME HN   ) (RESID  38 AND NAME HG2  )    2.5   0.8   0.8
ASSIGN (RESID  38 AND NAME HA   ) (RESID  38 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  38 AND NAME HA   ) (RESID  38 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  38 AND NAME HB1  ) (RESID  38 AND NAME HG1  )    2.2   0.7   0.7
ASSIGN (RESID  38 AND NAME HB1  ) (RESID  55 AND NAME HD*  )    2.9   0.9   0.9
ASSIGN (RESID  38 AND NAME HB1  ) (RESID  55 AND NAME HE*  )    2.9   0.9   0.9
ASSIGN (RESID  38 AND NAME HB2  ) (RESID  38 AND NAME HG1  )    2.4   0.7   0.7
ASSIGN (RESID  38 AND NAME HB2  ) (RESID  38 AND NAME HG2  )    2.3   0.7   0.7
ASSIGN (RESID  38 AND NAME HB2  ) (RESID  55 AND NAME HD*  )    3.5   1.1   1.1
ASSIGN (RESID  38 AND NAME HB2  ) (RESID  55 AND NAME HE*  )    2.9   0.9   0.9
ASSIGN (RESID  38 AND NAME HG2  ) (RESID  55 AND NAME HE*  )    3.1   0.9   0.9
ASSIGN (RESID  38 AND NAME HG2  ) (RESID  55 AND NAME HZ   )    3.3   1.0   1.0
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  39 AND NAME HN   ) (RESID  39 AND NAME HG*  )    3.2   1.0   1.0
ASSIGN (RESID  39 AND NAME HN   ) (RESID  59 AND NAME HE22 )    3.0   0.9   0.9
ASSIGN (RESID  39 AND NAME HA   ) (RESID  39 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  39 AND NAME HA   ) (RESID  39 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  39 AND NAME HA   ) (RESID  40 AND NAME HN   )    1.9   0.6   0.6
ASSIGN (RESID  39 AND NAME HA   ) (RESID  40 AND NAME HD1  )    2.2   0.7   0.7
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  39 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  39 AND NAME HG*  )    2.6   0.8   0.8
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  40 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  39 AND NAME HB1  ) (RESID  56 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  39 AND NAME HG*  )    2.6   0.8   0.8
ASSIGN (RESID  39 AND NAME HB2  ) (RESID  56 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  40 AND NAME HN   ) (RESID  40 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  40 AND NAME HN   ) (RESID  40 AND NAME HD1  )    2.4   0.7   0.7
ASSIGN (RESID  40 AND NAME HA   ) (RESID  40 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  40 AND NAME HA   ) (RESID  40 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HA   ) (RESID  41 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HA   ) (RESID  55 AND NAME HA   )    2.0   0.6   0.6
ASSIGN (RESID  40 AND NAME HA   ) (RESID  55 AND NAME HD*  )    3.4   1.0   1.0
ASSIGN (RESID  40 AND NAME HA   ) (RESID  56 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  40 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  40 AND NAME HD1  )    2.6   0.8   0.8
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  40 AND NAME HE3  )    2.9   0.9   0.9
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  41 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  53 AND NAME HE3  )    2.6   0.8   0.8
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  55 AND NAME HA   )    2.7   0.8   0.8
ASSIGN (RESID  40 AND NAME HB1  ) (RESID  55 AND NAME HD*  )    2.7   0.8   0.8
ASSIGN (RESID  40 AND NAME HB2  ) (RESID  40 AND NAME HE3  )    2.7   0.8   0.8
ASSIGN (RESID  40 AND NAME HB2  ) (RESID  41 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  40 AND NAME HD1  ) (RESID  40 AND NAME HE1  )    2.2   0.7   0.7
ASSIGN (RESID  40 AND NAME HE1  ) (RESID  40 AND NAME HZ2  )    2.4   0.7   0.7
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  40 AND NAME HZ3  )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  41 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  53 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  53 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  53 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  53 AND NAME HE3  )    2.9   0.9   0.9
ASSIGN (RESID  40 AND NAME HE3  ) (RESID  54 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  40 AND NAME HZ2  ) (RESID  40 AND NAME HH2  )    1.9   0.6   0.6
ASSIGN (RESID  40 AND NAME HZ3  ) (RESID  40 AND NAME HH2  )    2.3   0.7   0.7
ASSIGN (RESID  40 AND NAME HZ3  ) (RESID  42 AND NAME HA   )    3.2   1.0   1.0
ASSIGN (RESID  40 AND NAME HZ3  ) (RESID  42 AND NAME HB*  )    3.0   0.9   0.9
ASSIGN (RESID  40 AND NAME HZ3  ) (RESID  47 AND NAME HD*  )    3.0   0.9   0.9
ASSIGN (RESID  40 AND NAME HZ3  ) (RESID  47 AND NAME HE*  )    3.3   1.0   1.0
ASSIGN (RESID  41 AND NAME HN   ) (RESID  41 AND NAME HA   )    2.3   0.7   0.7
ASSIGN (RESID  41 AND NAME HN   ) (RESID  53 AND NAME HE3  )    2.8   0.8   0.8
ASSIGN (RESID  41 AND NAME HN   ) (RESID  54 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  41 AND NAME HN   ) (RESID  55 AND NAME HA   )    2.8   0.8   0.8
ASSIGN (RESID  41 AND NAME HA   ) (RESID  41 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  41 AND NAME HA   ) (RESID  41 AND NAME HB2  )    2.1   0.6   0.6
ASSIGN (RESID  41 AND NAME HA   ) (RESID  42 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID  41 AND NAME HB2  ) (RESID  42 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  42 AND NAME HN   ) (RESID  42 AND NAME HB*  )    2.6   0.8   0.8
ASSIGN (RESID  42 AND NAME HA   ) (RESID  42 AND NAME HB*  )    2.4   0.7   0.7
ASSIGN (RESID  42 AND NAME HA   ) (RESID  43 AND NAME HG2* )    3.7   1.1   1.1
ASSIGN (RESID  42 AND NAME HA   ) (RESID  53 AND NAME HA   )    2.1   0.6   0.6
ASSIGN (RESID  42 AND NAME HA   ) (RESID  54 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  42 AND NAME HB*  ) (RESID  47 AND NAME HN   )    3.6   1.1   1.1
ASSIGN (RESID  42 AND NAME HB*  ) (RESID  47 AND NAME HB1  )    3.2   1.0   1.0
ASSIGN (RESID  42 AND NAME HB*  ) (RESID  47 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  42 AND NAME HB*  ) (RESID  47 AND NAME HD*  )    3.2   1.0   1.0
ASSIGN (RESID  43 AND NAME HN   ) (RESID  43 AND NAME HG2* )    2.8   0.8   0.8
ASSIGN (RESID  43 AND NAME HN   ) (RESID  53 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  43 AND NAME HA   ) (RESID  43 AND NAME HG2* )    2.4   0.7   0.7
ASSIGN (RESID  43 AND NAME HB   ) (RESID  43 AND NAME HG2* )    2.4   0.7   0.7
ASSIGN (RESID  43 AND NAME HG1  ) (RESID  43 AND NAME HG2* )    3.0   0.9   0.9
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  53 AND NAME HA   )    2.8   0.8   0.8
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  54 AND NAME HN   )    3.5   1.1   1.1
ASSIGN (RESID  43 AND NAME HG2* ) (RESID  54 AND NAME HA*  )    3.9   1.2   1.2
ASSIGN (RESID  44 AND NAME HN   ) (RESID  44 AND NAME HG2* )    3.2   1.0   1.0
ASSIGN (RESID  44 AND NAME HN   ) (RESID  45 AND NAME HN   )    3.5   1.1   1.1
ASSIGN (RESID  44 AND NAME HB   ) (RESID  46 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  44 AND NAME HG2* ) (RESID  45 AND NAME HN   )    3.6   1.1   1.1
ASSIGN (RESID  44 AND NAME HG2* ) (RESID  50 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  44 AND NAME HG2* ) (RESID  50 AND NAME HB2  )    3.2   1.0   1.0
ASSIGN (RESID  44 AND NAME HG2* ) (RESID  52 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  45 AND NAME HN   ) (RESID  45 AND NAME HB*  )    2.4   0.7   0.7
ASSIGN (RESID  45 AND NAME HN   ) (RESID  46 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  45 AND NAME HA   ) (RESID  45 AND NAME HB*  )    2.3   0.7   0.7
ASSIGN (RESID  45 AND NAME HA   ) (RESID  46 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  45 AND NAME HB*  ) (RESID  46 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  46 AND NAME HN   ) (RESID  46 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  46 AND NAME HN   ) (RESID  46 AND NAME HB1  )    2.6   0.8   0.8
ASSIGN (RESID  46 AND NAME HN   ) (RESID  46 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  46 AND NAME HN   ) (RESID  47 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  46 AND NAME HA   ) (RESID  46 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  46 AND NAME HA   ) (RESID  46 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  46 AND NAME HB1  ) (RESID  46 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  46 AND NAME HB1  ) (RESID  46 AND NAME HD21 )    2.7   0.8   0.8
ASSIGN (RESID  46 AND NAME HB1  ) (RESID  49 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  46 AND NAME HB2  ) (RESID  46 AND NAME HD22 )    2.5   0.8   0.8
ASSIGN (RESID  46 AND NAME HB2  ) (RESID  46 AND NAME HD21 )    2.3   0.7   0.7
ASSIGN (RESID  46 AND NAME HD21 ) (RESID  46 AND NAME HD22 )    1.8   0.5   0.5
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  47 AND NAME HN   ) (RESID  47 AND NAME HD*  )    3.5   1.1   1.1
ASSIGN (RESID  47 AND NAME HN   ) (RESID  48 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  47 AND NAME HA   ) (RESID  47 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  47 AND NAME HA   ) (RESID  51 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  47 AND NAME HB1  ) (RESID  47 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  47 AND NAME HB1  ) (RESID  48 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID  47 AND NAME HB2  ) (RESID  47 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  47 AND NAME HD*  ) (RESID  47 AND NAME HE*  )    2.3   0.7   0.7
ASSIGN (RESID  47 AND NAME HD*  ) (RESID  51 AND NAME HA   )    3.1   0.9   0.9
ASSIGN (RESID  47 AND NAME HD*  ) (RESID  52 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  51 AND NAME HA   )    3.3   1.0   1.0
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  51 AND NAME HB1  )    3.3   1.0   1.0
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  51 AND NAME HG2  )    3.4   1.0   1.0
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  51 AND NAME HD*  )    3.8   1.1   1.1
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  52 AND NAME HA   )    3.6   1.1   1.1
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  53 AND NAME HA   )    3.5   1.1   1.1
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  53 AND NAME HB1  )    2.4   0.7   0.7
ASSIGN (RESID  47 AND NAME HE*  ) (RESID  53 AND NAME HB2  )    3.0   0.9   0.9
ASSIGN (RESID  48 AND NAME HN   ) (RESID  48 AND NAME HA   )    2.1   0.6   0.6
ASSIGN (RESID  48 AND NAME HN   ) (RESID  48 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  48 AND NAME HA   ) (RESID  48 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  48 AND NAME HA   ) (RESID  49 AND NAME HN   )    3.1   0.9   0.9
ASSIGN (RESID  48 AND NAME HB1  ) (RESID  48 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  48 AND NAME HB1  ) (RESID  49 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  48 AND NAME HB2  ) (RESID  49 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HB1  )    2.7   0.8   0.8
ASSIGN (RESID  49 AND NAME HN   ) (RESID  49 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  49 AND NAME HA   ) (RESID  49 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  49 AND NAME HB1  ) (RESID  49 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  49 AND NAME HB1  ) (RESID  50 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  49 AND NAME HB2  ) (RESID  50 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HA   )    2.5   0.8   0.8
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HB1  )    2.8   0.8   0.8
ASSIGN (RESID  50 AND NAME HN   ) (RESID  50 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  50 AND NAME HN   ) (RESID  51 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID  50 AND NAME HA   ) (RESID  50 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  50 AND NAME HA   ) (RESID  50 AND NAME HB2  )    2.6   0.8   0.8
ASSIGN (RESID  50 AND NAME HA   ) (RESID  51 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  50 AND NAME HB1  ) (RESID  50 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  50 AND NAME HB2  ) (RESID  51 AND NAME HN   )    2.9   0.9   0.9
ASSIGN (RESID  50 AND NAME HB2  ) (RESID  52 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HA   )    1.9   0.6   0.6
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HB2  )    2.7   0.8   0.8
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HG1  )    2.8   0.8   0.8
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HG2  )    2.8   0.8   0.8
ASSIGN (RESID  51 AND NAME HN   ) (RESID  51 AND NAME HD*  )    3.3   1.0   1.0
ASSIGN (RESID  51 AND NAME HN   ) (RESID  52 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HG2  )    2.3   0.7   0.7
ASSIGN (RESID  51 AND NAME HA   ) (RESID  51 AND NAME HD*  )    3.3   1.0   1.0
ASSIGN (RESID  51 AND NAME HA   ) (RESID  52 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  51 AND NAME HB1  ) (RESID  51 AND NAME HG2  )    2.1   0.6   0.6
ASSIGN (RESID  51 AND NAME HB2  ) (RESID  51 AND NAME HG2  )    2.2   0.7   0.7
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HA   )    2.4   0.7   0.7
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HB1  )    3.2   1.0   1.0
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HB2  )    2.2   0.7   0.7
ASSIGN (RESID  52 AND NAME HN   ) (RESID  52 AND NAME HG1  )    2.6   0.8   0.8
ASSIGN (RESID  52 AND NAME HN   ) (RESID  53 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HB1  )    2.2   0.7   0.7
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HB2  )    2.5   0.8   0.8
ASSIGN (RESID  52 AND NAME HA   ) (RESID  52 AND NAME HG1  )    2.5   0.8   0.8
ASSIGN (RESID  52 AND NAME HA   ) (RESID  53 AND NAME HN   )    1.9   0.6   0.6
ASSIGN (RESID  52 AND NAME HB1  ) (RESID  53 AND NAME HN   )    2.8   0.8   0.8
ASSIGN (RESID  53 AND NAME HN   ) (RESID  53 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  53 AND NAME HN   ) (RESID  53 AND NAME HB1  )    3.1   0.9   0.9
ASSIGN (RESID  53 AND NAME HA   ) (RESID  53 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  53 AND NAME HA   ) (RESID  53 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  53 AND NAME HA   ) (RESID  53 AND NAME HE3  )    3.1   0.9   0.9
ASSIGN (RESID  53 AND NAME HA   ) (RESID  54 AND NAME HN   )    2.3   0.7   0.7
ASSIGN (RESID  53 AND NAME HB1  ) (RESID  53 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  53 AND NAME HB1  ) (RESID  53 AND NAME HD1  )    2.8   0.8   0.8
ASSIGN (RESID  53 AND NAME HB1  ) (RESID  53 AND NAME HE3  )    2.7   0.8   0.8
ASSIGN (RESID  53 AND NAME HB1  ) (RESID  54 AND NAME HN   )    2.7   0.8   0.8
ASSIGN (RESID  53 AND NAME HB2  ) (RESID  53 AND NAME HE3  )    2.4   0.7   0.7
ASSIGN (RESID  53 AND NAME HB2  ) (RESID  54 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  53 AND NAME HE3  ) (RESID  53 AND NAME HZ3  )    2.2   0.7   0.7
ASSIGN (RESID  53 AND NAME HE3  ) (RESID  54 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  53 AND NAME HZ2  ) (RESID  53 AND NAME HH2  )    2.0   0.6   0.6
ASSIGN (RESID  53 AND NAME HZ3  ) (RESID  53 AND NAME HH2  )    2.1   0.6   0.6
ASSIGN (RESID  53 AND NAME HH2  ) (RESID  55 AND NAME HE*  )    2.9   0.9   0.9
ASSIGN (RESID  53 AND NAME HH2  ) (RESID  55 AND NAME HZ   )    2.5   0.8   0.8
ASSIGN (RESID  54 AND NAME HN   ) (RESID  54 AND NAME HA*  )    2.9   0.9   0.9
ASSIGN (RESID  54 AND NAME HA*  ) (RESID  55 AND NAME HN   )    2.5   0.8   0.8
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HA   )    2.6   0.8   0.8
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HB1  )    2.6   0.8   0.8
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  55 AND NAME HN   ) (RESID  55 AND NAME HD*  )    2.9   0.9   0.9
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HB1  )    2.4   0.7   0.7
ASSIGN (RESID  55 AND NAME HA   ) (RESID  55 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  55 AND NAME HA   ) (RESID  56 AND NAME HN   )    2.0   0.6   0.6
ASSIGN (RESID  55 AND NAME HB1  ) (RESID  55 AND NAME HD*  )    2.4   0.7   0.7
ASSIGN (RESID  55 AND NAME HB1  ) (RESID  55 AND NAME HE*  )    4.0   1.2   1.2
ASSIGN (RESID  55 AND NAME HB1  ) (RESID  56 AND NAME HN   )    2.6   0.8   0.8
ASSIGN (RESID  55 AND NAME HB2  ) (RESID  55 AND NAME HD*  )    2.5   0.8   0.8
ASSIGN (RESID  55 AND NAME HD*  ) (RESID  56 AND NAME HN   )    3.2   1.0   1.0
ASSIGN (RESID  56 AND NAME HN   ) (RESID  56 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  56 AND NAME HA   ) (RESID  56 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  56 AND NAME HA   ) (RESID  56 AND NAME HB2  )    2.9   0.9   0.9
ASSIGN (RESID  56 AND NAME HA   ) (RESID  57 AND NAME HD2  )    3.1   0.9   0.9
ASSIGN (RESID  56 AND NAME HB1  ) (RESID  56 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  57 AND NAME HA   ) (RESID  57 AND NAME HB*  )    2.1   0.6   0.6
ASSIGN (RESID  57 AND NAME HA   ) (RESID  57 AND NAME HG2  )    2.5   0.8   0.8
ASSIGN (RESID  57 AND NAME HA   ) (RESID  58 AND NAME HN   )    2.1   0.6   0.6
ASSIGN (RESID  57 AND NAME HB*  ) (RESID  57 AND NAME HD1  )    3.5   1.1   1.1
ASSIGN (RESID  57 AND NAME HB*  ) (RESID  58 AND NAME HN   )    3.0   0.9   0.9
ASSIGN (RESID  57 AND NAME HG2  ) (RESID  57 AND NAME HD2  )    2.1   0.6   0.6
ASSIGN (RESID  57 AND NAME HG2  ) (RESID  57 AND NAME HD1  )    2.3   0.7   0.7
ASSIGN (RESID  57 AND NAME HG2  ) (RESID  58 AND NAME HN   )    2.4   0.7   0.7
ASSIGN (RESID  57 AND NAME HD2  ) (RESID  57 AND NAME HD1  )    2.3   0.7   0.7
ASSIGN (RESID  58 AND NAME HN   ) (RESID  58 AND NAME HB1  )    2.5   0.8   0.8
ASSIGN (RESID  58 AND NAME HN   ) (RESID  58 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  58 AND NAME HA   ) (RESID  58 AND NAME HB1  )    2.3   0.7   0.7
ASSIGN (RESID  58 AND NAME HA   ) (RESID  59 AND NAME HN   )    2.2   0.7   0.7
ASSIGN (RESID  59 AND NAME HN   ) (RESID  59 AND NAME HB2  )    2.3   0.7   0.7
ASSIGN (RESID  59 AND NAME HN   ) (RESID  59 AND NAME HG*  )    2.7   0.8   0.8
ASSIGN (RESID  59 AND NAME HA   ) (RESID  59 AND NAME HB1  )    2.1   0.6   0.6
ASSIGN (RESID  59 AND NAME HA   ) (RESID  59 AND NAME HB2  )    2.4   0.7   0.7
ASSIGN (RESID  59 AND NAME HA   ) (RESID  59 AND NAME HG*  )    2.8   0.8   0.8
ASSIGN (RESID  59 AND NAME HB1  ) (RESID  59 AND NAME HB2  )    1.8   0.5   0.5
ASSIGN (RESID  59 AND NAME HB2  ) (RESID  59 AND NAME HG*  )    1.9   0.6   0.6
ASSIGN (RESID  59 AND NAME HG*  ) (RESID  59 AND NAME HE21 )    2.8   0.8   0.8
ASSIGN (RESID  59 AND NAME HG*  ) (RESID  59 AND NAME HE22 )    3.5   1.1   1.1
ASSIGN (RESID  59 AND NAME HE21 ) (RESID  59 AND NAME HE22 )    1.8   0.5   0.5
!hbonds
ASSIGN (RESID  19 AND NAME HN   ) (RESID  26 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  19 AND NAME N    ) (RESID  26 AND NAME O    )    2.9   0.5   0.5
ASSIGN (RESID  26 AND NAME HN   ) (RESID  19 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  26 AND NAME N    ) (RESID  19 AND NAME O    )    2.9   0.5   0.5
ASSIGN (RESID  21 AND NAME HN   ) (RESID  24 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  21 AND NAME N    ) (RESID  24 AND NAME O    )    2.9   0.5   0.5
ASSIGN (RESID  24 AND NAME HN   ) (RESID  21 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  24 AND NAME N    ) (RESID  21 AND NAME O    )    2.9   0.5   0.5
ASSIGN (RESID  41 AND NAME HN   ) (RESID  54 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  41 AND NAME N    ) (RESID  54 AND NAME O    )    2.9   0.5   0.5
ASSIGN (RESID  54 AND NAME HN   ) (RESID  41 AND NAME O    )    2.0   0.4   0.4
ASSIGN (RESID  54 AND NAME N    ) (RESID  41 AND NAME O    )    2.9   0.5   0.5


!side chain chi1 from hnhb and ecosy
assign (resid 9 and name n) (resid 9 and name ca)
       (resid 9 and name cb) (resid 9 and name cg) 1 60.0 30.0 2
assign (resid 15 and name n) (resid 15 and name ca)
       (resid 15 and name cb) (resid 15 and name sg) 1 -60.0 30.0 2
assign (resid 17 and name n) (resid 17 and name ca)
       (resid 17 and name cb) (resid 17 and name cg) 1 -60.0 30.0 2
assign (resid 19 and name n) (resid 19 and name ca)
       (resid 19 and name cb) (resid 19 and name cg) 1 60.0 30.0 2
assign (resid 21 and name n) (resid 21 and name ca)
       (resid 21 and name cb) (resid 21 and name cg) 1 180.0 30.0 2
assign (resid 22 and name n) (resid 22 and name ca)
       (resid 22 and name cb) (resid 22 and name cg) 1 -60.0 30.0 2
assign (resid 24 and name n) (resid 24 and name ca)
       (resid 24 and name cb) (resid 24 and name cg) 1 -60.0 30.0 2
assign (resid 25 and name n) (resid 25 and name ca)
       (resid 25 and name cb) (resid 25 and name cg) 1 -60.0 30.0 2
assign (resid 26 and name n) (resid 26 and name ca)
       (resid 26 and name cb) (resid 26 and name cg) 1 -60.0 30.0 2
assign (resid 27 and name n) (resid 27 and name ca)
       (resid 27 and name cb) (resid 27 and name cg) 1 -60.0 30.0 2
assign (resid 28 and name n) (resid 28 and name ca)
       (resid 28 and name cb) (resid 28 and name og) 1 60.0 30.0 2
assign (resid 29 and name n) (resid 29 and name ca)
       (resid 29 and name cb) (resid 29 and name sg) 1 -60.0 30.0 2
assign (resid 31 and name n) (resid 31 and name ca)
       (resid 31 and name cb) (resid 31 and name og) 1 60.0 30.0 2
assign (resid 34 and name n) (resid 34 and name ca)
       (resid 34 and name cb) (resid 34 and name cg) 1 -60.0 30.0 2
assign (resid 36 and name n) (resid 36 and name ca)
       (resid 36 and name cb) (resid 36 and name cg) 1 60.0 30.0 2
assign (resid 38 and name n) (resid 38 and name ca)
       (resid 38 and name cb) (resid 38 and name cg) 1 -60.0 30.0 2
assign (resid 39 and name n) (resid 39 and name ca)
       (resid 39 and name cb) (resid 39 and name cg) 1 -60.0 30.0 2
assign (resid 40 and name n) (resid 40 and name ca)
       (resid 40 and name cb) (resid 40 and name cg) 1 60.0 30.0 2
assign (resid 41 and name n) (resid 41 and name ca)
       (resid 41 and name cb) (resid 41 and name sg) 1 60.0 30.0 2
assign (resid 46 and name n) (resid 46 and name ca)
       (resid 46 and name cb) (resid 46 and name cg) 1 180.0 30.0 2
assign (resid 47 and name n) (resid 47 and name ca)
       (resid 47 and name cb) (resid 47 and name cg) 1 180.0 30.0 2
assign (resid 48 and name n) (resid 48 and name ca)
       (resid 48 and name cb) (resid 48 and name cg) 1 -60.0 30.0 2
assign (resid 49 and name n) (resid 49 and name ca)
       (resid 49 and name cb) (resid 49 and name cg) 1 -60.0 30.0 2
assign (resid 50 and name n) (resid 50 and name ca)
       (resid 50 and name cb) (resid 50 and name cg) 1 -60.0 30.0 2
assign (resid 51 and name n) (resid 51 and name ca)
       (resid 51 and name cb) (resid 51 and name cg) 1 -60.0 30.0 2
assign (resid 52 and name n) (resid 52 and name ca)
       (resid 52 and name cb) (resid 52 and name cg) 1 -60.0 30.0 2
assign (resid 53 and name n) (resid 53 and name ca)
       (resid 53 and name cb) (resid 53 and name cg) 1 60.0 30.0 2
assign (resid 55 and name n) (resid 55 and name ca)
       (resid 55 and name cb) (resid 55 and name cg) 1 -60.0 30.0 2


!ha cis to following n (from hnhb)
assign (resid 45 and name n) (resid 45 and name ca)
       (resid 45 and name c) (resid 46 and name n) 1 -60.0 40.0 2
assign (resid 47 and name n) (resid 47 and name ca)
       (resid 47 and name c) (resid 48 and name n) 1 -60.0 40.0 2
assign (resid 48 and name n) (resid 48 and name ca)
       (resid 48 and name c) (resid 49 and name n) 1 -60.0 40.0 2
assign (resid 50 and name n) (resid 50 and name ca)
       (resid 50 and name c) (resid 51 and name n) 1 -60.0 40.0 2



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER   1           1H       SER   1   8.784   6.343   9.237
    2    HA   SER   1           HA       SER   1   8.273   4.022   8.898
    3   1HB   SER   1          1HB       SER   1   7.609   3.364   6.570
    4   2HB   SER   1          2HB       SER   1   6.361   4.276   7.418
    5    HG   SER   1           HG       SER   1   6.424   5.448   5.660
    6    H    TRP   2           H        TRP   2   9.456   6.215   6.340
    7    HA   TRP   2           HA       TRP   2  11.448   6.411   5.265
    8   1HB   TRP   2          1HB       TRP   2  12.147   6.573   7.766
    9   2HB   TRP   2          2HB       TRP   2  12.765   4.942   7.547
   10    HD1  TRP   2           HD1      TRP   2  14.596   4.796   5.309
   11    HE1  TRP   2           1HE      TRP   2  16.536   6.423   4.831
   12    HE3  TRP   2           3HE      TRP   2  12.998   8.783   8.070
   13    HZ2  TRP   2           2HZ      TRP   2  17.292   9.035   5.550
   14    HZ3  TRP   2           3HZ      TRP   2  14.399  10.799   8.141
   15    HH2  TRP   2           HH2      TRP   2  16.503  10.922   6.903
   16    H    MET   3           H        MET   3   9.819   4.216   4.607
   17    HA   MET   3           HA       MET   3  11.853   2.245   3.847
   18   1HB   MET   3          1HB       MET   3   8.988   1.732   4.659
   19   2HB   MET   3          2HB       MET   3  10.084   0.521   4.023
   20   1HG   MET   3          1HG       MET   3  11.553   0.815   5.935
   21   2HG   MET   3          2HG       MET   3  10.493   2.073   6.563
   22   1HE   MET   3          1HE       MET   3  10.797   0.825   8.670
   23   2HE   MET   3          2HE       MET   3   9.735  -0.474   9.203
   24   3HE   MET   3          3HE       MET   3  11.243  -0.855   8.369
   25    H    SER   4           H        SER   4  12.019   1.908   1.728
   26    HA   SER   4           HA       SER   4  10.150   3.191  -0.076
   27   1HB   SER   4          1HB       SER   4  12.588   1.509  -0.704
   28   2HB   SER   4          2HB       SER   4  11.706   2.529  -1.840
   29    HG   SER   4           HG       SER   4  12.514   3.866   0.419
   30    H    THR   5           H        THR   5   9.168   1.950  -1.892
   31    HA   THR   5           HA       THR   5   8.168  -0.571  -0.865
   32    HB   THR   5           HB       THR   5   6.586  -0.300  -2.869
   33    HG1  THR   5           1HG      THR   5   7.353   1.230  -4.109
   34   1HG2  THR   5          1HG2      THR   5   5.219   1.409  -1.726
   35   2HG2  THR   5          2HG2      THR   5   5.766   0.106  -0.670
   36   3HG2  THR   5          3HG2      THR   5   6.560   1.681  -0.615
   37    H    VAL   6           H        VAL   6   7.654  -2.247  -2.344
   38    HA   VAL   6           HA       VAL   6   9.548  -2.706  -4.520
   39    HB   VAL   6           HB       VAL   6  10.494  -4.292  -3.213
   40   1HG1  VAL   6          1HG1      VAL   6   8.807  -3.262  -1.316
   41   2HG1  VAL   6          2HG1      VAL   6   8.440  -4.986  -1.293
   42   3HG1  VAL   6          3HG1      VAL   6  10.094  -4.430  -1.026
   43   1HG2  VAL   6          1HG2      VAL   6   8.519  -5.539  -4.561
   44   2HG2  VAL   6          2HG2      VAL   6   9.740  -6.367  -3.593
   45   3HG2  VAL   6          3HG2      VAL   6   8.159  -6.018  -2.900
   46    H    GLY   7           H        GLY   7   8.421  -4.434  -6.051
   47   1HA   GLY   7          1HA       GLY   7   6.433  -5.070  -7.150
   48   2HA   GLY   7          2HA       GLY   7   5.655  -4.919  -5.602
   49    H    GLY   8           H        GLY   8   3.806  -3.944  -6.395
   50   1HA   GLY   8          1HA       GLY   8   2.453  -2.244  -7.148
   51   2HA   GLY   8          2HA       GLY   8   3.554  -1.241  -6.228
   52    H    ASN   9           H        ASN   9   3.638   0.544  -7.493
   53    HA   ASN   9           HA       ASN   9   5.143   0.324  -9.941
   54   1HB   ASN   9          1HB       ASN   9   3.505   1.487 -11.363
   55   2HB   ASN   9          2HB       ASN   9   2.919  -0.074 -10.826
   56   1HD2  ASN   9          1HD2      ASN   9   1.074   2.465  -8.438
   57   2HD2  ASN   9          2HD2      ASN   9   2.690   1.892  -8.250
   58    H    SER  10           H        SER  10   5.042   1.706  -7.184
   59    HA   SER  10           HA       SER  10   4.975   4.506  -7.773
   60   1HB   SER  10          1HB       SER  10   6.172   4.455  -5.408
   61   2HB   SER  10          2HB       SER  10   4.448   4.140  -5.543
   62    HG   SER  10           HG       SER  10   5.723   2.583  -4.279
   63    H    GLY  11           H        GLY  11   7.450   2.043  -7.386
   64   1HA   GLY  11          1HA       GLY  11   9.540   2.124  -8.515
   65   2HA   GLY  11          2HA       GLY  11   9.388   3.875  -8.605
   66    H    GLY  12           H        GLY  12   8.561   2.510  -5.606
   67   1HA   GLY  12          1HA       GLY  12  10.043   2.009  -3.773
   68   2HA   GLY  12          2HA       GLY  12  11.262   3.010  -4.553
   69    H    ALA  13           H        ALA  13   7.841   3.640  -3.822
   70    HA   ALA  13           HA       ALA  13   8.674   6.119  -2.493
   71   1HB   ALA  13          1HB       ALA  13   6.036   5.263  -3.664
   72   2HB   ALA  13          2HB       ALA  13   6.247   6.730  -2.711
   73   3HB   ALA  13          3HB       ALA  13   7.113   6.535  -4.240
   74    HA   PRO  14           HA       PRO  14   7.818   4.479   1.514
   75   1HB   PRO  14          1HB       PRO  14   6.858   7.197   2.185
   76   2HB   PRO  14          2HB       PRO  14   8.155   6.252   2.919
   77   1HG   PRO  14          1HG       PRO  14   8.681   8.351   1.332
   78   2HG   PRO  14          2HG       PRO  14   9.713   6.909   1.341
   79   1HD   PRO  14          1HD       PRO  14   7.666   7.761  -0.663
   80   2HD   PRO  14          2HD       PRO  14   9.226   6.948  -0.909
   81    H    CYS  15           H        CYS  15   6.091   3.492   2.438
   82    HA   CYS  15           HA       CYS  15   3.496   3.771   1.299
   83   1HB   CYS  15          1HB       CYS  15   4.028   2.531   4.007
   84   2HB   CYS  15          2HB       CYS  15   2.770   2.119   2.853
   85    H    VAL  16           H        VAL  16   1.889   5.180   1.872
   86    HA   VAL  16           HA       VAL  16   2.388   6.941   4.159
   87    HB   VAL  16           HB       VAL  16   0.322   7.169   1.959
   88   1HG1  VAL  16          1HG1      VAL  16   1.043   9.069   4.186
   89   2HG1  VAL  16          2HG1      VAL  16   0.029   9.484   2.802
   90   3HG1  VAL  16          3HG1      VAL  16  -0.495   8.247   3.946
   91   1HG2  VAL  16          1HG2      VAL  16   2.648   7.456   1.193
   92   2HG2  VAL  16          2HG2      VAL  16   1.707   8.943   1.071
   93   3HG2  VAL  16          3HG2      VAL  16   2.864   8.740   2.387
   94    H    PHE  17           H        PHE  17   1.553   6.327   6.047
   95    HA   PHE  17           HA       PHE  17  -1.021   4.927   6.057
   96   1HB   PHE  17          1HB       PHE  17   1.261   4.899   8.035
   97   2HB   PHE  17          2HB       PHE  17  -0.308   4.181   8.349
   98    HD1  PHE  17           1HD      PHE  17  -1.120   2.437   6.532
   99    HD2  PHE  17           2HD      PHE  17   2.910   3.613   7.186
  100    HE1  PHE  17           1HE      PHE  17  -0.336   0.364   5.461
  101    HE2  PHE  17           2HE      PHE  17   3.712   1.552   6.127
  102    HZ   PHE  17           HZ       PHE  17   2.094  -0.102   5.242
  103    HA   PRO  18           HA       PRO  18  -2.542   4.458   7.270
  104   1HB   PRO  18          1HB       PRO  18  -5.149   5.577   7.565
  105   2HB   PRO  18          2HB       PRO  18  -4.290   4.535   8.704
  106   1HG   PRO  18          1HG       PRO  18  -4.943   7.196   9.143
  107   2HG   PRO  18          2HG       PRO  18  -3.697   6.293  10.019
  108   1HD   PRO  18          1HD       PRO  18  -3.406   8.219   7.754
  109   2HD   PRO  18          2HD       PRO  18  -2.354   7.964   9.165
  110    H    PHE  19           H        PHE  19  -3.083   3.735   5.258
  111    HA   PHE  19           HA       PHE  19  -4.001   5.781   3.349
  112   1HB   PHE  19          1HB       PHE  19  -3.196   4.407   1.549
  113   2HB   PHE  19          2HB       PHE  19  -1.906   4.581   2.728
  114    HD1  PHE  19           1HD      PHE  19  -1.257   2.663   4.134
  115    HD2  PHE  19           2HD      PHE  19  -4.136   2.284   1.026
  116    HE1  PHE  19           1HE      PHE  19  -0.980   0.224   4.177
  117    HE2  PHE  19           2HE      PHE  19  -3.858  -0.162   1.063
  118    HZ   PHE  19           HZ       PHE  19  -2.288  -1.195   2.641
  119    H    THR  20           H        THR  20  -5.972   5.603   2.382
  120    HA   THR  20           HA       THR  20  -7.585   3.352   3.335
  121    HB   THR  20           HB       THR  20  -8.369   5.978   2.038
  122    HG1  THR  20           1HG      THR  20  -7.763   6.269   4.158
  123   1HG2  THR  20          1HG2      THR  20 -10.637   5.093   3.173
  124   2HG2  THR  20          2HG2      THR  20 -10.249   4.904   1.465
  125   3HG2  THR  20          3HG2      THR  20  -9.956   3.574   2.589
  126    H    PHE  21           H        PHE  21  -7.996   1.708   2.127
  127    HA   PHE  21           HA       PHE  21  -7.830   1.968  -0.811
  128   1HB   PHE  21          1HB       PHE  21  -6.147   0.402   0.318
  129   2HB   PHE  21          2HB       PHE  21  -7.519  -0.559   0.811
  130    HD1  PHE  21           1HD      PHE  21  -6.279   0.955  -2.380
  131    HD2  PHE  21           2HD      PHE  21  -7.991  -2.410  -0.434
  132    HE1  PHE  21           1HE      PHE  21  -6.102  -0.330  -4.452
  133    HE2  PHE  21           2HE      PHE  21  -7.811  -3.702  -2.495
  134    HZ   PHE  21           HZ       PHE  21  -6.852  -2.677  -4.525
  135    H    LEU  22           H        LEU  22  -9.598   1.489  -1.875
  136    HA   LEU  22           HA       LEU  22 -11.766   1.102  -2.320
  137   1HB   LEU  22          1HB       LEU  22 -10.470  -1.237  -1.096
  138   2HB   LEU  22          2HB       LEU  22 -12.140  -1.398  -1.590
  139    HG   LEU  22           HG       LEU  22 -11.480  -0.933  -3.856
  140   1HD1  LEU  22          1HD1      LEU  22  -8.832  -0.399  -2.782
  141   2HD1  LEU  22          2HD1      LEU  22  -9.134  -0.757  -4.479
  142   3HD1  LEU  22          3HD1      LEU  22  -9.884   0.656  -3.732
  143   1HD2  LEU  22          1HD2      LEU  22 -10.041  -3.063  -2.431
  144   2HD2  LEU  22          2HD2      LEU  22 -11.402  -3.201  -3.545
  145   3HD2  LEU  22          3HD2      LEU  22  -9.788  -2.844  -4.162
  146    H    GLY  23           H        GLY  23 -11.490   2.534   0.222
  147   1HA   GLY  23          1HA       GLY  23 -13.431   3.287   1.416
  148   2HA   GLY  23          2HA       GLY  23 -14.032   1.644   1.405
  149    H    ASN  24           H        ASN  24 -11.053   0.903   2.342
  150    HA   ASN  24           HA       ASN  24 -11.742   1.440   5.159
  151   1HB   ASN  24          1HB       ASN  24 -10.038  -0.764   3.985
  152   2HB   ASN  24          2HB       ASN  24 -10.463  -0.583   5.675
  153   1HD2  ASN  24          1HD2      ASN  24 -12.858  -2.527   3.175
  154   2HD2  ASN  24          2HD2      ASN  24 -11.254  -2.021   2.798
  155    H    LYS  25           H        LYS  25 -10.157   2.108   6.638
  156    HA   LYS  25           HA       LYS  25  -7.886   3.469   5.497
  157   1HB   LYS  25          1HB       LYS  25  -8.911   3.207   8.329
  158   2HB   LYS  25          2HB       LYS  25  -7.621   4.249   7.801
  159   1HG   LYS  25          1HG       LYS  25  -9.125   5.580   6.493
  160   2HG   LYS  25          2HG       LYS  25 -10.446   4.455   6.827
  161   1HD   LYS  25          1HD       LYS  25 -10.662   6.383   8.254
  162   2HD   LYS  25          2HD       LYS  25 -10.227   4.978   9.233
  163   1HE   LYS  25          1HE       LYS  25  -7.850   5.729   9.121
  164   2HE   LYS  25          2HE       LYS  25  -8.397   7.199   8.314
  165   1HZ   LYS  25          1HZ       LYS  25  -9.947   7.289  10.432
  166   2HZ   LYS  25          2HZ       LYS  25  -8.684   6.381  11.111
  167   3HZ   LYS  25          3HZ       LYS  25  -8.366   7.918  10.451
  168    H    TYR  26           H        TYR  26  -5.930   2.459   5.362
  169    HA   TYR  26           HA       TYR  26  -5.529   0.099   7.049
  170   1HB   TYR  26          1HB       TYR  26  -4.167   0.865   4.464
  171   2HB   TYR  26          2HB       TYR  26  -3.848  -0.588   5.398
  172    HD1  TYR  26           1HD      TYR  26  -6.589   1.194   3.630
  173    HD2  TYR  26           2HD      TYR  26  -5.046  -2.518   4.974
  174    HE1  TYR  26           1HE      TYR  26  -8.374   0.031   2.430
  175    HE2  TYR  26           2HE      TYR  26  -6.817  -3.700   3.766
  176    HH   TYR  26           HH       TYR  26  -8.494  -2.648   1.432
  177    H    GLU  27           H        GLU  27  -4.330   0.351   8.678
  178    HA   GLU  27           HA       GLU  27  -2.441   2.554   8.908
  179   1HB   GLU  27          1HB       GLU  27  -3.475   0.537  10.894
  180   2HB   GLU  27          2HB       GLU  27  -2.432   1.886  11.278
  181   1HG   GLU  27          1HG       GLU  27  -4.093   3.437  11.004
  182   2HG   GLU  27          2HG       GLU  27  -5.007   2.412   9.899
  183    H    SER  28           H        SER  28  -2.545  -0.743   8.246
  184    HA   SER  28           HA       SER  28   0.366  -0.932   8.451
  185   1HB   SER  28          1HB       SER  28  -0.145  -3.442   8.853
  186   2HB   SER  28          2HB       SER  28  -0.344  -2.338  10.212
  187    HG   SER  28           HG       SER  28  -2.177  -3.924   9.021
  188    H    CYS  29           H        CYS  29   0.887  -3.152   7.042
  189    HA   CYS  29           HA       CYS  29   0.139  -2.435   4.406
  190   1HB   CYS  29          1HB       CYS  29   1.392  -5.006   5.384
  191   2HB   CYS  29          2HB       CYS  29   1.285  -4.494   3.713
  192    H    THR  30           H        THR  30  -0.855  -4.006   2.897
  193    HA   THR  30           HA       THR  30  -2.946  -5.644   4.139
  194    HB   THR  30           HB       THR  30  -3.962  -3.412   3.666
  195    HG1  THR  30           1HG      THR  30  -5.415  -5.012   3.456
  196   1HG2  THR  30          1HG2      THR  30  -4.292  -3.348   0.943
  197   2HG2  THR  30          2HG2      THR  30  -3.228  -2.300   1.881
  198   3HG2  THR  30          3HG2      THR  30  -2.587  -3.758   1.125
  199    H    SER  31           H        SER  31  -4.093  -6.922   2.468
  200    HA   SER  31           HA       SER  31  -2.358  -7.571   0.195
  201   1HB   SER  31          1HB       SER  31  -3.243  -9.955   0.473
  202   2HB   SER  31          2HB       SER  31  -2.091  -9.408   1.695
  203    HG   SER  31           HG       SER  31  -4.093 -10.517   2.428
  204    H    ALA  32           H        ALA  32  -4.679  -5.836   0.812
  205    HA   ALA  32           HA       ALA  32  -7.065  -6.755  -0.325
  206   1HB   ALA  32          1HB       ALA  32  -6.593  -4.641   1.095
  207   2HB   ALA  32          2HB       ALA  32  -6.165  -3.885  -0.438
  208   3HB   ALA  32          3HB       ALA  32  -7.792  -4.516  -0.196
  209    H    GLY  33           H        GLY  33  -7.883  -6.736  -2.349
  210   1HA   GLY  33          1HA       GLY  33  -7.951  -6.448  -4.639
  211   2HA   GLY  33          2HA       GLY  33  -6.568  -5.372  -4.504
  212    H    ARG  34           H        ARG  34  -5.610  -8.067  -2.908
  213    HA   ARG  34           HA       ARG  34  -4.503  -9.245  -5.361
  214   1HB   ARG  34          1HB       ARG  34  -3.245  -9.323  -2.622
  215   2HB   ARG  34          2HB       ARG  34  -2.534  -9.812  -4.140
  216   1HG   ARG  34          1HG       ARG  34  -2.919  -7.307  -4.782
  217   2HG   ARG  34          2HG       ARG  34  -2.941  -7.085  -3.038
  218   1HD   ARG  34          1HD       ARG  34  -0.698  -6.764  -3.963
  219   2HD   ARG  34          2HD       ARG  34  -0.753  -8.134  -2.854
  220    HE   ARG  34           HE       ARG  34  -0.157  -9.498  -4.573
  221   1HH1  ARG  34          1HH1      ARG  34  -1.475  -6.553  -5.926
  222   2HH1  ARG  34          2HH1      ARG  34  -1.072  -6.958  -7.566
  223   1HH2  ARG  34          1HH2      ARG  34   0.359 -10.059  -6.725
  224   2HH2  ARG  34          2HH2      ARG  34  -0.001  -8.950  -8.007
  225    H    SER  35           H        SER  35  -4.582 -11.427  -5.617
  226    HA   SER  35           HA       SER  35  -5.905 -12.961  -3.478
  227   1HB   SER  35          1HB       SER  35  -6.259 -13.213  -6.473
  228   2HB   SER  35          2HB       SER  35  -6.877 -14.387  -5.306
  229    HG   SER  35           HG       SER  35  -7.576 -11.641  -5.554
  230    H    ASP  36           H        ASP  36  -3.055 -12.486  -4.210
  231    HA   ASP  36           HA       ASP  36  -2.206 -15.216  -4.820
  232   1HB   ASP  36          1HB       ASP  36   0.102 -13.929  -4.894
  233   2HB   ASP  36          2HB       ASP  36  -0.988 -13.937  -6.268
  234    H    GLY  37           H        GLY  37  -0.597 -12.727  -2.980
  235   1HA   GLY  37          1HA       GLY  37  -1.005 -13.704  -0.424
  236   2HA   GLY  37          2HA       GLY  37   0.412 -14.532  -1.047
  237    H    LYS  38           H        LYS  38   1.180 -12.142  -2.663
  238    HA   LYS  38           HA       LYS  38   2.921 -10.944  -0.837
  239   1HB   LYS  38          1HB       LYS  38   1.992  -9.898  -3.518
  240   2HB   LYS  38          2HB       LYS  38   3.446  -9.415  -2.670
  241   1HG   LYS  38          1HG       LYS  38   4.106 -10.873  -4.371
  242   2HG   LYS  38          2HG       LYS  38   4.261 -11.770  -2.877
  243   1HD   LYS  38          1HD       LYS  38   2.283 -13.026  -3.350
  244   2HD   LYS  38          2HD       LYS  38   1.886 -11.981  -4.719
  245   1HE   LYS  38          1HE       LYS  38   4.340 -13.726  -4.521
  246   2HE   LYS  38          2HE       LYS  38   2.869 -14.163  -5.386
  247   1HZ   LYS  38          1HZ       LYS  38   3.213 -12.098  -6.737
  248   2HZ   LYS  38          2HZ       LYS  38   4.742 -11.940  -6.012
  249   3HZ   LYS  38          3HZ       LYS  38   4.395 -13.297  -6.966
  250    H    MET  39           H        MET  39   2.497  -9.440   0.703
  251    HA   MET  39           HA       MET  39   0.034  -7.914   0.514
  252   1HB   MET  39          1HB       MET  39   2.141  -7.912   2.683
  253   2HB   MET  39          2HB       MET  39   0.542  -7.191   2.771
  254   1HG   MET  39          1HG       MET  39  -0.475  -9.403   2.610
  255   2HG   MET  39          2HG       MET  39   1.134 -10.128   2.516
  256   1HE   MET  39          1HE       MET  39  -0.186 -11.519   4.125
  257   2HE   MET  39          2HE       MET  39   0.395 -11.471   5.791
  258   3HE   MET  39          3HE       MET  39  -1.172 -10.772   5.387
  259    H    TRP  40           H        TRP  40  -0.001  -5.612   0.516
  260    HA   TRP  40           HA       TRP  40   2.549  -4.336  -0.211
  261   1HB   TRP  40          1HB       TRP  40   1.314  -3.012  -1.921
  262   2HB   TRP  40          2HB       TRP  40   1.372  -4.733  -2.293
  263    HD1  TRP  40           HD1      TRP  40  -1.040  -6.102  -1.522
  264    HE1  TRP  40           1HE      TRP  40  -3.454  -5.262  -1.756
  265    HE3  TRP  40           3HE      TRP  40  -0.127  -1.100  -2.036
  266    HZ2  TRP  40           2HZ      TRP  40  -4.791  -2.820  -2.079
  267    HZ3  TRP  40           3HZ      TRP  40  -2.035   0.417  -2.274
  268    HH2  TRP  40           HH2      TRP  40  -4.321  -0.425  -2.305
  269    H    CYS  41           H        CYS  41   1.627  -1.811  -0.657
  270    HA   CYS  41           HA       CYS  41   0.016  -0.840   1.543
  271   1HB   CYS  41          1HB       CYS  41   1.800   0.612   2.449
  272   2HB   CYS  41          2HB       CYS  41   2.248  -1.086   2.619
  273    H    ALA  42           H        ALA  42  -0.633   1.389   1.122
  274    HA   ALA  42           HA       ALA  42  -0.221   2.122  -1.663
  275   1HB   ALA  42          1HB       ALA  42  -2.467   2.341  -0.682
  276   2HB   ALA  42          2HB       ALA  42  -1.843   3.550   0.441
  277   3HB   ALA  42          3HB       ALA  42  -1.848   3.878  -1.292
  278    H    THR  43           H        THR  43   0.714   4.084  -2.319
  279    HA   THR  43           HA       THR  43   2.638   5.112  -0.370
  280    HB   THR  43           HB       THR  43   3.901   5.841  -2.355
  281    HG1  THR  43           1HG      THR  43   2.653   6.171  -4.032
  282   1HG2  THR  43          1HG2      THR  43   4.012   3.449  -3.442
  283   2HG2  THR  43          2HG2      THR  43   4.626   3.742  -1.813
  284   3HG2  THR  43          3HG2      THR  43   3.033   3.019  -2.039
  285    H    THR  44           H        THR  44  -0.295   5.825  -1.012
  286    HA   THR  44           HA       THR  44   0.098   8.717  -0.828
  287    HB   THR  44           HB       THR  44  -1.909   9.069  -2.262
  288    HG1  THR  44           1HG      THR  44  -3.072   7.424  -2.806
  289   1HG2  THR  44          1HG2      THR  44  -0.176   7.406  -3.990
  290   2HG2  THR  44          2HG2      THR  44  -0.837   9.020  -4.255
  291   3HG2  THR  44          3HG2      THR  44   0.551   8.797  -3.189
  292    H    ALA  45           H        ALA  45  -1.629   9.786   0.350
  293    HA   ALA  45           HA       ALA  45  -2.504   8.362   2.598
  294   1HB   ALA  45          1HB       ALA  45  -3.191  11.035   1.460
  295   2HB   ALA  45          2HB       ALA  45  -4.116  10.395   2.821
  296   3HB   ALA  45          3HB       ALA  45  -2.374  10.630   2.971
  297    H    ASN  46           H        ASN  46  -4.285   9.356  -0.289
  298    HA   ASN  46           HA       ASN  46  -6.366   7.431   0.469
  299   1HB   ASN  46          1HB       ASN  46  -7.170   9.782   0.384
  300   2HB   ASN  46          2HB       ASN  46  -6.676   9.869  -1.306
  301   1HD2  ASN  46          1HD2      ASN  46 -10.188   8.316  -0.249
  302   2HD2  ASN  46          2HD2      ASN  46  -9.095   9.049   0.867
  303    H    TYR  47           H        TYR  47  -5.977   5.635  -0.606
  304    HA   TYR  47           HA       TYR  47  -4.547   5.581  -3.069
  305   1HB   TYR  47          1HB       TYR  47  -4.443   3.773  -1.364
  306   2HB   TYR  47          2HB       TYR  47  -6.099   3.339  -1.764
  307    HD1  TYR  47           1HD      TYR  47  -6.580   2.564  -4.170
  308    HD2  TYR  47           2HD      TYR  47  -2.657   2.951  -2.587
  309    HE1  TYR  47           1HE      TYR  47  -5.712   1.105  -5.953
  310    HE2  TYR  47           2HE      TYR  47  -1.787   1.500  -4.354
  311    HH   TYR  47           HH       TYR  47  -3.275  -0.506  -5.999
  312    H    ASP  48           H        ASP  48  -7.947   5.368  -2.181
  313    HA   ASP  48           HA       ASP  48  -9.099   4.407  -4.467
  314   1HB   ASP  48          1HB       ASP  48 -10.021   6.492  -2.519
  315   2HB   ASP  48          2HB       ASP  48 -11.000   6.082  -3.921
  316    H    ASP  49           H        ASP  49  -7.767   7.619  -3.983
  317    HA   ASP  49           HA       ASP  49  -8.744   8.523  -6.558
  318   1HB   ASP  49          1HB       ASP  49  -7.202   9.866  -4.350
  319   2HB   ASP  49          2HB       ASP  49  -7.496  10.641  -5.898
  320    H    ASP  50           H        ASP  50  -5.526   8.576  -5.025
  321    HA   ASP  50           HA       ASP  50  -4.145   8.981  -7.455
  322   1HB   ASP  50          1HB       ASP  50  -3.293   8.264  -4.675
  323   2HB   ASP  50          2HB       ASP  50  -2.125   8.304  -5.991
  324    H    ARG  51           H        ARG  51  -4.882   6.043  -5.680
  325    HA   ARG  51           HA       ARG  51  -4.442   3.878  -6.024
  326   1HB   ARG  51          1HB       ARG  51  -4.735   4.688  -8.901
  327   2HB   ARG  51          2HB       ARG  51  -4.966   3.069  -8.240
  328   1HG   ARG  51          1HG       ARG  51  -6.521   4.632  -6.627
  329   2HG   ARG  51          2HG       ARG  51  -6.763   5.356  -8.220
  330   1HD   ARG  51          1HD       ARG  51  -7.004   2.420  -7.680
  331   2HD   ARG  51          2HD       ARG  51  -8.356   3.540  -7.512
  332    HE   ARG  51           HE       ARG  51  -7.141   3.801 -10.064
  333   1HH1  ARG  51          1HH1      ARG  51  -9.271   1.773  -8.179
  334   2HH1  ARG  51          2HH1      ARG  51 -10.090   1.118  -9.565
  335   1HH2  ARG  51          1HH2      ARG  51  -8.227   2.955 -11.901
  336   2HH2  ARG  51          2HH2      ARG  51  -9.523   1.814 -11.677
  337    H    LYS  52           H        LYS  52  -2.150   5.132  -5.478
  338    HA   LYS  52           HA       LYS  52  -0.215   3.845  -7.264
  339   1HB   LYS  52          1HB       LYS  52   0.088   6.249  -5.455
  340   2HB   LYS  52          2HB       LYS  52   1.451   5.445  -6.232
  341   1HG   LYS  52          1HG       LYS  52   0.979   6.308  -8.257
  342   2HG   LYS  52          2HG       LYS  52  -0.763   6.183  -8.022
  343   1HD   LYS  52          1HD       LYS  52  -0.605   8.148  -6.470
  344   2HD   LYS  52          2HD       LYS  52   1.077   8.334  -6.983
  345   1HE   LYS  52          1HE       LYS  52   0.410   8.704  -9.254
  346   2HE   LYS  52          2HE       LYS  52  -1.261   8.288  -8.886
  347   1HZ   LYS  52          1HZ       LYS  52  -1.277  10.261  -7.369
  348   2HZ   LYS  52          2HZ       LYS  52   0.237  10.701  -8.025
  349   3HZ   LYS  52          3HZ       LYS  52  -1.143  10.616  -9.017
  350    H    TRP  53           H        TRP  53   0.622   2.072  -6.481
  351    HA   TRP  53           HA       TRP  53   0.734   1.717  -3.565
  352   1HB   TRP  53          1HB       TRP  53  -0.109  -0.512  -3.848
  353   2HB   TRP  53          2HB       TRP  53  -1.200   0.619  -4.555
  354    HD1  TRP  53           HD1      TRP  53  -0.647   0.867  -7.475
  355    HE1  TRP  53           1HE      TRP  53  -0.362  -1.155  -9.062
  356    HE3  TRP  53           3HE      TRP  53   0.416  -2.586  -3.999
  357    HZ2  TRP  53           2HZ      TRP  53   0.253  -3.921  -8.806
  358    HZ3  TRP  53           3HZ      TRP  53   0.847  -4.932  -4.695
  359    HH2  TRP  53           HH2      TRP  53   0.764  -5.573  -7.058
  360    H    GLY  54           H        GLY  54   1.878  -0.283  -2.962
  361   1HA   GLY  54          1HA       GLY  54   3.990  -1.312  -4.585
  362   2HA   GLY  54          2HA       GLY  54   4.582  -0.155  -3.395
  363    H    PHE  55           H        PHE  55   4.871  -3.129  -3.660
  364    HA   PHE  55           HA       PHE  55   3.432  -4.519  -1.744
  365   1HB   PHE  55          1HB       PHE  55   6.205  -4.868  -2.855
  366   2HB   PHE  55          2HB       PHE  55   5.513  -5.991  -1.700
  367    HD1  PHE  55           1HD      PHE  55   2.760  -4.987  -3.441
  368    HD2  PHE  55           2HD      PHE  55   6.334  -7.220  -4.037
  369    HE1  PHE  55           1HE      PHE  55   1.668  -6.261  -5.240
  370    HE2  PHE  55           2HE      PHE  55   5.244  -8.492  -5.836
  371    HZ   PHE  55           HZ       PHE  55   2.914  -8.009  -6.446
  372    H    CYS  56           H        CYS  56   4.024  -5.266   0.326
  373    HA   CYS  56           HA       CYS  56   4.893  -3.220   2.095
  374   1HB   CYS  56          1HB       CYS  56   3.190  -5.054   2.558
  375   2HB   CYS  56          2HB       CYS  56   4.547  -6.161   2.711
  376    HA   PRO  57           HA       PRO  57   9.258  -4.064   2.153
  377   1HB   PRO  57          1HB       PRO  57   9.977  -2.920   4.437
  378   2HB   PRO  57          2HB       PRO  57   9.362  -1.946   3.090
  379   1HG   PRO  57          1HG       PRO  57   7.853  -3.089   5.398
  380   2HG   PRO  57          2HG       PRO  57   7.932  -1.380   4.913
  381   1HD   PRO  57          1HD       PRO  57   5.876  -2.891   4.156
  382   2HD   PRO  57          2HD       PRO  57   6.628  -1.776   2.989
  383    H    ASP  58           H        ASP  58  10.637  -4.369   4.636
  384    HA   ASP  58           HA       ASP  58  10.601  -7.167   4.904
  385   1HB   ASP  58          1HB       ASP  58  12.573  -5.831   5.479
  386   2HB   ASP  58          2HB       ASP  58  11.694  -5.104   6.821
  387    H    GLN  59           H        GLN  59   9.082  -8.377   5.802
  388    HA   GLN  59           HA       GLN  59   7.368  -7.212   7.868
  389   1HB   GLN  59          1HB       GLN  59   7.046  -9.765   6.282
  390   2HB   GLN  59          2HB       GLN  59   5.878  -9.128   7.426
  391   1HG   GLN  59          1HG       GLN  59   5.626  -7.131   6.018
  392   2HG   GLN  59          2HG       GLN  59   6.754  -7.833   4.860
  393   1HE2  GLN  59          1HE2      GLN  59   2.918  -8.633   4.528
  394   2HE2  GLN  59          2HE2      GLN  59   3.605  -7.317   5.415
  395    H    GLY  60           H        GLY  60  10.121  -8.100   8.413
  396   1HA   GLY  60          1HA       GLY  60   9.882 -10.567   9.900
  397   2HA   GLY  60          2HA       GLY  60  11.299  -9.531   9.815
  Start of MODEL    2
    1    H    SER   1           1H       SER   1  18.315   4.108   6.434
    2    HA   SER   1           HA       SER   1  17.953   5.624   4.443
    3   1HB   SER   1          1HB       SER   1  17.629   3.563   3.051
    4   2HB   SER   1          2HB       SER   1  18.861   3.382   4.300
    5    HG   SER   1           HG       SER   1  17.165   1.654   4.001
    6    H    TRP   2           H        TRP   2  16.329   5.017   2.427
    7    HA   TRP   2           HA       TRP   2  13.766   6.050   3.320
    8   1HB   TRP   2          1HB       TRP   2  15.250   6.558   1.089
    9   2HB   TRP   2          2HB       TRP   2  14.103   5.376   0.463
   10    HD1  TRP   2           HD1      TRP   2  11.400   6.139   1.561
   11    HE1  TRP   2           1HE      TRP   2  10.323   8.448   1.165
   12    HE3  TRP   2           3HE      TRP   2  15.605   8.820   0.444
   13    HZ2  TRP   2           2HZ      TRP   2  11.152  11.050   0.459
   14    HZ3  TRP   2           3HZ      TRP   2  15.375  11.206  -0.084
   15    HH2  TRP   2           HH2      TRP   2  13.189  12.299  -0.076
   16    H    MET   3           H        MET   3  11.938   4.871   3.502
   17    HA   MET   3           HA       MET   3  12.105   2.026   3.096
   18   1HB   MET   3          1HB       MET   3   9.759   2.044   4.021
   19   2HB   MET   3          2HB       MET   3  11.008   2.640   5.097
   20   1HG   MET   3          1HG       MET   3  10.307   4.886   4.801
   21   2HG   MET   3          2HG       MET   3   9.269   4.458   3.442
   22   1HE   MET   3          1HE       MET   3  10.198   3.459   6.860
   23   2HE   MET   3          2HE       MET   3   8.844   4.011   7.847
   24   3HE   MET   3          3HE       MET   3   8.874   2.357   7.234
   25    H    SER   4           H        SER   4  12.404   2.298   0.756
   26    HA   SER   4           HA       SER   4  10.233   3.160  -0.881
   27   1HB   SER   4          1HB       SER   4  12.587   1.400  -1.619
   28   2HB   SER   4          2HB       SER   4  11.548   2.275  -2.740
   29    HG   SER   4           HG       SER   4  12.349   4.210  -1.958
   30    H    THR   5           H        THR   5   9.096   1.736  -2.420
   31    HA   THR   5           HA       THR   5   8.264  -0.714  -1.072
   32    HB   THR   5           HB       THR   5   6.326  -0.519  -2.721
   33    HG1  THR   5           1HG      THR   5   7.058   2.185  -2.935
   34   1HG2  THR   5          1HG2      THR   5   5.135   1.141  -1.476
   35   2HG2  THR   5          2HG2      THR   5   6.080   0.134  -0.379
   36   3HG2  THR   5          3HG2      THR   5   6.638   1.758  -0.793
   37    H    VAL   6           H        VAL   6   7.389  -2.387  -2.595
   38    HA   VAL   6           HA       VAL   6   9.280  -2.895  -4.817
   39    HB   VAL   6           HB       VAL   6   7.780  -5.219  -3.922
   40   1HG1  VAL   6          1HG1      VAL   6  10.170  -4.708  -5.183
   41   2HG1  VAL   6          2HG1      VAL   6  10.663  -5.357  -3.621
   42   3HG1  VAL   6          3HG1      VAL   6   9.581  -6.287  -4.660
   43   1HG2  VAL   6          1HG2      VAL   6   9.001  -3.601  -1.833
   44   2HG2  VAL   6          2HG2      VAL   6   7.861  -4.942  -1.717
   45   3HG2  VAL   6          3HG2      VAL   6   9.589  -5.265  -1.866
   46    H    GLY   7           H        GLY   7   7.854  -4.876  -6.033
   47   1HA   GLY   7          1HA       GLY   7   6.246  -4.988  -7.719
   48   2HA   GLY   7          2HA       GLY   7   5.192  -4.870  -6.342
   49    H    GLY   8           H        GLY   8   3.628  -3.558  -6.731
   50   1HA   GLY   8          1HA       GLY   8   2.399  -1.810  -7.585
   51   2HA   GLY   8          2HA       GLY   8   3.620  -0.902  -6.729
   52    H    ASN   9           H        ASN   9   3.674   0.815  -7.985
   53    HA   ASN   9           HA       ASN   9   5.064   0.532 -10.505
   54   1HB   ASN   9          1HB       ASN   9   3.525   2.087 -11.694
   55   2HB   ASN   9          2HB       ASN   9   2.824   0.522 -11.344
   56   1HD2  ASN   9          1HD2      ASN   9   1.266   2.804  -8.552
   57   2HD2  ASN   9          2HD2      ASN   9   2.852   2.118  -8.522
   58    H    SER  10           H        SER  10   4.935   1.816  -7.610
   59    HA   SER  10           HA       SER  10   5.798   4.506  -8.303
   60   1HB   SER  10          1HB       SER  10   5.584   3.293  -5.544
   61   2HB   SER  10          2HB       SER  10   5.554   4.994  -5.986
   62    HG   SER  10           HG       SER  10   3.448   4.016  -5.525
   63    H    GLY  11           H        GLY  11   6.948   1.796  -6.275
   64   1HA   GLY  11          1HA       GLY  11   9.057   0.881  -6.113
   65   2HA   GLY  11          2HA       GLY  11   9.603   1.985  -7.367
   66    H    GLY  12           H        GLY  12  10.156   4.177  -6.734
   67   1HA   GLY  12          1HA       GLY  12  11.723   4.201  -4.361
   68   2HA   GLY  12          2HA       GLY  12  11.456   5.561  -5.441
   69    H    ALA  13           H        ALA  13   8.440   5.063  -4.966
   70    HA   ALA  13           HA       ALA  13   8.279   6.921  -2.763
   71   1HB   ALA  13          1HB       ALA  13   6.826   6.961  -4.865
   72   2HB   ALA  13          2HB       ALA  13   5.914   5.659  -4.101
   73   3HB   ALA  13          3HB       ALA  13   6.034   7.231  -3.313
   74    HA   PRO  14           HA       PRO  14   7.443   3.800   0.269
   75   1HB   PRO  14          1HB       PRO  14   7.132   5.432   2.368
   76   2HB   PRO  14          2HB       PRO  14   8.706   5.229   1.588
   77   1HG   PRO  14          1HG       PRO  14   6.787   7.498   1.426
   78   2HG   PRO  14          2HG       PRO  14   8.556   7.511   1.337
   79   1HD   PRO  14          1HD       PRO  14   6.741   7.615  -0.833
   80   2HD   PRO  14          2HD       PRO  14   8.495   7.372  -0.932
   81    H    CYS  15           H        CYS  15   5.753   3.312   1.957
   82    HA   CYS  15           HA       CYS  15   3.136   3.715   0.834
   83   1HB   CYS  15          1HB       CYS  15   3.536   2.645   3.607
   84   2HB   CYS  15          2HB       CYS  15   2.379   2.147   2.381
   85    H    VAL  16           H        VAL  16   1.496   5.040   1.647
   86    HA   VAL  16           HA       VAL  16   2.322   6.938   3.742
   87    HB   VAL  16           HB       VAL  16   0.180   7.261   1.624
   88   1HG1  VAL  16          1HG1      VAL  16  -0.350   8.431   3.731
   89   2HG1  VAL  16          2HG1      VAL  16   1.197   9.270   3.633
   90   3HG1  VAL  16          3HG1      VAL  16  -0.032   9.547   2.399
   91   1HG2  VAL  16          1HG2      VAL  16   2.826   7.418   1.193
   92   2HG2  VAL  16          2HG2      VAL  16   1.645   8.428   0.355
   93   3HG2  VAL  16          3HG2      VAL  16   2.516   9.064   1.751
   94    H    PHE  17           H        PHE  17   1.582   6.282   5.669
   95    HA   PHE  17           HA       PHE  17  -1.094   5.099   5.806
   96   1HB   PHE  17          1HB       PHE  17   1.258   4.887   7.679
   97   2HB   PHE  17          2HB       PHE  17  -0.332   4.235   8.018
   98    HD1  PHE  17           1HD      PHE  17  -1.248   2.762   5.874
   99    HD2  PHE  17           2HD      PHE  17   2.790   3.372   7.046
  100    HE1  PHE  17           1HE      PHE  17  -0.597   0.667   4.761
  101    HE2  PHE  17           2HE      PHE  17   3.456   1.290   5.939
  102    HZ   PHE  17           HZ       PHE  17   1.763  -0.094   4.775
  103    HA   PRO  18           HA       PRO  18  -2.524   4.636   7.064
  104   1HB   PRO  18          1HB       PRO  18  -5.063   5.746   7.641
  105   2HB   PRO  18          2HB       PRO  18  -4.093   4.715   8.690
  106   1HG   PRO  18          1HG       PRO  18  -4.722   7.402   9.153
  107   2HG   PRO  18          2HG       PRO  18  -3.466   6.468   9.980
  108   1HD   PRO  18          1HD       PRO  18  -3.212   8.415   7.732
  109   2HD   PRO  18          2HD       PRO  18  -2.094   8.076   9.074
  110    H    PHE  19           H        PHE  19  -3.259   4.043   5.032
  111    HA   PHE  19           HA       PHE  19  -4.271   6.267   3.386
  112   1HB   PHE  19          1HB       PHE  19  -3.710   5.026   1.394
  113   2HB   PHE  19          2HB       PHE  19  -2.297   5.139   2.422
  114    HD1  PHE  19           1HD      PHE  19  -1.542   3.117   3.677
  115    HD2  PHE  19           2HD      PHE  19  -4.591   2.975   0.723
  116    HE1  PHE  19           1HE      PHE  19  -1.188   0.694   3.435
  117    HE2  PHE  19           2HE      PHE  19  -4.246   0.555   0.471
  118    HZ   PHE  19           HZ       PHE  19  -2.551  -0.590   1.823
  119    H    THR  20           H        THR  20  -5.658   4.937   1.460
  120    HA   THR  20           HA       THR  20  -7.584   3.252   2.844
  121    HB   THR  20           HB       THR  20  -8.309   5.879   1.497
  122    HG1  THR  20           1HG      THR  20  -7.608   6.110   3.650
  123   1HG2  THR  20          1HG2      THR  20 -10.615   5.372   2.338
  124   2HG2  THR  20          2HG2      THR  20 -10.066   4.434   0.948
  125   3HG2  THR  20          3HG2      THR  20 -10.074   3.705   2.556
  126    H    PHE  21           H        PHE  21  -7.942   1.582   1.604
  127    HA   PHE  21           HA       PHE  21  -7.672   1.890  -1.319
  128   1HB   PHE  21          1HB       PHE  21  -6.164   0.185  -0.204
  129   2HB   PHE  21          2HB       PHE  21  -7.617  -0.666   0.286
  130    HD1  PHE  21           1HD      PHE  21  -5.935   0.590  -2.802
  131    HD2  PHE  21           2HD      PHE  21  -8.533  -2.304  -1.075
  132    HE1  PHE  21           1HE      PHE  21  -5.898  -0.675  -4.899
  133    HE2  PHE  21           2HE      PHE  21  -8.491  -3.583  -3.169
  134    HZ   PHE  21           HZ       PHE  21  -7.181  -2.773  -5.095
  135    H    LEU  22           H        LEU  22  -9.377   1.519  -2.517
  136    HA   LEU  22           HA       LEU  22 -11.573   1.430  -3.018
  137   1HB   LEU  22          1HB       LEU  22 -10.391  -1.121  -2.165
  138   2HB   LEU  22          2HB       LEU  22 -12.051  -1.113  -2.734
  139    HG   LEU  22           HG       LEU  22 -10.362  -1.631  -4.489
  140   1HD1  LEU  22          1HD1      LEU  22 -12.612  -0.577  -4.814
  141   2HD1  LEU  22          2HD1      LEU  22 -11.737   0.946  -4.991
  142   3HD1  LEU  22          3HD1      LEU  22 -11.439  -0.379  -6.118
  143   1HD2  LEU  22          1HD2      LEU  22  -9.498   1.145  -3.870
  144   2HD2  LEU  22          2HD2      LEU  22  -8.513  -0.301  -4.104
  145   3HD2  LEU  22          3HD2      LEU  22  -9.306   0.462  -5.483
  146    H    GLY  23           H        GLY  23 -11.512   2.613  -0.586
  147   1HA   GLY  23          1HA       GLY  23 -13.363   3.271   0.723
  148   2HA   GLY  23          2HA       GLY  23 -14.038   1.670   0.541
  149    H    ASN  24           H        ASN  24 -10.993   0.839   1.504
  150    HA   ASN  24           HA       ASN  24 -11.820   1.074   4.326
  151   1HB   ASN  24          1HB       ASN  24 -10.056  -1.009   3.044
  152   2HB   ASN  24          2HB       ASN  24 -10.643  -0.996   4.701
  153   1HD2  ASN  24          1HD2      ASN  24 -12.809  -2.626   1.807
  154   2HD2  ASN  24          2HD2      ASN  24 -11.167  -2.128   1.638
  155    H    LYS  25           H        LYS  25 -10.461   1.969   5.788
  156    HA   LYS  25           HA       LYS  25  -8.113   3.316   4.880
  157   1HB   LYS  25          1HB       LYS  25  -9.250   2.951   7.655
  158   2HB   LYS  25          2HB       LYS  25  -8.059   4.125   7.157
  159   1HG   LYS  25          1HG       LYS  25  -9.679   5.239   5.737
  160   2HG   LYS  25          2HG       LYS  25 -10.886   4.018   6.160
  161   1HD   LYS  25          1HD       LYS  25 -11.298   5.959   7.486
  162   2HD   LYS  25          2HD       LYS  25 -10.636   4.709   8.542
  163   1HE   LYS  25          1HE       LYS  25  -8.413   5.766   8.351
  164   2HE   LYS  25          2HE       LYS  25  -9.117   7.026   7.340
  165   1HZ   LYS  25          1HZ       LYS  25 -10.699   7.069   9.535
  166   2HZ   LYS  25          2HZ       LYS  25  -9.178   6.717  10.206
  167   3HZ   LYS  25          3HZ       LYS  25  -9.386   8.110   9.260
  168    H    TYR  26           H        TYR  26  -6.100   2.456   4.857
  169    HA   TYR  26           HA       TYR  26  -5.628   0.082   6.515
  170   1HB   TYR  26          1HB       TYR  26  -4.308   0.953   3.943
  171   2HB   TYR  26          2HB       TYR  26  -3.858  -0.463   4.880
  172    HD1  TYR  26           1HD      TYR  26  -7.124  -0.624   5.444
  173    HD2  TYR  26           2HD      TYR  26  -4.508  -0.805   2.117
  174    HE1  TYR  26           1HE      TYR  26  -8.785  -1.932   4.221
  175    HE2  TYR  26           2HE      TYR  26  -6.151  -2.134   0.878
  176    HH   TYR  26           HH       TYR  26  -8.511  -3.782   2.151
  177    H    GLU  27           H        GLU  27  -4.437   0.376   8.167
  178    HA   GLU  27           HA       GLU  27  -2.640   2.665   8.354
  179   1HB   GLU  27          1HB       GLU  27  -3.702   0.730  10.403
  180   2HB   GLU  27          2HB       GLU  27  -2.644   2.071  10.759
  181   1HG   GLU  27          1HG       GLU  27  -4.314   3.656  10.081
  182   2HG   GLU  27          2HG       GLU  27  -5.361   2.356   9.514
  183    H    SER  28           H        SER  28  -2.625  -0.611   7.705
  184    HA   SER  28           HA       SER  28   0.277  -0.768   8.081
  185   1HB   SER  28          1HB       SER  28  -0.194  -3.245   8.560
  186   2HB   SER  28          2HB       SER  28  -0.587  -2.116   9.852
  187    HG   SER  28           HG       SER  28  -2.190  -3.861   8.729
  188    H    CYS  29           H        CYS  29   0.820  -3.072   6.788
  189    HA   CYS  29           HA       CYS  29   0.313  -2.446   4.081
  190   1HB   CYS  29          1HB       CYS  29   1.376  -4.947   5.375
  191   2HB   CYS  29          2HB       CYS  29   1.245  -4.745   3.641
  192    H    THR  30           H        THR  30  -0.556  -4.202   2.594
  193    HA   THR  30           HA       THR  30  -2.798  -5.680   3.688
  194    HB   THR  30           HB       THR  30  -3.750  -3.395   3.215
  195    HG1  THR  30           1HG      THR  30  -5.220  -4.978   2.973
  196   1HG2  THR  30          1HG2      THR  30  -3.507  -3.864   0.299
  197   2HG2  THR  30          2HG2      THR  30  -3.655  -2.355   1.196
  198   3HG2  THR  30          3HG2      THR  30  -2.106  -3.195   1.134
  199    H    SER  31           H        SER  31  -3.954  -6.757   1.818
  200    HA   SER  31           HA       SER  31  -2.183  -7.361  -0.419
  201   1HB   SER  31          1HB       SER  31  -2.854  -9.787  -0.203
  202   2HB   SER  31          2HB       SER  31  -1.786  -9.200   1.080
  203    HG   SER  31           HG       SER  31  -3.272  -9.978   2.346
  204    H    ALA  32           H        ALA  32  -4.459  -5.700   0.211
  205    HA   ALA  32           HA       ALA  32  -6.896  -6.639  -0.750
  206   1HB   ALA  32          1HB       ALA  32  -6.670  -4.564   0.535
  207   2HB   ALA  32          2HB       ALA  32  -5.784  -3.825  -0.798
  208   3HB   ALA  32          3HB       ALA  32  -7.483  -4.256  -1.000
  209    H    GLY  33           H        GLY  33  -7.821  -6.771  -2.690
  210   1HA   GLY  33          1HA       GLY  33  -8.067  -6.688  -4.975
  211   2HA   GLY  33          2HA       GLY  33  -6.763  -5.506  -5.021
  212    H    ARG  34           H        ARG  34  -5.497  -7.998  -3.333
  213    HA   ARG  34           HA       ARG  34  -4.376  -9.203  -5.767
  214   1HB   ARG  34          1HB       ARG  34  -3.133  -9.061  -3.018
  215   2HB   ARG  34          2HB       ARG  34  -2.383  -9.658  -4.480
  216   1HG   ARG  34          1HG       ARG  34  -2.934  -7.203  -5.315
  217   2HG   ARG  34          2HG       ARG  34  -2.851  -6.884  -3.587
  218   1HD   ARG  34          1HD       ARG  34  -0.691  -6.569  -4.721
  219   2HD   ARG  34          2HD       ARG  34  -0.634  -7.814  -3.469
  220    HE   ARG  34           HE       ARG  34  -0.173  -9.375  -5.077
  221   1HH1  ARG  34          1HH1      ARG  34  -1.375  -6.482  -6.631
  222   2HH1  ARG  34          2HH1      ARG  34  -1.073  -7.067  -8.239
  223   1HH2  ARG  34          1HH2      ARG  34   0.217 -10.147  -7.173
  224   2HH2  ARG  34          2HH2      ARG  34  -0.151  -9.154  -8.549
  225    H    SER  35           H        SER  35  -4.287 -10.239  -2.399
  226    HA   SER  35           HA       SER  35  -4.855 -12.155  -1.331
  227   1HB   SER  35          1HB       SER  35  -6.770 -12.558  -3.643
  228   2HB   SER  35          2HB       SER  35  -6.799 -13.434  -2.110
  229    HG   SER  35           HG       SER  35  -7.499 -11.655  -1.085
  230    H    ASP  36           H        ASP  36  -2.815 -12.028  -3.549
  231    HA   ASP  36           HA       ASP  36  -2.743 -14.818  -4.390
  232   1HB   ASP  36          1HB       ASP  36  -1.405 -14.146  -6.151
  233   2HB   ASP  36          2HB       ASP  36  -2.378 -12.715  -5.897
  234    H    GLY  37           H        GLY  37  -1.053 -12.442  -2.555
  235   1HA   GLY  37          1HA       GLY  37   0.003 -13.765  -0.536
  236   2HA   GLY  37          2HA       GLY  37   1.069 -14.317  -1.823
  237    H    LYS  38           H        LYS  38   1.254 -11.979  -3.311
  238    HA   LYS  38           HA       LYS  38   3.291 -10.595  -1.936
  239   1HB   LYS  38          1HB       LYS  38   1.757  -9.698  -4.385
  240   2HB   LYS  38          2HB       LYS  38   3.345  -9.148  -3.882
  241   1HG   LYS  38          1HG       LYS  38   4.349 -11.166  -4.415
  242   2HG   LYS  38          2HG       LYS  38   2.810 -12.015  -4.528
  243   1HD   LYS  38          1HD       LYS  38   2.267 -10.526  -6.485
  244   2HD   LYS  38          2HD       LYS  38   3.934  -9.949  -6.416
  245   1HE   LYS  38          1HE       LYS  38   3.733 -11.702  -8.073
  246   2HE   LYS  38          2HE       LYS  38   4.727 -12.252  -6.724
  247   1HZ   LYS  38          1HZ       LYS  38   2.035 -12.908  -6.204
  248   2HZ   LYS  38          2HZ       LYS  38   2.439 -13.452  -7.767
  249   3HZ   LYS  38          3HZ       LYS  38   3.356 -13.949  -6.422
  250    H    MET  39           H        MET  39   2.820  -9.370  -0.164
  251    HA   MET  39           HA       MET  39   0.354  -7.868  -0.076
  252   1HB   MET  39          1HB       MET  39   2.654  -7.993   1.889
  253   2HB   MET  39          2HB       MET  39   1.105  -7.214   2.167
  254   1HG   MET  39          1HG       MET  39   0.035  -9.465   1.805
  255   2HG   MET  39          2HG       MET  39   1.660 -10.144   1.853
  256   1HE   MET  39          1HE       MET  39   3.280  -9.146   3.504
  257   2HE   MET  39          2HE       MET  39   2.853  -8.366   5.029
  258   3HE   MET  39          3HE       MET  39   3.010 -10.120   4.949
  259    H    TRP  40           H        TRP  40   0.224  -5.629  -0.019
  260    HA   TRP  40           HA       TRP  40   2.637  -4.144  -0.779
  261   1HB   TRP  40          1HB       TRP  40   1.341  -2.963  -2.517
  262   2HB   TRP  40          2HB       TRP  40   1.447  -4.691  -2.850
  263    HD1  TRP  40           HD1      TRP  40  -0.911  -6.128  -2.089
  264    HE1  TRP  40           1HE      TRP  40  -3.356  -5.356  -2.252
  265    HE3  TRP  40           3HE      TRP  40  -0.147  -1.112  -2.514
  266    HZ2  TRP  40           2HZ      TRP  40  -4.770  -2.948  -2.506
  267    HZ3  TRP  40           3HZ      TRP  40  -2.100   0.367  -2.686
  268    HH2  TRP  40           HH2      TRP  40  -4.361  -0.535  -2.689
  269    H    CYS  41           H        CYS  41   1.557  -1.718  -1.205
  270    HA   CYS  41           HA       CYS  41  -0.220  -0.870   0.906
  271   1HB   CYS  41          1HB       CYS  41   1.470   0.642   1.946
  272   2HB   CYS  41          2HB       CYS  41   1.870  -1.061   2.176
  273    H    ALA  42           H        ALA  42  -0.757   1.454   0.631
  274    HA   ALA  42           HA       ALA  42  -0.429   2.270  -2.141
  275   1HB   ALA  42          1HB       ALA  42  -1.915   3.626   0.110
  276   2HB   ALA  42          2HB       ALA  42  -1.924   4.136  -1.578
  277   3HB   ALA  42          3HB       ALA  42  -2.620   2.579  -1.121
  278    H    THR  43           H        THR  43   0.607   4.129  -2.823
  279    HA   THR  43           HA       THR  43   2.571   5.151  -0.908
  280    HB   THR  43           HB       THR  43   3.848   5.822  -2.916
  281    HG1  THR  43           1HG      THR  43   2.718   6.005  -4.684
  282   1HG2  THR  43          1HG2      THR  43   3.559   3.213  -3.861
  283   2HG2  THR  43          2HG2      THR  43   4.743   3.807  -2.696
  284   3HG2  THR  43          3HG2      THR  43   3.210   3.139  -2.134
  285    H    THR  44           H        THR  44  -0.338   5.888  -1.613
  286    HA   THR  44           HA       THR  44   0.069   8.781  -1.452
  287    HB   THR  44           HB       THR  44  -2.062   9.052  -2.802
  288    HG1  THR  44           1HG      THR  44  -3.069   7.319  -3.339
  289   1HG2  THR  44          1HG2      THR  44  -1.065   8.825  -4.979
  290   2HG2  THR  44          2HG2      THR  44   0.120   9.467  -3.840
  291   3HG2  THR  44          3HG2      THR  44   0.194   7.773  -4.330
  292    H    ALA  45           H        ALA  45  -1.595   9.856  -0.206
  293    HA   ALA  45           HA       ALA  45  -2.419   8.450   2.066
  294   1HB   ALA  45          1HB       ALA  45  -3.518  11.032   0.965
  295   2HB   ALA  45          2HB       ALA  45  -3.783  10.421   2.599
  296   3HB   ALA  45          3HB       ALA  45  -2.157  10.858   2.074
  297    H    ASN  46           H        ASN  46  -4.243   9.241  -0.872
  298    HA   ASN  46           HA       ASN  46  -6.289   7.336   0.047
  299   1HB   ASN  46          1HB       ASN  46  -7.167   9.677  -0.032
  300   2HB   ASN  46          2HB       ASN  46  -6.801   9.723  -1.755
  301   1HD2  ASN  46          1HD2      ASN  46 -10.224   8.228  -0.458
  302   2HD2  ASN  46          2HD2      ASN  46  -9.119   9.114   0.518
  303    H    TYR  47           H        TYR  47  -5.972   5.538  -1.029
  304    HA   TYR  47           HA       TYR  47  -4.589   5.443  -3.495
  305   1HB   TYR  47          1HB       TYR  47  -4.538   3.641  -1.778
  306   2HB   TYR  47          2HB       TYR  47  -6.191   3.231  -2.215
  307    HD1  TYR  47           1HD      TYR  47  -6.647   2.430  -4.598
  308    HD2  TYR  47           2HD      TYR  47  -2.715   2.814  -3.019
  309    HE1  TYR  47           1HE      TYR  47  -5.783   0.952  -6.366
  310    HE2  TYR  47           2HE      TYR  47  -1.860   1.341  -4.783
  311    HH   TYR  47           HH       TYR  47  -3.390  -0.683  -6.394
  312    H    ASP  48           H        ASP  48  -8.036   5.286  -2.681
  313    HA   ASP  48           HA       ASP  48  -9.040   4.410  -5.103
  314   1HB   ASP  48          1HB       ASP  48 -10.146   6.411  -3.148
  315   2HB   ASP  48          2HB       ASP  48 -11.044   5.877  -4.559
  316    H    ASP  49           H        ASP  49  -7.890   7.587  -4.212
  317    HA   ASP  49           HA       ASP  49  -8.802   8.927  -6.558
  318   1HB   ASP  49          1HB       ASP  49  -6.831   9.690  -4.407
  319   2HB   ASP  49          2HB       ASP  49  -7.255  10.750  -5.740
  320    H    ASP  50           H        ASP  50  -5.442   8.548  -5.454
  321    HA   ASP  50           HA       ASP  50  -4.492   8.933  -8.148
  322   1HB   ASP  50          1HB       ASP  50  -3.057   8.586  -5.526
  323   2HB   ASP  50          2HB       ASP  50  -2.230   8.816  -7.063
  324    H    ARG  51           H        ARG  51  -5.118   6.158  -6.232
  325    HA   ARG  51           HA       ARG  51  -4.537   3.990  -6.359
  326   1HB   ARG  51          1HB       ARG  51  -4.816   4.672  -9.259
  327   2HB   ARG  51          2HB       ARG  51  -4.918   3.053  -8.575
  328   1HG   ARG  51          1HG       ARG  51  -6.678   4.271  -7.009
  329   2HG   ARG  51          2HG       ARG  51  -6.832   5.297  -8.435
  330   1HD   ARG  51          1HD       ARG  51  -6.895   2.331  -8.633
  331   2HD   ARG  51          2HD       ARG  51  -8.337   3.254  -8.204
  332    HE   ARG  51           HE       ARG  51  -7.301   4.416 -10.498
  333   1HH1  ARG  51          1HH1      ARG  51  -8.582   1.298  -9.580
  334   2HH1  ARG  51          2HH1      ARG  51  -9.218   0.959 -11.158
  335   1HH2  ARG  51          1HH2      ARG  51  -8.171   3.978 -12.564
  336   2HH2  ARG  51          2HH2      ARG  51  -8.993   2.473 -12.847
  337    H    LYS  52           H        LYS  52  -2.243   5.116  -5.771
  338    HA   LYS  52           HA       LYS  52  -0.323   3.826  -7.574
  339   1HB   LYS  52          1HB       LYS  52   0.022   6.250  -5.796
  340   2HB   LYS  52          2HB       LYS  52   1.375   5.405  -6.544
  341   1HG   LYS  52          1HG       LYS  52   0.567   5.901  -8.740
  342   2HG   LYS  52          2HG       LYS  52  -0.936   6.545  -8.091
  343   1HD   LYS  52          1HD       LYS  52   0.318   8.359  -7.027
  344   2HD   LYS  52          2HD       LYS  52   1.816   7.719  -7.713
  345   1HE   LYS  52          1HE       LYS  52   0.826   7.996  -9.978
  346   2HE   LYS  52          2HE       LYS  52  -0.581   8.757  -9.239
  347   1HZ   LYS  52          1HZ       LYS  52   2.075   9.843  -8.626
  348   2HZ   LYS  52          2HZ       LYS  52   1.398  10.168 -10.153
  349   3HZ   LYS  52          3HZ       LYS  52   0.572  10.637  -8.742
  350    H    TRP  53           H        TRP  53   0.566   2.100  -6.821
  351    HA   TRP  53           HA       TRP  53   0.619   1.662  -3.918
  352   1HB   TRP  53          1HB       TRP  53  -0.110  -0.600  -4.326
  353   2HB   TRP  53          2HB       TRP  53  -1.224   0.516  -5.008
  354    HD1  TRP  53           HD1      TRP  53  -0.659   0.973  -7.849
  355    HE1  TRP  53           1HE      TRP  53  -0.217  -0.898  -9.567
  356    HE3  TRP  53           3HE      TRP  53   0.600  -2.630  -4.607
  357    HZ2  TRP  53           2HZ      TRP  53   0.557  -3.650  -9.498
  358    HZ3  TRP  53           3HZ      TRP  53   1.174  -4.899  -5.452
  359    HH2  TRP  53           HH2      TRP  53   1.155  -5.388  -7.854
  360    H    GLY  54           H        GLY  54   1.867  -0.303  -3.351
  361   1HA   GLY  54          1HA       GLY  54   4.098  -1.113  -4.956
  362   2HA   GLY  54          2HA       GLY  54   4.566   0.023  -3.694
  363    H    PHE  55           H        PHE  55   4.999  -2.974  -4.132
  364    HA   PHE  55           HA       PHE  55   3.635  -4.440  -2.167
  365   1HB   PHE  55          1HB       PHE  55   6.297  -4.761  -3.519
  366   2HB   PHE  55          2HB       PHE  55   5.748  -5.893  -2.303
  367    HD1  PHE  55           1HD      PHE  55   2.790  -5.115  -3.721
  368    HD2  PHE  55           2HD      PHE  55   6.458  -6.999  -4.766
  369    HE1  PHE  55           1HE      PHE  55   1.620  -6.445  -5.438
  370    HE2  PHE  55           2HE      PHE  55   5.296  -8.332  -6.475
  371    HZ   PHE  55           HZ       PHE  55   2.874  -8.039  -6.825
  372    H    CYS  56           H        CYS  56   4.476  -5.298  -0.196
  373    HA   CYS  56           HA       CYS  56   6.048  -3.332   1.296
  374   1HB   CYS  56          1HB       CYS  56   4.240  -5.596   2.165
  375   2HB   CYS  56          2HB       CYS  56   5.292  -4.730   3.290
  376    HA   PRO  57           HA       PRO  57   9.500  -6.074   0.920
  377   1HB   PRO  57          1HB       PRO  57  11.290  -4.756   2.318
  378   2HB   PRO  57          2HB       PRO  57  10.622  -4.055   0.830
  379   1HG   PRO  57          1HG       PRO  57   9.705  -3.665   3.653
  380   2HG   PRO  57          2HG       PRO  57  10.195  -2.397   2.507
  381   1HD   PRO  57          1HD       PRO  57   7.624  -3.022   2.877
  382   2HD   PRO  57          2HD       PRO  57   8.238  -2.669   1.243
  383    H    ASP  58           H        ASP  58   7.633  -6.034   3.391
  384    HA   ASP  58           HA       ASP  58   9.303  -7.884   4.963
  385   1HB   ASP  58          1HB       ASP  58   8.837  -5.657   6.092
  386   2HB   ASP  58          2HB       ASP  58   7.144  -6.141   6.157
  387    H    GLN  59           H        GLN  59   8.436  -9.631   3.769
  388    HA   GLN  59           HA       GLN  59   5.596 -10.084   3.705
  389   1HB   GLN  59          1HB       GLN  59   7.984 -11.700   2.852
  390   2HB   GLN  59          2HB       GLN  59   6.360 -12.367   2.797
  391   1HG   GLN  59          1HG       GLN  59   7.180  -9.840   1.383
  392   2HG   GLN  59          2HG       GLN  59   7.188 -11.438   0.639
  393   1HE2  GLN  59          1HE2      GLN  59   3.837 -11.372  -0.152
  394   2HE2  GLN  59          2HE2      GLN  59   5.403 -12.076  -0.345
  395    H    GLY  60           H        GLY  60   4.553 -11.958   4.598
  396   1HA   GLY  60          1HA       GLY  60   5.550 -13.765   6.392
  397   2HA   GLY  60          2HA       GLY  60   5.244 -12.327   7.354
  Start of MODEL    3
    1    H    SER   1           1H       SER   1   9.911   6.203   5.550
    2    HA   SER   1           HA       SER   1  10.934   3.654   6.301
    3   1HB   SER   1          1HB       SER   1   9.036   4.098   4.753
    4   2HB   SER   1          2HB       SER   1  10.154   4.908   3.649
    5    HG   SER   1           HG       SER   1   9.565   2.448   3.516
    6    H    TRP   2           H        TRP   2  12.712   2.615   5.284
    7    HA   TRP   2           HA       TRP   2  14.778   4.472   4.288
    8   1HB   TRP   2          1HB       TRP   2  15.107   2.082   6.106
    9   2HB   TRP   2          2HB       TRP   2  16.450   2.830   5.251
   10    HD1  TRP   2           HD1      TRP   2  13.751   3.848   7.851
   11    HE1  TRP   2           1HE      TRP   2  14.801   5.611   9.410
   12    HE3  TRP   2           3HE      TRP   2  18.298   4.348   5.565
   13    HZ2  TRP   2           2HZ      TRP   2  17.236   7.002   9.649
   14    HZ3  TRP   2           3HZ      TRP   2  19.937   5.904   6.534
   15    HH2  TRP   2           HH2      TRP   2  19.413   7.203   8.530
   16    H    MET   3           H        MET   3  12.945   1.667   3.673
   17    HA   MET   3           HA       MET   3  14.738   0.995   1.463
   18   1HB   MET   3          1HB       MET   3  13.606  -1.338   1.734
   19   2HB   MET   3          2HB       MET   3  14.951  -0.893   2.770
   20   1HG   MET   3          1HG       MET   3  13.373  -0.281   4.542
   21   2HG   MET   3          2HG       MET   3  12.026  -0.715   3.490
   22   1HE   MET   3          1HE       MET   3  11.623  -1.630   5.845
   23   2HE   MET   3          2HE       MET   3  11.632  -3.386   5.992
   24   3HE   MET   3          3HE       MET   3  12.944  -2.438   6.692
   25    H    SER   4           H        SER   4  12.318   2.719   1.680
   26    HA   SER   4           HA       SER   4  10.371   3.195   0.525
   27   1HB   SER   4          1HB       SER   4  12.249   3.389  -1.147
   28   2HB   SER   4          2HB       SER   4  11.833   1.772  -1.705
   29    HG   SER   4           HG       SER   4  10.564   2.883  -2.993
   30    H    THR   5           H        THR   5   9.424   1.709  -1.774
   31    HA   THR   5           HA       THR   5   8.141  -0.548  -0.394
   32    HB   THR   5           HB       THR   5   6.358  -0.165  -2.206
   33    HG1  THR   5           1HG      THR   5   7.229   2.490  -2.258
   34   1HG2  THR   5          1HG2      THR   5   5.487   1.970  -1.012
   35   2HG2  THR   5          2HG2      THR   5   5.533   0.417  -0.172
   36   3HG2  THR   5          3HG2      THR   5   6.795   1.616   0.116
   37    H    VAL   6           H        VAL   6   7.256  -2.166  -1.974
   38    HA   VAL   6           HA       VAL   6   9.199  -2.723  -4.133
   39    HB   VAL   6           HB       VAL   6   7.596  -5.005  -3.312
   40   1HG1  VAL   6          1HG1      VAL   6  10.419  -4.401  -3.946
   41   2HG1  VAL   6          2HG1      VAL   6  10.095  -5.844  -2.986
   42   3HG1  VAL   6          3HG1      VAL   6   9.354  -5.656  -4.578
   43   1HG2  VAL   6          1HG2      VAL   6   8.502  -3.439  -1.167
   44   2HG2  VAL   6          2HG2      VAL   6   7.818  -5.062  -1.115
   45   3HG2  VAL   6          3HG2      VAL   6   9.563  -4.846  -1.254
   46    H    GLY   7           H        GLY   7   7.713  -4.684  -5.352
   47   1HA   GLY   7          1HA       GLY   7   6.173  -4.763  -7.092
   48   2HA   GLY   7          2HA       GLY   7   5.073  -4.543  -5.769
   49    H    GLY   8           H        GLY   8   3.604  -3.176  -6.232
   50   1HA   GLY   8          1HA       GLY   8   2.466  -1.437  -7.190
   51   2HA   GLY   8          2HA       GLY   8   3.686  -0.529  -6.329
   52    H    ASN   9           H        ASN   9   3.898   1.137  -7.619
   53    HA   ASN   9           HA       ASN   9   5.269   0.751 -10.143
   54   1HB   ASN   9          1HB       ASN   9   3.611   2.783 -10.893
   55   2HB   ASN   9          2HB       ASN   9   3.384   1.110 -11.344
   56   1HD2  ASN   9          1HD2      ASN   9   0.759   2.996  -9.007
   57   2HD2  ASN   9          2HD2      ASN   9   2.201   3.730  -9.616
   58    H    SER  10           H        SER  10   4.424   2.559  -7.368
   59    HA   SER  10           HA       SER  10   5.425   5.087  -7.928
   60   1HB   SER  10          1HB       SER  10   5.642   3.693  -5.248
   61   2HB   SER  10          2HB       SER  10   5.452   5.417  -5.559
   62    HG   SER  10           HG       SER  10   3.430   4.719  -5.068
   63    H    GLY  11           H        GLY  11   7.096   2.196  -6.708
   64   1HA   GLY  11          1HA       GLY  11   9.303   1.590  -6.970
   65   2HA   GLY  11          2HA       GLY  11   9.558   3.063  -7.886
   66    H    GLY  12           H        GLY  12   9.912   5.051  -6.682
   67   1HA   GLY  12          1HA       GLY  12  11.412   4.457  -4.230
   68   2HA   GLY  12          2HA       GLY  12  11.643   5.862  -5.258
   69    H    ALA  13           H        ALA  13   8.592   4.609  -3.906
   70    HA   ALA  13           HA       ALA  13   8.456   7.051  -2.261
   71   1HB   ALA  13          1HB       ALA  13   6.773   6.387  -4.464
   72   2HB   ALA  13          2HB       ALA  13   5.821   6.350  -2.980
   73   3HB   ALA  13          3HB       ALA  13   6.719   7.804  -3.416
   74    HA   PRO  14           HA       PRO  14   7.366   4.098   0.858
   75   1HB   PRO  14          1HB       PRO  14   6.949   5.841   2.885
   76   2HB   PRO  14          2HB       PRO  14   8.562   5.476   2.258
   77   1HG   PRO  14          1HG       PRO  14   6.889   7.894   1.884
   78   2HG   PRO  14          2HG       PRO  14   8.650   7.728   1.859
   79   1HD   PRO  14          1HD       PRO  14   6.915   7.903  -0.382
   80   2HD   PRO  14          2HD       PRO  14   8.654   7.540  -0.402
   81    H    CYS  15           H        CYS  15   5.575   3.720   2.469
   82    HA   CYS  15           HA       CYS  15   3.037   4.118   1.163
   83   1HB   CYS  15          1HB       CYS  15   3.200   3.001   3.928
   84   2HB   CYS  15          2HB       CYS  15   2.219   2.474   2.566
   85    H    VAL  16           H        VAL  16   1.365   5.442   1.825
   86    HA   VAL  16           HA       VAL  16   1.982   7.348   3.985
   87    HB   VAL  16           HB       VAL  16  -0.089   7.516   1.782
   88   1HG1  VAL  16          1HG1      VAL  16   0.083   8.913   4.295
   89   2HG1  VAL  16          2HG1      VAL  16   0.278  10.037   2.951
   90   3HG1  VAL  16          3HG1      VAL  16  -1.153   9.014   3.035
   91   1HG2  VAL  16          1HG2      VAL  16   2.620   8.024   1.648
   92   2HG2  VAL  16          2HG2      VAL  16   1.390   8.651   0.550
   93   3HG2  VAL  16          3HG2      VAL  16   1.918   9.617   1.927
   94    H    PHE  17           H        PHE  17   1.212   6.681   5.879
   95    HA   PHE  17           HA       PHE  17  -1.383   5.310   5.952
   96   1HB   PHE  17          1HB       PHE  17   1.008   5.173   7.777
   97   2HB   PHE  17          2HB       PHE  17  -0.552   4.487   8.191
   98    HD1  PHE  17           1HD      PHE  17  -0.889   3.794   5.036
   99    HD2  PHE  17           2HD      PHE  17   1.890   2.903   8.121
  100    HE1  PHE  17           1HE      PHE  17  -0.261   1.723   3.874
  101    HE2  PHE  17           2HE      PHE  17   2.533   0.834   6.977
  102    HZ   PHE  17           HZ       PHE  17   1.465   0.211   4.836
  103    HA   PRO  18           HA       PRO  18  -2.813   4.774   7.105
  104   1HB   PRO  18          1HB       PRO  18  -5.417   5.715   7.653
  105   2HB   PRO  18          2HB       PRO  18  -4.421   4.697   8.693
  106   1HG   PRO  18          1HG       PRO  18  -5.205   7.324   9.247
  107   2HG   PRO  18          2HG       PRO  18  -3.914   6.432  10.068
  108   1HD   PRO  18          1HD       PRO  18  -3.728   8.465   7.890
  109   2HD   PRO  18          2HD       PRO  18  -2.624   8.157   9.249
  110    H    PHE  19           H        PHE  19  -3.533   4.177   5.098
  111    HA   PHE  19           HA       PHE  19  -4.530   6.373   3.419
  112   1HB   PHE  19          1HB       PHE  19  -3.977   5.105   1.454
  113   2HB   PHE  19          2HB       PHE  19  -2.574   5.154   2.506
  114    HD1  PHE  19           1HD      PHE  19  -1.943   3.105   3.787
  115    HD2  PHE  19           2HD      PHE  19  -4.930   3.070   0.762
  116    HE1  PHE  19           1HE      PHE  19  -1.697   0.667   3.588
  117    HE2  PHE  19           2HE      PHE  19  -4.701   0.626   0.557
  118    HZ   PHE  19           HZ       PHE  19  -3.083  -0.577   1.959
  119    H    THR  20           H        THR  20  -5.982   5.034   1.521
  120    HA   THR  20           HA       THR  20  -7.994   3.516   3.019
  121    HB   THR  20           HB       THR  20  -8.649   5.984   1.374
  122    HG1  THR  20           1HG      THR  20  -8.169   5.609   4.093
  123   1HG2  THR  20          1HG2      THR  20 -10.858   5.737   2.644
  124   2HG2  THR  20          2HG2      THR  20 -10.559   4.686   1.258
  125   3HG2  THR  20          3HG2      THR  20 -10.359   4.061   2.892
  126    H    PHE  21           H        PHE  21  -8.736   1.873   1.938
  127    HA   PHE  21           HA       PHE  21  -8.720   1.935  -1.000
  128   1HB   PHE  21          1HB       PHE  21  -6.757   0.640   0.097
  129   2HB   PHE  21          2HB       PHE  21  -7.973  -0.532   0.545
  130    HD1  PHE  21           1HD      PHE  21  -8.458   1.187  -2.630
  131    HD2  PHE  21           2HD      PHE  21  -6.742  -2.189  -0.708
  132    HE1  PHE  21           1HE      PHE  21  -8.180   0.082  -4.799
  133    HE2  PHE  21           2HE      PHE  21  -6.463  -3.306  -2.862
  134    HZ   PHE  21           HZ       PHE  21  -7.169  -2.169  -4.938
  135    H    LEU  22           H        LEU  22 -10.417   0.910  -1.912
  136    HA   LEU  22           HA       LEU  22 -12.586   0.437  -2.134
  137   1HB   LEU  22          1HB       LEU  22 -11.347  -1.716  -0.544
  138   2HB   LEU  22          2HB       LEU  22 -12.903  -1.918  -1.336
  139    HG   LEU  22           HG       LEU  22 -11.778  -2.542  -3.158
  140   1HD1  LEU  22          1HD1      LEU  22 -10.818   0.187  -3.076
  141   2HD1  LEU  22          2HD1      LEU  22 -10.048  -0.947  -4.182
  142   3HD1  LEU  22          3HD1      LEU  22 -11.782  -0.645  -4.297
  143   1HD2  LEU  22          1HD2      LEU  22 -10.040  -2.967  -1.243
  144   2HD2  LEU  22          2HD2      LEU  22  -9.793  -3.427  -2.926
  145   3HD2  LEU  22          3HD2      LEU  22  -9.106  -1.921  -2.312
  146    H    GLY  23           H        GLY  23 -12.271   2.214   0.150
  147   1HA   GLY  23          1HA       GLY  23 -14.104   3.053   1.414
  148   2HA   GLY  23          2HA       GLY  23 -14.733   1.421   1.532
  149    H    ASN  24           H        ASN  24 -11.661   0.803   2.338
  150    HA   ASN  24           HA       ASN  24 -12.213   1.390   5.178
  151   1HB   ASN  24          1HB       ASN  24 -10.521  -0.776   3.907
  152   2HB   ASN  24          2HB       ASN  24 -10.725  -0.536   5.635
  153   1HD2  ASN  24          1HD2      ASN  24 -13.397  -2.605   3.519
  154   2HD2  ASN  24          2HD2      ASN  24 -11.901  -2.026   2.882
  155    H    LYS  25           H        LYS  25 -10.487   1.909   6.565
  156    HA   LYS  25           HA       LYS  25  -8.449   3.515   5.292
  157   1HB   LYS  25          1HB       LYS  25  -9.061   3.246   8.234
  158   2HB   LYS  25          2HB       LYS  25  -8.266   4.555   7.407
  159   1HG   LYS  25          1HG       LYS  25 -10.283   5.548   7.657
  160   2HG   LYS  25          2HG       LYS  25 -10.605   4.685   6.153
  161   1HD   LYS  25          1HD       LYS  25 -12.447   4.318   7.656
  162   2HD   LYS  25          2HD       LYS  25 -11.545   2.811   7.485
  163   1HE   LYS  25          1HE       LYS  25 -10.331   3.439   9.611
  164   2HE   LYS  25          2HE       LYS  25 -11.517   4.733   9.803
  165   1HZ   LYS  25          1HZ       LYS  25 -13.180   2.746   9.451
  166   2HZ   LYS  25          2HZ       LYS  25 -11.864   1.837  10.028
  167   3HZ   LYS  25          3HZ       LYS  25 -12.515   3.082  10.982
  168    H    TYR  26           H        TYR  26  -6.377   2.758   5.154
  169    HA   TYR  26           HA       TYR  26  -5.791   0.372   6.745
  170   1HB   TYR  26          1HB       TYR  26  -4.616   1.268   4.120
  171   2HB   TYR  26          2HB       TYR  26  -4.150  -0.179   5.001
  172    HD1  TYR  26           1HD      TYR  26  -7.145   1.454   3.488
  173    HD2  TYR  26           2HD      TYR  26  -5.225  -2.180   4.550
  174    HE1  TYR  26           1HE      TYR  26  -8.924   0.198   2.385
  175    HE2  TYR  26           2HE      TYR  26  -6.998  -3.447   3.438
  176    HH   TYR  26           HH       TYR  26  -9.294  -2.008   1.389
  177    H    GLU  27           H        GLU  27  -4.670   0.797   8.403
  178    HA   GLU  27           HA       GLU  27  -2.816   3.023   8.537
  179   1HB   GLU  27          1HB       GLU  27  -3.729   1.039  10.607
  180   2HB   GLU  27          2HB       GLU  27  -2.725   2.430  10.915
  181   1HG   GLU  27          1HG       GLU  27  -4.514   3.921  10.245
  182   2HG   GLU  27          2HG       GLU  27  -5.527   2.530   9.857
  183    H    SER  28           H        SER  28  -2.757  -0.204   7.772
  184    HA   SER  28           HA       SER  28   0.142  -0.346   8.070
  185   1HB   SER  28          1HB       SER  28  -0.369  -2.865   8.543
  186   2HB   SER  28          2HB       SER  28  -0.541  -1.707   9.862
  187    HG   SER  28           HG       SER  28  -2.355  -3.357   9.106
  188    H    CYS  29           H        CYS  29   0.564  -2.769   6.807
  189    HA   CYS  29           HA       CYS  29  -0.073  -2.106   4.116
  190   1HB   CYS  29          1HB       CYS  29   1.164  -4.583   5.298
  191   2HB   CYS  29          2HB       CYS  29   0.943  -4.338   3.582
  192    H    THR  30           H        THR  30  -1.047  -3.767   2.659
  193    HA   THR  30           HA       THR  30  -3.212  -5.306   3.884
  194    HB   THR  30           HB       THR  30  -4.204  -3.070   3.393
  195    HG1  THR  30           1HG      THR  30  -5.650  -4.680   3.128
  196   1HG2  THR  30          1HG2      THR  30  -4.007  -3.470   0.479
  197   2HG2  THR  30          2HG2      THR  30  -4.072  -1.984   1.424
  198   3HG2  THR  30          3HG2      THR  30  -2.558  -2.877   1.290
  199    H    SER  31           H        SER  31  -4.359  -6.571   2.143
  200    HA   SER  31           HA       SER  31  -2.547  -7.220  -0.077
  201   1HB   SER  31          1HB       SER  31  -3.383  -9.610   0.178
  202   2HB   SER  31          2HB       SER  31  -2.323  -9.047   1.478
  203    HG   SER  31           HG       SER  31  -4.173 -10.117   2.293
  204    H    ALA  32           H        ALA  32  -4.955  -5.541   0.561
  205    HA   ALA  32           HA       ALA  32  -7.278  -6.494  -0.648
  206   1HB   ALA  32          1HB       ALA  32  -6.504  -4.169   0.645
  207   2HB   ALA  32          2HB       ALA  32  -6.842  -3.628  -0.999
  208   3HB   ALA  32          3HB       ALA  32  -8.091  -4.461  -0.075
  209    H    GLY  33           H        GLY  33  -8.114  -6.374  -2.684
  210   1HA   GLY  33          1HA       GLY  33  -8.156  -6.108  -4.972
  211   2HA   GLY  33          2HA       GLY  33  -6.828  -4.969  -4.808
  212    H    ARG  34           H        ARG  34  -5.689  -7.563  -3.256
  213    HA   ARG  34           HA       ARG  34  -4.444  -8.588  -5.703
  214   1HB   ARG  34          1HB       ARG  34  -3.484  -8.684  -2.847
  215   2HB   ARG  34          2HB       ARG  34  -2.642  -9.377  -4.211
  216   1HG   ARG  34          1HG       ARG  34  -2.814  -6.880  -5.105
  217   2HG   ARG  34          2HG       ARG  34  -2.896  -6.554  -3.377
  218   1HD   ARG  34          1HD       ARG  34  -0.586  -6.499  -4.264
  219   2HD   ARG  34          2HD       ARG  34  -0.822  -7.709  -2.994
  220    HE   ARG  34           HE       ARG  34  -0.314  -9.341  -4.504
  221   1HH1  ARG  34          1HH1      ARG  34  -1.129  -6.444  -6.314
  222   2HH1  ARG  34          2HH1      ARG  34  -0.712  -7.132  -7.847
  223   1HH2  ARG  34          1HH2      ARG  34   0.214 -10.245  -6.536
  224   2HH2  ARG  34          2HH2      ARG  34   0.059  -9.283  -7.975
  225    H    SER  35           H        SER  35  -4.902  -9.913  -2.444
  226    HA   SER  35           HA       SER  35  -5.634 -11.925  -1.678
  227   1HB   SER  35          1HB       SER  35  -7.286 -11.916  -4.219
  228   2HB   SER  35          2HB       SER  35  -7.531 -12.999  -2.848
  229    HG   SER  35           HG       SER  35  -8.230 -11.332  -1.632
  230    H    ASP  36           H        ASP  36  -3.323 -11.678  -3.530
  231    HA   ASP  36           HA       ASP  36  -3.261 -14.359  -4.673
  232   1HB   ASP  36          1HB       ASP  36  -1.842 -13.562  -6.290
  233   2HB   ASP  36          2HB       ASP  36  -2.731 -12.101  -5.925
  234    H    GLY  37           H        GLY  37  -1.741 -12.203  -2.466
  235   1HA   GLY  37          1HA       GLY  37  -0.876 -13.823  -0.555
  236   2HA   GLY  37          2HA       GLY  37   0.350 -14.119  -1.779
  237    H    LYS  38           H        LYS  38   1.171 -11.880  -2.755
  238    HA   LYS  38           HA       LYS  38   2.679 -10.657  -0.777
  239   1HB   LYS  38          1HB       LYS  38   1.914  -9.563  -3.480
  240   2HB   LYS  38          2HB       LYS  38   3.258  -9.015  -2.493
  241   1HG   LYS  38          1HG       LYS  38   4.192 -10.373  -4.129
  242   2HG   LYS  38          2HG       LYS  38   4.177 -11.371  -2.689
  243   1HD   LYS  38          1HD       LYS  38   2.422 -12.687  -3.514
  244   2HD   LYS  38          2HD       LYS  38   1.971 -11.482  -4.722
  245   1HE   LYS  38          1HE       LYS  38   4.453 -13.193  -4.711
  246   2HE   LYS  38          2HE       LYS  38   3.074 -13.341  -5.802
  247   1HZ   LYS  38          1HZ       LYS  38   3.647 -10.892  -6.366
  248   2HZ   LYS  38          2HZ       LYS  38   5.178 -11.273  -5.738
  249   3HZ   LYS  38          3HZ       LYS  38   4.561 -12.139  -7.065
  250    H    MET  39           H        MET  39   2.420  -8.913   0.487
  251    HA   MET  39           HA       MET  39  -0.147  -7.519   0.354
  252   1HB   MET  39          1HB       MET  39   1.912  -7.503   2.578
  253   2HB   MET  39          2HB       MET  39   0.295  -6.828   2.626
  254   1HG   MET  39          1HG       MET  39  -0.689  -9.017   2.479
  255   2HG   MET  39          2HG       MET  39   0.906  -9.751   2.306
  256   1HE   MET  39          1HE       MET  39  -0.250  -6.804   4.451
  257   2HE   MET  39          2HE       MET  39  -1.542  -7.886   4.971
  258   3HE   MET  39          3HE       MET  39  -0.266  -7.424   6.100
  259    H    TRP  40           H        TRP  40  -0.171  -5.227   0.409
  260    HA   TRP  40           HA       TRP  40   2.375  -3.920  -0.232
  261   1HB   TRP  40          1HB       TRP  40   1.213  -2.633  -2.012
  262   2HB   TRP  40          2HB       TRP  40   1.287  -4.358  -2.367
  263    HD1  TRP  40           HD1      TRP  40  -1.155  -5.731  -1.750
  264    HE1  TRP  40           1HE      TRP  40  -3.561  -4.880  -2.060
  265    HE3  TRP  40           3HE      TRP  40  -0.220  -0.724  -2.055
  266    HZ2  TRP  40           2HZ      TRP  40  -4.874  -2.421  -2.366
  267    HZ3  TRP  40           3HZ      TRP  40  -2.119   0.815  -2.332
  268    HH2  TRP  40           HH2      TRP  40  -4.398  -0.024  -2.490
  269    H    CYS  41           H        CYS  41   1.545  -1.415  -0.665
  270    HA   CYS  41           HA       CYS  41  -0.282  -0.469   1.374
  271   1HB   CYS  41          1HB       CYS  41   1.462   0.984   2.425
  272   2HB   CYS  41          2HB       CYS  41   1.738  -0.734   2.712
  273    H    ALA  42           H        ALA  42  -1.044   1.602   0.817
  274    HA   ALA  42           HA       ALA  42  -0.428   2.452  -1.856
  275   1HB   ALA  42          1HB       ALA  42  -2.357   3.303   0.239
  276   2HB   ALA  42          2HB       ALA  42  -1.935   4.466  -1.021
  277   3HB   ALA  42          3HB       ALA  42  -2.628   2.905  -1.458
  278    H    THR  43           H        THR  43   0.578   4.346  -2.499
  279    HA   THR  43           HA       THR  43   2.353   5.470  -0.466
  280    HB   THR  43           HB       THR  43   3.725   6.230  -2.351
  281    HG1  THR  43           1HG      THR  43   2.535   6.589  -4.072
  282   1HG2  THR  43          1HG2      THR  43   3.680   3.726  -3.502
  283   2HG2  THR  43          2HG2      THR  43   4.638   4.213  -2.103
  284   3HG2  THR  43          3HG2      THR  43   3.065   3.446  -1.875
  285    H    THR  44           H        THR  44  -0.570   6.062  -1.338
  286    HA   THR  44           HA       THR  44  -0.283   8.985  -1.236
  287    HB   THR  44           HB       THR  44  -2.436   9.091  -2.571
  288    HG1  THR  44           1HG      THR  44  -3.382   7.264  -2.937
  289   1HG2  THR  44          1HG2      THR  44  -1.339   8.320  -4.779
  290   2HG2  THR  44          2HG2      THR  44  -0.646   9.676  -3.893
  291   3HG2  THR  44          3HG2      THR  44   0.097   8.078  -3.783
  292    H    ALA  45           H        ALA  45  -2.012  10.051  -0.059
  293    HA   ALA  45           HA       ALA  45  -2.784   8.758   2.306
  294   1HB   ALA  45          1HB       ALA  45  -2.981  11.359   1.245
  295   2HB   ALA  45          2HB       ALA  45  -4.609  10.884   1.738
  296   3HB   ALA  45          3HB       ALA  45  -3.286  10.838   2.901
  297    H    ASN  46           H        ASN  46  -4.489   9.229  -0.734
  298    HA   ASN  46           HA       ASN  46  -6.506   7.292   0.189
  299   1HB   ASN  46          1HB       ASN  46  -7.401   9.684  -0.117
  300   2HB   ASN  46          2HB       ASN  46  -7.109   9.452  -1.840
  301   1HD2  ASN  46          1HD2      ASN  46 -10.444   8.141  -0.188
  302   2HD2  ASN  46          2HD2      ASN  46  -9.342   9.250   0.544
  303    H    TYR  47           H        TYR  47  -6.055   5.473  -0.835
  304    HA   TYR  47           HA       TYR  47  -4.470   5.410  -3.172
  305   1HB   TYR  47          1HB       TYR  47  -4.473   3.576  -1.520
  306   2HB   TYR  47          2HB       TYR  47  -6.114   3.157  -2.014
  307    HD1  TYR  47           1HD      TYR  47  -2.755   3.736  -3.554
  308    HD2  TYR  47           2HD      TYR  47  -6.374   1.515  -3.579
  309    HE1  TYR  47           1HE      TYR  47  -1.873   2.334  -5.364
  310    HE2  TYR  47           2HE      TYR  47  -5.500   0.103  -5.377
  311    HH   TYR  47           HH       TYR  47  -2.745  -0.440  -6.126
  312    H    ASP  48           H        ASP  48  -7.966   4.997  -2.696
  313    HA   ASP  48           HA       ASP  48  -8.530   4.138  -5.285
  314   1HB   ASP  48          1HB       ASP  48 -10.162   5.540  -3.199
  315   2HB   ASP  48          2HB       ASP  48 -10.836   5.192  -4.787
  316    H    ASP  49           H        ASP  49  -7.944   7.304  -4.028
  317    HA   ASP  49           HA       ASP  49  -8.963   8.812  -6.203
  318   1HB   ASP  49          1HB       ASP  49  -7.248   9.380  -3.841
  319   2HB   ASP  49          2HB       ASP  49  -7.171  10.515  -5.183
  320    H    ASP  50           H        ASP  50  -5.555   8.246  -5.281
  321    HA   ASP  50           HA       ASP  50  -4.741   9.011  -7.976
  322   1HB   ASP  50          1HB       ASP  50  -3.185   8.555  -5.439
  323   2HB   ASP  50          2HB       ASP  50  -2.428   8.940  -6.979
  324    H    ARG  51           H        ARG  51  -4.969   6.137  -6.069
  325    HA   ARG  51           HA       ARG  51  -4.389   4.009  -6.362
  326   1HB   ARG  51          1HB       ARG  51  -4.732   4.748  -9.247
  327   2HB   ARG  51          2HB       ARG  51  -4.730   3.106  -8.603
  328   1HG   ARG  51          1HG       ARG  51  -6.493   4.517  -7.003
  329   2HG   ARG  51          2HG       ARG  51  -6.870   5.033  -8.652
  330   1HD   ARG  51          1HD       ARG  51  -6.711   2.218  -7.624
  331   2HD   ARG  51          2HD       ARG  51  -8.186   3.116  -7.975
  332    HE   ARG  51           HE       ARG  51  -6.535   3.030 -10.269
  333   1HH1  ARG  51          1HH1      ARG  51  -8.643   1.009  -8.345
  334   2HH1  ARG  51          2HH1      ARG  51  -9.053  -0.043  -9.667
  335   1HH2  ARG  51          1HH2      ARG  51  -6.991   1.603 -11.983
  336   2HH2  ARG  51          2HH2      ARG  51  -8.117   0.307 -11.746
  337    H    LYS  52           H        LYS  52  -2.209   5.209  -5.692
  338    HA   LYS  52           HA       LYS  52  -0.182   3.981  -7.418
  339   1HB   LYS  52          1HB       LYS  52   0.004   6.529  -5.812
  340   2HB   LYS  52          2HB       LYS  52   1.447   5.626  -6.264
  341   1HG   LYS  52          1HG       LYS  52   0.542   5.771  -8.663
  342   2HG   LYS  52          2HG       LYS  52  -0.510   7.037  -8.037
  343   1HD   LYS  52          1HD       LYS  52   2.496   7.028  -7.779
  344   2HD   LYS  52          2HD       LYS  52   1.608   7.891  -9.038
  345   1HE   LYS  52          1HE       LYS  52   1.262   8.334  -6.069
  346   2HE   LYS  52          2HE       LYS  52   2.292   9.314  -7.115
  347   1HZ   LYS  52          1HZ       LYS  52  -0.451   9.012  -8.022
  348   2HZ   LYS  52          2HZ       LYS  52  -0.265   9.888  -6.574
  349   3HZ   LYS  52          3HZ       LYS  52   0.537  10.393  -7.977
  350    H    TRP  53           H        TRP  53   0.646   2.268  -6.548
  351    HA   TRP  53           HA       TRP  53   0.656   2.051  -3.619
  352   1HB   TRP  53          1HB       TRP  53  -0.057  -0.245  -3.857
  353   2HB   TRP  53          2HB       TRP  53  -1.190   0.817  -4.612
  354    HD1  TRP  53           HD1      TRP  53  -0.752   1.024  -7.478
  355    HE1  TRP  53           1HE      TRP  53  -0.251  -0.962  -9.048
  356    HE3  TRP  53           3HE      TRP  53   0.811  -2.235  -3.999
  357    HZ2  TRP  53           2HZ      TRP  53   0.707  -3.644  -8.783
  358    HZ3  TRP  53           3HZ      TRP  53   1.515  -4.520  -4.674
  359    HH2  TRP  53           HH2      TRP  53   1.461  -5.195  -7.035
  360    H    GLY  54           H        GLY  54   1.853   0.083  -2.912
  361   1HA   GLY  54          1HA       GLY  54   4.103  -0.790  -4.465
  362   2HA   GLY  54          2HA       GLY  54   4.548   0.317  -3.166
  363    H    PHE  55           H        PHE  55   4.937  -2.703  -3.598
  364    HA   PHE  55           HA       PHE  55   3.364  -4.107  -1.770
  365   1HB   PHE  55          1HB       PHE  55   6.107  -4.534  -2.896
  366   2HB   PHE  55          2HB       PHE  55   5.498  -5.588  -1.636
  367    HD1  PHE  55           1HD      PHE  55   2.565  -5.283  -2.777
  368    HD2  PHE  55           2HD      PHE  55   6.317  -6.413  -4.433
  369    HE1  PHE  55           1HE      PHE  55   1.398  -6.686  -4.428
  370    HE2  PHE  55           2HE      PHE  55   5.153  -7.804  -6.101
  371    HZ   PHE  55           HZ       PHE  55   2.700  -7.940  -6.101
  372    H    CYS  56           H        CYS  56   3.947  -4.971   0.292
  373    HA   CYS  56           HA       CYS  56   4.821  -3.019   2.166
  374   1HB   CYS  56          1HB       CYS  56   3.298  -5.212   2.403
  375   2HB   CYS  56          2HB       CYS  56   4.842  -5.952   2.813
  376    HA   PRO  57           HA       PRO  57   9.215  -3.544   1.925
  377   1HB   PRO  57          1HB       PRO  57  10.019  -3.218   4.466
  378   2HB   PRO  57          2HB       PRO  57   9.416  -1.882   3.471
  379   1HG   PRO  57          1HG       PRO  57   7.914  -3.628   5.366
  380   2HG   PRO  57          2HG       PRO  57   7.985  -1.852   5.370
  381   1HD   PRO  57          1HD       PRO  57   5.907  -3.060   4.261
  382   2HD   PRO  57          2HD       PRO  57   6.697  -1.729   3.377
  383    H    ASP  58           H        ASP  58  10.747  -4.481   4.166
  384    HA   ASP  58           HA       ASP  58  11.343  -7.047   3.440
  385   1HB   ASP  58          1HB       ASP  58  12.545  -5.416   5.068
  386   2HB   ASP  58          2HB       ASP  58  11.604  -6.229   6.316
  387    H    GLN  59           H        GLN  59  10.049  -8.739   3.337
  388    HA   GLN  59           HA       GLN  59   8.344  -9.356   5.656
  389   1HB   GLN  59          1HB       GLN  59   7.734  -9.787   2.724
  390   2HB   GLN  59          2HB       GLN  59   6.804 -10.503   4.030
  391   1HG   GLN  59          1HG       GLN  59   6.368  -8.169   4.849
  392   2HG   GLN  59          2HG       GLN  59   7.087  -7.600   3.342
  393   1HE2  GLN  59          1HE2      GLN  59   3.266  -8.646   3.436
  394   2HE2  GLN  59          2HE2      GLN  59   4.254  -8.370   4.828
  395    H    GLY  60           H        GLY  60   7.931 -11.645   5.962
  396   1HA   GLY  60          1HA       GLY  60   9.904 -13.410   4.693
  397   2HA   GLY  60          2HA       GLY  60   9.831 -13.325   6.449
  Start of MODEL    4
    1    H    SER   1           1H       SER   1   7.189   5.987   9.213
    2    HA   SER   1           HA       SER   1   9.337   6.098   8.711
    3   1HB   SER   1          1HB       SER   1   9.856   3.831   9.453
    4   2HB   SER   1          2HB       SER   1   9.148   3.159   7.980
    5    HG   SER   1           HG       SER   1  11.635   3.779   8.314
    6    H    TRP   2           H        TRP   2  10.403   6.589   6.724
    7    HA   TRP   2           HA       TRP   2   8.609   6.436   4.398
    8   1HB   TRP   2          1HB       TRP   2  10.792   8.421   5.066
    9   2HB   TRP   2          2HB       TRP   2   9.983   8.352   3.503
   10    HD1  TRP   2           HD1      TRP   2   8.861   8.662   7.217
   11    HE1  TRP   2           1HE      TRP   2   6.903  10.332   7.312
   12    HE3  TRP   2           3HE      TRP   2   8.482   9.739   2.238
   13    HZ2  TRP   2           2HZ      TRP   2   5.423  11.925   5.519
   14    HZ3  TRP   2           3HZ      TRP   2   6.776  11.359   1.504
   15    HH2  TRP   2           HH2      TRP   2   5.279  12.427   3.116
   16    H    MET   3           H        MET   3   9.678   4.157   4.542
   17    HA   MET   3           HA       MET   3  12.303   4.013   3.347
   18   1HB   MET   3          1HB       MET   3  12.015   1.596   3.484
   19   2HB   MET   3          2HB       MET   3  11.645   2.346   5.022
   20   1HG   MET   3          1HG       MET   3   9.263   2.107   4.575
   21   2HG   MET   3          2HG       MET   3   9.622   1.408   2.999
   22   1HE   MET   3          1HE       MET   3  10.255   1.280   6.683
   23   2HE   MET   3          2HE       MET   3  10.185  -0.423   7.129
   24   3HE   MET   3          3HE       MET   3  11.674   0.254   6.471
   25    H    SER   4           H        SER   4  11.978   1.840   1.617
   26    HA   SER   4           HA       SER   4  10.490   3.147  -0.558
   27   1HB   SER   4          1HB       SER   4  12.811   1.204  -0.722
   28   2HB   SER   4          2HB       SER   4  11.999   1.943  -2.106
   29    HG   SER   4           HG       SER   4  12.994   3.619  -0.093
   30    H    THR   5           H        THR   5   9.576   1.634  -2.209
   31    HA   THR   5           HA       THR   5   8.327  -0.646  -0.842
   32    HB   THR   5           HB       THR   5   6.595  -0.293  -2.717
   33    HG1  THR   5           1HG      THR   5   7.490   2.359  -2.729
   34   1HG2  THR   5          1HG2      THR   5   5.487   1.576  -1.547
   35   2HG2  THR   5          2HG2      THR   5   5.996   0.266  -0.483
   36   3HG2  THR   5          3HG2      THR   5   6.936   1.758  -0.556
   37    H    VAL   6           H        VAL   6   7.443  -2.260  -2.398
   38    HA   VAL   6           HA       VAL   6   9.376  -2.937  -4.527
   39    HB   VAL   6           HB       VAL   6   7.806  -5.185  -3.599
   40   1HG1  VAL   6          1HG1      VAL   6   9.783  -5.407  -4.970
   41   2HG1  VAL   6          2HG1      VAL   6  10.781  -4.727  -3.685
   42   3HG1  VAL   6          3HG1      VAL   6   9.986  -6.283  -3.451
   43   1HG2  VAL   6          1HG2      VAL   6   7.907  -3.971  -1.431
   44   2HG2  VAL   6          2HG2      VAL   6   8.698  -5.545  -1.409
   45   3HG2  VAL   6          3HG2      VAL   6   9.667  -4.074  -1.503
   46    H    GLY   7           H        GLY   7   7.911  -4.934  -5.667
   47   1HA   GLY   7          1HA       GLY   7   6.338  -5.086  -7.388
   48   2HA   GLY   7          2HA       GLY   7   5.263  -4.885  -6.033
   49    H    GLY   8           H        GLY   8   3.770  -3.509  -6.369
   50   1HA   GLY   8          1HA       GLY   8   2.560  -1.834  -7.423
   51   2HA   GLY   8          2HA       GLY   8   3.711  -0.909  -6.493
   52    H    ASN   9           H        ASN   9   4.075   0.793  -7.652
   53    HA   ASN   9           HA       ASN   9   5.607   0.584 -10.057
   54   1HB   ASN   9          1HB       ASN   9   4.073   1.963 -11.467
   55   2HB   ASN   9          2HB       ASN   9   3.500   0.340 -11.154
   56   1HD2  ASN   9          1HD2      ASN   9   1.443   2.590  -8.637
   57   2HD2  ASN   9          2HD2      ASN   9   3.082   2.099  -8.416
   58    H    SER  10           H        SER  10   5.954   1.628  -7.458
   59    HA   SER  10           HA       SER  10   5.953   4.529  -7.811
   60   1HB   SER  10          1HB       SER  10   6.933   4.085  -5.314
   61   2HB   SER  10          2HB       SER  10   5.216   4.271  -5.671
   62    HG   SER  10           HG       SER  10   6.387   2.194  -4.589
   63    H    GLY  11           H        GLY  11   8.107   1.773  -7.316
   64   1HA   GLY  11          1HA       GLY  11  10.331   1.639  -8.072
   65   2HA   GLY  11          2HA       GLY  11  10.340   3.383  -8.294
   66    H    GLY  12           H        GLY  12  10.155   4.651  -6.160
   67   1HA   GLY  12          1HA       GLY  12  11.595   3.253  -4.004
   68   2HA   GLY  12          2HA       GLY  12  12.233   4.756  -4.638
   69    H    ALA  13           H        ALA  13   8.897   4.873  -4.732
   70    HA   ALA  13           HA       ALA  13   8.796   6.812  -2.637
   71   1HB   ALA  13          1HB       ALA  13   7.374   6.636  -4.821
   72   2HB   ALA  13          2HB       ALA  13   6.332   5.616  -3.831
   73   3HB   ALA  13          3HB       ALA  13   6.648   7.281  -3.346
   74    HA   PRO  14           HA       PRO  14   7.674   4.040   0.632
   75   1HB   PRO  14          1HB       PRO  14   6.943   5.820   2.495
   76   2HB   PRO  14          2HB       PRO  14   8.616   5.723   1.926
   77   1HG   PRO  14          1HG       PRO  14   6.488   7.700   1.245
   78   2HG   PRO  14          2HG       PRO  14   8.227   7.953   1.464
   79   1HD   PRO  14          1HD       PRO  14   6.919   7.679  -0.986
   80   2HD   PRO  14          2HD       PRO  14   8.666   7.518  -0.721
   81    H    CYS  15           H        CYS  15   5.832   3.597   2.181
   82    HA   CYS  15           HA       CYS  15   3.298   3.964   0.750
   83   1HB   CYS  15          1HB       CYS  15   4.111   2.075   2.977
   84   2HB   CYS  15          2HB       CYS  15   2.446   2.263   2.436
   85    H    VAL  16           H        VAL  16   2.164   5.706   1.365
   86    HA   VAL  16           HA       VAL  16   2.624   7.045   3.841
   87    HB   VAL  16           HB       VAL  16   0.379   7.481   1.862
   88   1HG1  VAL  16          1HG1      VAL  16   0.246   8.467   4.250
   89   2HG1  VAL  16          2HG1      VAL  16   1.519   9.561   3.699
   90   3HG1  VAL  16          3HG1      VAL  16  -0.040   9.532   2.875
   91   1HG2  VAL  16          1HG2      VAL  16   3.179   7.907   1.589
   92   2HG2  VAL  16          2HG2      VAL  16   1.887   8.307   0.456
   93   3HG2  VAL  16          3HG2      VAL  16   2.382   9.479   1.681
   94    H    PHE  17           H        PHE  17   1.853   6.392   5.756
   95    HA   PHE  17           HA       PHE  17  -0.759   5.061   5.823
   96   1HB   PHE  17          1HB       PHE  17   1.640   4.808   7.623
   97   2HB   PHE  17          2HB       PHE  17   0.057   4.192   8.052
   98    HD1  PHE  17           1HD      PHE  17  -1.036   2.721   6.026
   99    HD2  PHE  17           2HD      PHE  17   3.096   3.322   6.806
  100    HE1  PHE  17           1HE      PHE  17  -0.504   0.641   4.829
  101    HE2  PHE  17           2HE      PHE  17   3.645   1.252   5.617
  102    HZ   PHE  17           HZ       PHE  17   1.853  -0.118   4.608
  103    HA   PRO  18           HA       PRO  18  -2.132   4.528   7.056
  104   1HB   PRO  18          1HB       PRO  18  -4.717   5.374   7.633
  105   2HB   PRO  18          2HB       PRO  18  -3.637   4.543   8.752
  106   1HG   PRO  18          1HG       PRO  18  -4.571   7.246   8.879
  107   2HG   PRO  18          2HG       PRO  18  -3.481   6.419   9.997
  108   1HD   PRO  18          1HD       PRO  18  -2.862   8.325   7.853
  109   2HD   PRO  18          2HD       PRO  18  -1.878   7.834   9.246
  110    H    PHE  19           H        PHE  19  -2.998   3.915   5.078
  111    HA   PHE  19           HA       PHE  19  -3.933   6.149   3.399
  112   1HB   PHE  19          1HB       PHE  19  -3.365   4.900   1.434
  113   2HB   PHE  19          2HB       PHE  19  -1.975   4.876   2.498
  114    HD1  PHE  19           1HD      PHE  19  -1.398   2.770   3.717
  115    HD2  PHE  19           2HD      PHE  19  -4.440   2.927   0.743
  116    HE1  PHE  19           1HE      PHE  19  -1.264   0.326   3.444
  117    HE2  PHE  19           2HE      PHE  19  -4.312   0.488   0.475
  118    HZ   PHE  19           HZ       PHE  19  -2.725  -0.818   1.818
  119    H    THR  20           H        THR  20  -5.407   4.939   1.521
  120    HA   THR  20           HA       THR  20  -7.384   3.302   2.906
  121    HB   THR  20           HB       THR  20  -8.026   5.936   1.526
  122    HG1  THR  20           1HG      THR  20  -7.359   6.368   3.577
  123   1HG2  THR  20          1HG2      THR  20  -9.945   4.070   2.887
  124   2HG2  THR  20          2HG2      THR  20 -10.318   5.605   2.104
  125   3HG2  THR  20          3HG2      THR  20  -9.768   4.235   1.140
  126    H    PHE  21           H        PHE  21  -7.838   1.654   1.691
  127    HA   PHE  21           HA       PHE  21  -7.660   1.913  -1.248
  128   1HB   PHE  21          1HB       PHE  21  -6.021   0.281  -0.163
  129   2HB   PHE  21          2HB       PHE  21  -7.413  -0.623   0.378
  130    HD1  PHE  21           1HD      PHE  21  -5.954   0.703  -2.794
  131    HD2  PHE  21           2HD      PHE  21  -8.227  -2.353  -0.904
  132    HE1  PHE  21           1HE      PHE  21  -5.909  -0.605  -4.862
  133    HE2  PHE  21           2HE      PHE  21  -8.189  -3.661  -2.974
  134    HZ   PHE  21           HZ       PHE  21  -7.034  -2.792  -4.966
  135    H    LEU  22           H        LEU  22  -9.400   1.333  -2.363
  136    HA   LEU  22           HA       LEU  22 -11.620   1.155  -2.726
  137   1HB   LEU  22          1HB       LEU  22 -10.311  -1.305  -1.794
  138   2HB   LEU  22          2HB       LEU  22 -11.992  -1.384  -2.280
  139    HG   LEU  22           HG       LEU  22 -10.352  -1.956  -4.069
  140   1HD1  LEU  22          1HD1      LEU  22 -12.642  -0.405  -4.112
  141   2HD1  LEU  22          2HD1      LEU  22 -11.511   0.330  -5.252
  142   3HD1  LEU  22          3HD1      LEU  22 -11.963  -1.371  -5.420
  143   1HD2  LEU  22          1HD2      LEU  22  -8.733  -0.132  -3.417
  144   2HD2  LEU  22          2HD2      LEU  22  -9.067  -0.341  -5.138
  145   3HD2  LEU  22          3HD2      LEU  22  -9.834   0.971  -4.238
  146    H    GLY  23           H        GLY  23 -11.544   2.534  -0.456
  147   1HA   GLY  23          1HA       GLY  23 -13.283   3.221   0.952
  148   2HA   GLY  23          2HA       GLY  23 -13.983   1.624   0.836
  149    H    ASN  24           H        ASN  24 -10.898   0.875   1.749
  150    HA   ASN  24           HA       ASN  24 -11.665   1.099   4.585
  151   1HB   ASN  24          1HB       ASN  24  -9.838  -0.920   3.278
  152   2HB   ASN  24          2HB       ASN  24 -10.353  -0.912   4.955
  153   1HD2  ASN  24          1HD2      ASN  24 -12.549  -2.698   2.174
  154   2HD2  ASN  24          2HD2      ASN  24 -10.943  -2.114   1.927
  155    H    LYS  25           H        LYS  25 -10.150   1.820   6.108
  156    HA   LYS  25           HA       LYS  25  -7.900   3.265   5.049
  157   1HB   LYS  25          1HB       LYS  25  -8.990   2.937   7.843
  158   2HB   LYS  25          2HB       LYS  25  -7.749   4.060   7.351
  159   1HG   LYS  25          1HG       LYS  25  -9.322   5.223   5.911
  160   2HG   LYS  25          2HG       LYS  25 -10.582   4.078   6.371
  161   1HD   LYS  25          1HD       LYS  25 -10.890   6.034   7.680
  162   2HD   LYS  25          2HD       LYS  25 -10.237   4.777   8.738
  163   1HE   LYS  25          1HE       LYS  25  -7.973   5.741   8.413
  164   2HE   LYS  25          2HE       LYS  25  -8.694   7.039   7.463
  165   1HZ   LYS  25          1HZ       LYS  25  -9.483   6.480  10.269
  166   2HZ   LYS  25          2HZ       LYS  25  -8.227   7.550   9.861
  167   3HZ   LYS  25          3HZ       LYS  25  -9.815   7.874   9.345
  168    H    TYR  26           H        TYR  26  -5.825   2.498   5.121
  169    HA   TYR  26           HA       TYR  26  -5.367   0.063   6.693
  170   1HB   TYR  26          1HB       TYR  26  -4.081   0.944   4.110
  171   2HB   TYR  26          2HB       TYR  26  -3.677  -0.517   5.003
  172    HD1  TYR  26           1HD      TYR  26  -6.167   1.124   2.897
  173    HD2  TYR  26           2HD      TYR  26  -5.186  -2.417   5.015
  174    HE1  TYR  26           1HE      TYR  26  -7.938  -0.062   1.714
  175    HE2  TYR  26           2HE      TYR  26  -6.961  -3.620   3.832
  176    HH   TYR  26           HH       TYR  26  -8.494  -3.536   2.212
  177    H    GLU  27           H        GLU  27  -4.129   0.327   8.320
  178    HA   GLU  27           HA       GLU  27  -2.296   2.588   8.538
  179   1HB   GLU  27          1HB       GLU  27  -2.968   0.506  10.603
  180   2HB   GLU  27          2HB       GLU  27  -2.306   2.098  10.862
  181   1HG   GLU  27          1HG       GLU  27  -4.360   3.155  10.353
  182   2HG   GLU  27          2HG       GLU  27  -5.039   1.654   9.726
  183    H    SER  28           H        SER  28  -2.357  -0.705   7.839
  184    HA   SER  28           HA       SER  28   0.553  -0.882   8.016
  185   1HB   SER  28          1HB       SER  28   0.126  -3.352   8.482
  186   2HB   SER  28          2HB       SER  28  -0.232  -2.256   9.808
  187    HG   SER  28           HG       SER  28  -1.971  -3.718   8.166
  188    H    CYS  29           H        CYS  29   1.063  -3.106   6.643
  189    HA   CYS  29           HA       CYS  29   0.286  -2.444   3.998
  190   1HB   CYS  29          1HB       CYS  29   1.542  -4.995   5.003
  191   2HB   CYS  29          2HB       CYS  29   1.442  -4.491   3.330
  192    H    THR  30           H        THR  30  -0.782  -3.957   2.555
  193    HA   THR  30           HA       THR  30  -2.826  -5.613   3.855
  194    HB   THR  30           HB       THR  30  -3.828  -3.368   3.402
  195    HG1  THR  30           1HG      THR  30  -5.295  -4.966   3.260
  196   1HG2  THR  30          1HG2      THR  30  -3.520  -3.941   0.472
  197   2HG2  THR  30          2HG2      THR  30  -4.043  -2.456   1.265
  198   3HG2  THR  30          3HG2      THR  30  -2.354  -2.956   1.354
  199    H    SER  31           H        SER  31  -4.008  -6.899   2.203
  200    HA   SER  31           HA       SER  31  -2.284  -7.570  -0.078
  201   1HB   SER  31          1HB       SER  31  -3.215  -9.937   0.241
  202   2HB   SER  31          2HB       SER  31  -2.031  -9.380   1.435
  203    HG   SER  31           HG       SER  31  -4.768  -9.895   1.716
  204    H    ALA  32           H        ALA  32  -4.592  -5.799   0.501
  205    HA   ALA  32           HA       ALA  32  -6.987  -6.697  -0.623
  206   1HB   ALA  32          1HB       ALA  32  -6.057  -4.354   0.549
  207   2HB   ALA  32          2HB       ALA  32  -6.453  -3.873  -1.098
  208   3HB   ALA  32          3HB       ALA  32  -7.683  -4.623  -0.083
  209    H    GLY  33           H        GLY  33  -7.741  -6.873  -2.647
  210   1HA   GLY  33          1HA       GLY  33  -7.827  -6.680  -4.954
  211   2HA   GLY  33          2HA       GLY  33  -6.522  -5.506  -4.861
  212    H    ARG  34           H        ARG  34  -5.330  -7.967  -3.150
  213    HA   ARG  34           HA       ARG  34  -4.088  -9.167  -5.526
  214   1HB   ARG  34          1HB       ARG  34  -2.993  -8.912  -2.715
  215   2HB   ARG  34          2HB       ARG  34  -2.182  -9.691  -4.053
  216   1HG   ARG  34          1HG       ARG  34  -2.586  -7.300  -5.160
  217   2HG   ARG  34          2HG       ARG  34  -2.536  -6.822  -3.464
  218   1HD   ARG  34          1HD       ARG  34  -0.316  -6.747  -4.571
  219   2HD   ARG  34          2HD       ARG  34  -0.361  -7.846  -3.192
  220    HE   ARG  34           HE       ARG  34   0.057  -9.587  -4.595
  221   1HH1  ARG  34          1HH1      ARG  34  -1.004  -6.851  -6.487
  222   2HH1  ARG  34          2HH1      ARG  34  -0.738  -7.635  -8.017
  223   1HH2  ARG  34          1HH2      ARG  34   0.448 -10.624  -6.567
  224   2HH2  ARG  34          2HH2      ARG  34   0.144  -9.785  -8.060
  225    H    SER  35           H        SER  35  -4.094 -10.264  -2.185
  226    HA   SER  35           HA       SER  35  -4.578 -12.244  -1.209
  227   1HB   SER  35          1HB       SER  35  -6.753 -12.307  -3.320
  228   2HB   SER  35          2HB       SER  35  -6.666 -13.384  -1.925
  229    HG   SER  35           HG       SER  35  -7.955 -11.768  -1.243
  230    H    ASP  36           H        ASP  36  -2.646 -12.145  -3.386
  231    HA   ASP  36           HA       ASP  36  -2.845 -14.819  -4.546
  232   1HB   ASP  36          1HB       ASP  36  -1.221 -14.065  -6.151
  233   2HB   ASP  36          2HB       ASP  36  -2.456 -12.838  -6.018
  234    H    GLY  37           H        GLY  37  -0.797 -12.688  -2.757
  235   1HA   GLY  37          1HA       GLY  37   0.204 -14.471  -0.938
  236   2HA   GLY  37          2HA       GLY  37   1.314 -14.552  -2.298
  237    H    LYS  38           H        LYS  38   1.667 -12.075  -3.143
  238    HA   LYS  38           HA       LYS  38   3.270 -10.881  -1.149
  239   1HB   LYS  38          1HB       LYS  38   2.322  -9.805  -3.805
  240   2HB   LYS  38          2HB       LYS  38   3.664  -9.179  -2.863
  241   1HG   LYS  38          1HG       LYS  38   4.602 -10.445  -4.585
  242   2HG   LYS  38          2HG       LYS  38   4.777 -11.415  -3.140
  243   1HD   LYS  38          1HD       LYS  38   3.125 -12.926  -3.842
  244   2HD   LYS  38          2HD       LYS  38   2.499 -11.809  -5.060
  245   1HE   LYS  38          1HE       LYS  38   3.949 -13.774  -5.858
  246   2HE   LYS  38          2HE       LYS  38   4.308 -12.165  -6.494
  247   1HZ   LYS  38          1HZ       LYS  38   5.709 -13.093  -4.073
  248   2HZ   LYS  38          2HZ       LYS  38   6.204 -13.683  -5.588
  249   3HZ   LYS  38          3HZ       LYS  38   6.229 -12.012  -5.277
  250    H    MET  39           H        MET  39   2.819  -9.263   0.257
  251    HA   MET  39           HA       MET  39   0.203  -7.982   0.056
  252   1HB   MET  39          1HB       MET  39   2.212  -8.002   2.328
  253   2HB   MET  39          2HB       MET  39   0.712  -7.102   2.326
  254   1HG   MET  39          1HG       MET  39   0.274  -9.006   3.595
  255   2HG   MET  39          2HG       MET  39  -0.487  -9.293   2.032
  256   1HE   MET  39          1HE       MET  39  -0.155 -11.483   4.073
  257   2HE   MET  39          2HE       MET  39  -0.638 -12.027   2.465
  258   3HE   MET  39          3HE       MET  39   0.684 -12.832   3.308
  259    H    TRP  40           H        TRP  40   0.093  -5.642   0.227
  260    HA   TRP  40           HA       TRP  40   2.578  -4.228  -0.473
  261   1HB   TRP  40          1HB       TRP  40   1.391  -3.043  -2.293
  262   2HB   TRP  40          2HB       TRP  40   1.466  -4.778  -2.598
  263    HD1  TRP  40           HD1      TRP  40  -0.946  -6.128  -1.800
  264    HE1  TRP  40           1HE      TRP  40  -3.362  -5.321  -2.099
  265    HE3  TRP  40           3HE      TRP  40  -0.055  -1.159  -2.517
  266    HZ2  TRP  40           2HZ      TRP  40  -4.711  -2.909  -2.535
  267    HZ3  TRP  40           3HZ      TRP  40  -1.976   0.335  -2.838
  268    HH2  TRP  40           HH2      TRP  40  -4.248  -0.524  -2.853
  269    H    CYS  41           H        CYS  41   1.408  -1.782  -1.043
  270    HA   CYS  41           HA       CYS  41  -0.517  -0.907   0.820
  271   1HB   CYS  41          1HB       CYS  41   1.172   0.663   2.039
  272   2HB   CYS  41          2HB       CYS  41   0.976  -0.993   2.602
  273    H    ALA  42           H        ALA  42  -0.927   1.426   0.580
  274    HA   ALA  42           HA       ALA  42  -0.330   2.264  -2.108
  275   1HB   ALA  42          1HB       ALA  42  -2.535   2.610  -0.882
  276   2HB   ALA  42          2HB       ALA  42  -1.731   3.942  -0.050
  277   3HB   ALA  42          3HB       ALA  42  -1.906   3.975  -1.806
  278    H    THR  43           H        THR  43   0.617   4.223  -2.718
  279    HA   THR  43           HA       THR  43   2.685   5.125  -0.846
  280    HB   THR  43           HB       THR  43   3.856   5.929  -2.867
  281    HG1  THR  43           1HG      THR  43   2.902   5.949  -4.756
  282   1HG2  THR  43          1HG2      THR  43   3.901   3.549  -4.012
  283   2HG2  THR  43          2HG2      THR  43   4.624   3.834  -2.427
  284   3HG2  THR  43          3HG2      THR  43   3.022   3.103  -2.549
  285    H    THR  44           H        THR  44  -0.284   5.901  -1.512
  286    HA   THR  44           HA       THR  44   0.139   8.779  -1.159
  287    HB   THR  44           HB       THR  44  -1.952   9.167  -2.481
  288    HG1  THR  44           1HG      THR  44  -3.092   7.509  -3.037
  289   1HG2  THR  44          1HG2      THR  44  -0.779   8.018  -4.697
  290   2HG2  THR  44          2HG2      THR  44  -0.506   9.651  -4.084
  291   3HG2  THR  44          3HG2      THR  44   0.573   8.338  -3.608
  292    H    ALA  45           H        ALA  45  -1.457   9.777   0.205
  293    HA   ALA  45           HA       ALA  45  -2.278   8.206   2.370
  294   1HB   ALA  45          1HB       ALA  45  -2.562  10.983   1.575
  295   2HB   ALA  45          2HB       ALA  45  -3.976  10.389   2.445
  296   3HB   ALA  45          3HB       ALA  45  -2.379  10.278   3.181
  297    H    ASN  46           H        ASN  46  -3.985   9.119  -0.552
  298    HA   ASN  46           HA       ASN  46  -6.144   7.293   0.256
  299   1HB   ASN  46          1HB       ASN  46  -6.875   9.709   0.236
  300   2HB   ASN  46          2HB       ASN  46  -6.505   9.749  -1.485
  301   1HD2  ASN  46          1HD2      ASN  46 -10.014   8.425  -0.208
  302   2HD2  ASN  46          2HD2      ASN  46  -8.861   9.245   0.778
  303    H    TYR  47           H        TYR  47  -5.858   5.524  -0.916
  304    HA   TYR  47           HA       TYR  47  -4.453   5.508  -3.406
  305   1HB   TYR  47          1HB       TYR  47  -4.372   3.657  -1.734
  306   2HB   TYR  47          2HB       TYR  47  -6.041   3.274  -2.133
  307    HD1  TYR  47           1HD      TYR  47  -6.559   2.499  -4.516
  308    HD2  TYR  47           2HD      TYR  47  -2.604   2.839  -3.005
  309    HE1  TYR  47           1HE      TYR  47  -5.744   1.008  -6.301
  310    HE2  TYR  47           2HE      TYR  47  -1.793   1.354  -4.768
  311    HH   TYR  47           HH       TYR  47  -3.659  -0.609  -6.538
  312    H    ASP  48           H        ASP  48  -7.831   5.356  -2.454
  313    HA   ASP  48           HA       ASP  48  -9.023   4.470  -4.780
  314   1HB   ASP  48          1HB       ASP  48  -9.897   6.405  -2.658
  315   2HB   ASP  48          2HB       ASP  48 -10.913   6.128  -4.065
  316    H    ASP  49           H        ASP  49  -7.674   7.610  -4.056
  317    HA   ASP  49           HA       ASP  49  -8.732   8.885  -6.408
  318   1HB   ASP  49          1HB       ASP  49  -6.851   9.719  -4.224
  319   2HB   ASP  49          2HB       ASP  49  -7.084  10.718  -5.651
  320    H    ASP  50           H        ASP  50  -5.379   8.248  -5.322
  321    HA   ASP  50           HA       ASP  50  -4.438   8.793  -8.007
  322   1HB   ASP  50          1HB       ASP  50  -3.028   8.361  -5.397
  323   2HB   ASP  50          2HB       ASP  50  -2.153   8.482  -6.919
  324    H    ARG  51           H        ARG  51  -5.052   5.941  -6.187
  325    HA   ARG  51           HA       ARG  51  -4.522   3.778  -6.449
  326   1HB   ARG  51          1HB       ARG  51  -4.812   4.581  -9.317
  327   2HB   ARG  51          2HB       ARG  51  -4.941   2.939  -8.690
  328   1HG   ARG  51          1HG       ARG  51  -6.638   4.267  -7.061
  329   2HG   ARG  51          2HG       ARG  51  -6.847   5.156  -8.574
  330   1HD   ARG  51          1HD       ARG  51  -6.936   2.167  -8.437
  331   2HD   ARG  51          2HD       ARG  51  -8.359   3.161  -8.121
  332    HE   ARG  51           HE       ARG  51  -8.453   3.751 -10.376
  333   1HH1  ARG  51          1HH1      ARG  51  -5.688   1.693  -9.781
  334   2HH1  ARG  51          2HH1      ARG  51  -5.288   1.523 -11.462
  335   1HH2  ARG  51          1HH2      ARG  51  -7.947   3.514 -12.581
  336   2HH2  ARG  51          2HH2      ARG  51  -6.570   2.572 -13.058
  337    H    LYS  52           H        LYS  52  -2.208   5.092  -5.958
  338    HA   LYS  52           HA       LYS  52  -0.294   3.727  -7.704
  339   1HB   LYS  52          1HB       LYS  52  -0.046   6.253  -6.084
  340   2HB   LYS  52          2HB       LYS  52   1.376   5.373  -6.638
  341   1HG   LYS  52          1HG       LYS  52   1.159   6.110  -8.734
  342   2HG   LYS  52          2HG       LYS  52  -0.577   5.815  -8.748
  343   1HD   LYS  52          1HD       LYS  52  -0.252   8.150  -9.063
  344   2HD   LYS  52          2HD       LYS  52  -0.863   7.919  -7.427
  345   1HE   LYS  52          1HE       LYS  52   1.306   8.249  -6.481
  346   2HE   LYS  52          2HE       LYS  52   2.063   8.210  -8.075
  347   1HZ   LYS  52          1HZ       LYS  52   0.576  10.228  -8.554
  348   2HZ   LYS  52          2HZ       LYS  52   0.408  10.346  -6.866
  349   3HZ   LYS  52          3HZ       LYS  52   1.944  10.458  -7.577
  350    H    TRP  53           H        TRP  53   0.673   2.055  -6.867
  351    HA   TRP  53           HA       TRP  53   0.666   1.738  -3.949
  352   1HB   TRP  53          1HB       TRP  53  -0.037  -0.544  -4.277
  353   2HB   TRP  53          2HB       TRP  53  -1.155   0.539  -5.010
  354    HD1  TRP  53           HD1      TRP  53  -0.562   0.881  -7.890
  355    HE1  TRP  53           1HE      TRP  53  -0.064  -1.065  -9.516
  356    HE3  TRP  53           3HE      TRP  53   0.670  -2.580  -4.480
  357    HZ2  TRP  53           2HZ      TRP  53   0.745  -3.794  -9.322
  358    HZ3  TRP  53           3HZ      TRP  53   1.294  -4.868  -5.218
  359    HH2  TRP  53           HH2      TRP  53   1.329  -5.453  -7.600
  360    H    GLY  54           H        GLY  54   1.894  -0.171  -3.263
  361   1HA   GLY  54          1HA       GLY  54   4.189  -1.002  -4.791
  362   2HA   GLY  54          2HA       GLY  54   4.583   0.101  -3.478
  363    H    PHE  55           H        PHE  55   5.156  -2.830  -3.870
  364    HA   PHE  55           HA       PHE  55   3.574  -4.345  -2.100
  365   1HB   PHE  55          1HB       PHE  55   6.291  -4.667  -3.305
  366   2HB   PHE  55          2HB       PHE  55   5.761  -5.770  -2.051
  367    HD1  PHE  55           1HD      PHE  55   2.825  -5.010  -3.599
  368    HD2  PHE  55           2HD      PHE  55   6.489  -7.030  -4.363
  369    HE1  PHE  55           1HE      PHE  55   1.696  -6.409  -5.285
  370    HE2  PHE  55           2HE      PHE  55   5.370  -8.434  -6.050
  371    HZ   PHE  55           HZ       PHE  55   2.972  -8.120  -6.521
  372    H    CYS  56           H        CYS  56   4.274  -5.329  -0.122
  373    HA   CYS  56           HA       CYS  56   5.412  -3.402   1.730
  374   1HB   CYS  56          1HB       CYS  56   3.338  -4.912   2.130
  375   2HB   CYS  56          2HB       CYS  56   4.497  -6.219   2.334
  376    HA   PRO  57           HA       PRO  57   9.452  -5.235   1.516
  377   1HB   PRO  57          1HB       PRO  57  10.480  -4.761   3.924
  378   2HB   PRO  57          2HB       PRO  57  10.127  -3.439   2.800
  379   1HG   PRO  57          1HG       PRO  57   8.408  -4.548   4.964
  380   2HG   PRO  57          2HG       PRO  57   8.910  -2.856   4.752
  381   1HD   PRO  57          1HD       PRO  57   6.528  -3.653   3.896
  382   2HD   PRO  57          2HD       PRO  57   7.517  -2.595   2.860
  383    H    ASP  58           H        ASP  58  10.832  -6.295   3.741
  384    HA   ASP  58           HA       ASP  58  10.315  -8.997   3.497
  385   1HB   ASP  58          1HB       ASP  58  11.767  -7.476   5.668
  386   2HB   ASP  58          2HB       ASP  58  11.825  -9.216   5.466
  387    H    GLN  59           H        GLN  59   9.063 -10.430   4.557
  388    HA   GLN  59           HA       GLN  59   6.967  -9.408   6.250
  389   1HB   GLN  59          1HB       GLN  59   7.560 -12.270   5.457
  390   2HB   GLN  59          2HB       GLN  59   6.060 -11.668   6.152
  391   1HG   GLN  59          1HG       GLN  59   7.174 -10.792   3.501
  392   2HG   GLN  59          2HG       GLN  59   5.968 -12.061   3.707
  393   1HE2  GLN  59          1HE2      GLN  59   4.857  -8.281   3.438
  394   2HE2  GLN  59          2HE2      GLN  59   6.422  -8.892   3.032
  395    H    GLY  60           H        GLY  60   7.804  -8.813   8.223
  396   1HA   GLY  60          1HA       GLY  60   7.840 -10.374  10.366
  397   2HA   GLY  60          2HA       GLY  60   9.442 -10.707   9.719
  Start of MODEL    5
    1    H    SER   1           1H       SER   1  18.323  -1.041   4.888
    2    HA   SER   1           HA       SER   1  16.520  -0.090   6.932
    3   1HB   SER   1          1HB       SER   1  17.217   2.069   5.782
    4   2HB   SER   1          2HB       SER   1  18.533   1.143   6.500
    5    HG   SER   1           HG       SER   1  19.057   1.848   4.375
    6    H    TRP   2           H        TRP   2  14.717   1.291   6.329
    7    HA   TRP   2           HA       TRP   2  13.185   0.129   4.168
    8   1HB   TRP   2          1HB       TRP   2  12.285   0.812   6.477
    9   2HB   TRP   2          2HB       TRP   2  12.358   2.469   5.886
   10    HD1  TRP   2           HD1      TRP   2  10.992   2.588   3.252
   11    HE1  TRP   2           1HE      TRP   2   8.583   1.786   2.837
   12    HE3  TRP   2           3HE      TRP   2  10.490  -0.550   7.236
   13    HZ2  TRP   2           2HZ      TRP   2   6.712   0.054   4.044
   14    HZ3  TRP   2           3HZ      TRP   2   8.361  -1.743   7.545
   15    HH2  TRP   2           HH2      TRP   2   6.511  -1.444   5.981
   16    H    MET   3           H        MET   3  14.349   0.822   2.331
   17    HA   MET   3           HA       MET   3  14.356   3.713   1.825
   18   1HB   MET   3          1HB       MET   3  15.855   1.450   0.506
   19   2HB   MET   3          2HB       MET   3  15.900   3.114  -0.054
   20   1HG   MET   3          1HG       MET   3  16.851   3.800   2.100
   21   2HG   MET   3          2HG       MET   3  16.815   2.119   2.632
   22   1HE   MET   3          1HE       MET   3  17.417   3.560  -0.770
   23   2HE   MET   3          2HE       MET   3  18.697   4.579  -0.107
   24   3HE   MET   3          3HE       MET   3  19.103   3.219  -1.158
   25    H    SER   4           H        SER   4  12.296   4.110   1.102
   26    HA   SER   4           HA       SER   4  10.550   4.231  -0.353
   27   1HB   SER   4          1HB       SER   4  12.434   4.501  -2.013
   28   2HB   SER   4          2HB       SER   4  12.346   2.766  -2.306
   29    HG   SER   4           HG       SER   4  10.980   3.431  -3.791
   30    H    THR   5           H        THR   5   9.731   2.367  -2.316
   31    HA   THR   5           HA       THR   5   8.958   0.130  -0.572
   32    HB   THR   5           HB       THR   5   7.109  -0.012  -2.470
   33    HG1  THR   5           1HG      THR   5   7.573   2.771  -2.449
   34   1HG2  THR   5          1HG2      THR   5   5.685   1.606  -1.229
   35   2HG2  THR   5          2HG2      THR   5   6.434   0.362  -0.227
   36   3HG2  THR   5          3HG2      THR   5   7.090   2.001  -0.241
   37    H    VAL   6           H        VAL   6   8.024  -1.674  -2.140
   38    HA   VAL   6           HA       VAL   6   9.936  -2.355  -4.233
   39    HB   VAL   6           HB       VAL   6  10.762  -3.796  -2.639
   40   1HG1  VAL   6          1HG1      VAL   6   8.189  -3.352  -1.293
   41   2HG1  VAL   6          2HG1      VAL   6   8.903  -4.945  -1.029
   42   3HG1  VAL   6          3HG1      VAL   6   9.811  -3.492  -0.613
   43   1HG2  VAL   6          1HG2      VAL   6   8.530  -5.116  -4.003
   44   2HG2  VAL   6          2HG2      VAL   6  10.249  -5.516  -3.980
   45   3HG2  VAL   6          3HG2      VAL   6   9.220  -5.962  -2.619
   46    H    GLY   7           H        GLY   7   8.764  -3.990  -5.728
   47   1HA   GLY   7          1HA       GLY   7   6.781  -4.609  -6.833
   48   2HA   GLY   7          2HA       GLY   7   5.992  -4.412  -5.295
   49    H    GLY   8           H        GLY   8   4.187  -3.519  -6.385
   50   1HA   GLY   8          1HA       GLY   8   2.873  -1.810  -7.167
   51   2HA   GLY   8          2HA       GLY   8   3.880  -0.826  -6.139
   52    H    ASN   9           H        ASN   9   3.667   0.930  -7.430
   53    HA   ASN   9           HA       ASN   9   5.519   1.086  -9.646
   54   1HB   ASN   9          1HB       ASN   9   3.909   2.044 -11.227
   55   2HB   ASN   9          2HB       ASN   9   3.462   0.407 -10.802
   56   1HD2  ASN   9          1HD2      ASN   9   1.029   2.597  -8.596
   57   2HD2  ASN   9          2HD2      ASN   9   2.671   2.209  -8.223
   58    H    SER  10           H        SER  10   5.325   2.097  -6.978
   59    HA   SER  10           HA       SER  10   4.406   4.678  -6.683
   60   1HB   SER  10          1HB       SER  10   6.742   4.565  -5.179
   61   2HB   SER  10          2HB       SER  10   5.134   4.101  -4.636
   62    HG   SER  10           HG       SER  10   6.520   2.369  -4.315
   63    H    GLY  11           H        GLY  11   7.683   3.664  -7.629
   64   1HA   GLY  11          1HA       GLY  11   9.144   4.775  -9.081
   65   2HA   GLY  11          2HA       GLY  11   8.002   6.116  -9.164
   66    H    GLY  12           H        GLY  12   9.474   4.535  -6.360
   67   1HA   GLY  12          1HA       GLY  12  11.079   5.363  -4.876
   68   2HA   GLY  12          2HA       GLY  12  11.143   6.845  -5.812
   69    H    ALA  13           H        ALA  13   8.746   5.074  -3.838
   70    HA   ALA  13           HA       ALA  13   8.349   7.467  -2.235
   71   1HB   ALA  13          1HB       ALA  13   6.666   7.013  -4.387
   72   2HB   ALA  13          2HB       ALA  13   5.763   6.392  -3.006
   73   3HB   ALA  13          3HB       ALA  13   6.339   8.061  -3.010
   74    HA   PRO  14           HA       PRO  14   7.639   4.240   0.749
   75   1HB   PRO  14          1HB       PRO  14   7.098   5.759   2.885
   76   2HB   PRO  14          2HB       PRO  14   8.711   5.728   2.165
   77   1HG   PRO  14          1HG       PRO  14   6.594   7.803   1.978
   78   2HG   PRO  14          2HG       PRO  14   8.355   7.987   2.001
   79   1HD   PRO  14          1HD       PRO  14   6.694   8.032  -0.269
   80   2HD   PRO  14          2HD       PRO  14   8.462   7.898  -0.264
   81    H    CYS  15           H        CYS  15   5.874   3.881   2.621
   82    HA   CYS  15           HA       CYS  15   3.327   3.957   1.213
   83   1HB   CYS  15          1HB       CYS  15   3.651   2.813   3.979
   84   2HB   CYS  15          2HB       CYS  15   2.576   2.307   2.684
   85    H    VAL  16           H        VAL  16   1.851   5.514   1.574
   86    HA   VAL  16           HA       VAL  16   2.219   7.373   3.767
   87    HB   VAL  16           HB       VAL  16   0.201   7.319   1.514
   88   1HG1  VAL  16          1HG1      VAL  16   0.363   8.980   3.938
   89   2HG1  VAL  16          2HG1      VAL  16   0.145   9.866   2.425
   90   3HG1  VAL  16          3HG1      VAL  16  -1.014   8.622   2.896
   91   1HG2  VAL  16          1HG2      VAL  16   2.832   8.640   1.939
   92   2HG2  VAL  16          2HG2      VAL  16   2.145   7.934   0.476
   93   3HG2  VAL  16          3HG2      VAL  16   1.593   9.512   1.039
   94    H    PHE  17           H        PHE  17   1.457   6.789   5.717
   95    HA   PHE  17           HA       PHE  17  -1.137   5.424   5.823
   96   1HB   PHE  17          1HB       PHE  17   1.247   5.244   7.656
   97   2HB   PHE  17          2HB       PHE  17  -0.340   4.647   8.096
   98    HD1  PHE  17           1HD      PHE  17  -1.388   3.160   5.998
   99    HD2  PHE  17           2HD      PHE  17   2.696   3.653   7.059
  100    HE1  PHE  17           1HE      PHE  17  -0.842   1.023   4.916
  101    HE2  PHE  17           2HE      PHE  17   3.262   1.525   5.989
  102    HZ   PHE  17           HZ       PHE  17   1.486   0.178   4.890
  103    HA   PRO  18           HA       PRO  18  -2.602   4.985   6.966
  104   1HB   PRO  18          1HB       PRO  18  -5.172   6.020   7.478
  105   2HB   PRO  18          2HB       PRO  18  -4.203   5.020   8.564
  106   1HG   PRO  18          1HG       PRO  18  -4.926   7.712   8.958
  107   2HG   PRO  18          2HG       PRO  18  -3.724   6.799   9.882
  108   1HD   PRO  18          1HD       PRO  18  -3.338   8.747   7.665
  109   2HD   PRO  18          2HD       PRO  18  -2.289   8.387   9.054
  110    H    PHE  19           H        PHE  19  -3.365   4.383   4.982
  111    HA   PHE  19           HA       PHE  19  -4.260   6.586   3.252
  112   1HB   PHE  19          1HB       PHE  19  -3.637   5.272   1.324
  113   2HB   PHE  19          2HB       PHE  19  -2.274   5.391   2.412
  114    HD1  PHE  19           1HD      PHE  19  -4.825   3.142   1.022
  115    HD2  PHE  19           2HD      PHE  19  -1.326   3.453   3.416
  116    HE1  PHE  19           1HE      PHE  19  -4.507   0.711   0.868
  117    HE2  PHE  19           2HE      PHE  19  -1.008   1.018   3.270
  118    HZ   PHE  19           HZ       PHE  19  -2.598  -0.352   1.987
  119    H    THR  20           H        THR  20  -5.650   5.190   1.316
  120    HA   THR  20           HA       THR  20  -7.695   3.734   2.823
  121    HB   THR  20           HB       THR  20  -8.310   6.171   1.120
  122    HG1  THR  20           1HG      THR  20  -7.434   6.817   3.082
  123   1HG2  THR  20          1HG2      THR  20 -10.563   6.011   2.077
  124   2HG2  THR  20          2HG2      THR  20 -10.156   4.634   1.052
  125   3HG2  THR  20          3HG2      THR  20 -10.120   4.469   2.807
  126    H    PHE  21           H        PHE  21  -8.475   2.086   1.760
  127    HA   PHE  21           HA       PHE  21  -8.436   2.095  -1.179
  128   1HB   PHE  21          1HB       PHE  21  -6.539   0.708  -0.047
  129   2HB   PHE  21          2HB       PHE  21  -7.829  -0.388   0.397
  130    HD1  PHE  21           1HD      PHE  21  -8.386   1.243  -2.757
  131    HD2  PHE  21           2HD      PHE  21  -6.496  -2.064  -0.878
  132    HE1  PHE  21           1HE      PHE  21  -8.201   0.110  -4.913
  133    HE2  PHE  21           2HE      PHE  21  -6.308  -3.205  -3.029
  134    HZ   PHE  21           HZ       PHE  21  -7.151  -2.107  -5.079
  135    H    LEU  22           H        LEU  22 -10.200   1.064  -2.076
  136    HA   LEU  22           HA       LEU  22 -12.390   0.686  -2.254
  137   1HB   LEU  22          1HB       LEU  22 -11.306  -1.391  -0.458
  138   2HB   LEU  22          2HB       LEU  22 -12.843  -1.570  -1.286
  139    HG   LEU  22           HG       LEU  22 -11.654  -2.491  -2.939
  140   1HD1  LEU  22          1HD1      LEU  22 -10.459   0.169  -3.282
  141   2HD1  LEU  22          2HD1      LEU  22 -10.256  -1.168  -4.416
  142   3HD1  LEU  22          3HD1      LEU  22 -11.861  -0.500  -4.110
  143   1HD2  LEU  22          1HD2      LEU  22  -9.942  -2.749  -1.069
  144   2HD2  LEU  22          2HD2      LEU  22  -9.541  -3.149  -2.740
  145   3HD2  LEU  22          3HD2      LEU  22  -9.032  -1.608  -2.064
  146    H    GLY  23           H        GLY  23 -11.922   2.658  -0.234
  147   1HA   GLY  23          1HA       GLY  23 -13.455   3.819   1.079
  148   2HA   GLY  23          2HA       GLY  23 -14.428   2.367   1.199
  149    H    ASN  24           H        ASN  24 -11.463   1.245   2.079
  150    HA   ASN  24           HA       ASN  24 -12.065   1.804   4.904
  151   1HB   ASN  24          1HB       ASN  24 -10.523  -0.447   3.613
  152   2HB   ASN  24          2HB       ASN  24 -10.788  -0.269   5.337
  153   1HD2  ASN  24          1HD2      ASN  24 -13.499  -2.032   3.027
  154   2HD2  ASN  24          2HD2      ASN  24 -11.909  -1.602   2.517
  155    H    LYS  25           H        LYS  25 -10.548   2.707   6.242
  156    HA   LYS  25           HA       LYS  25  -8.253   3.940   5.077
  157   1HB   LYS  25          1HB       LYS  25  -9.083   3.710   7.972
  158   2HB   LYS  25          2HB       LYS  25  -8.046   4.917   7.254
  159   1HG   LYS  25          1HG       LYS  25  -9.896   5.867   6.026
  160   2HG   LYS  25          2HG       LYS  25 -10.956   4.585   6.609
  161   1HD   LYS  25          1HD       LYS  25 -10.595   5.369   8.912
  162   2HD   LYS  25          2HD       LYS  25  -9.610   6.695   8.289
  163   1HE   LYS  25          1HE       LYS  25 -12.541   6.194   7.787
  164   2HE   LYS  25          2HE       LYS  25 -11.834   7.513   8.717
  165   1HZ   LYS  25          1HZ       LYS  25 -10.761   8.278   6.635
  166   2HZ   LYS  25          2HZ       LYS  25 -11.616   7.077   5.787
  167   3HZ   LYS  25          3HZ       LYS  25 -12.458   8.321   6.571
  168    H    TYR  26           H        TYR  26  -6.268   2.980   4.926
  169    HA   TYR  26           HA       TYR  26  -5.806   0.612   6.589
  170   1HB   TYR  26          1HB       TYR  26  -4.569   1.436   3.963
  171   2HB   TYR  26          2HB       TYR  26  -4.100   0.016   4.885
  172    HD1  TYR  26           1HD      TYR  26  -7.403   0.081   5.561
  173    HD2  TYR  26           2HD      TYR  26  -4.849  -0.500   2.223
  174    HE1  TYR  26           1HE      TYR  26  -9.155  -1.200   4.448
  175    HE2  TYR  26           2HE      TYR  26  -6.592  -1.794   1.101
  176    HH   TYR  26           HH       TYR  26  -9.473  -1.729   1.499
  177    H    GLU  27           H        GLU  27  -4.682   0.978   8.261
  178    HA   GLU  27           HA       GLU  27  -2.761   3.143   8.391
  179   1HB   GLU  27          1HB       GLU  27  -3.766   1.241  10.493
  180   2HB   GLU  27          2HB       GLU  27  -2.753   2.632  10.786
  181   1HG   GLU  27          1HG       GLU  27  -4.538   4.097   9.940
  182   2HG   GLU  27          2HG       GLU  27  -5.558   2.679   9.708
  183    H    SER  28           H        SER  28  -2.868  -0.203   7.900
  184    HA   SER  28           HA       SER  28   0.045  -0.352   8.128
  185   1HB   SER  28          1HB       SER  28  -0.409  -2.814   8.724
  186   2HB   SER  28          2HB       SER  28  -0.691  -1.618   9.985
  187    HG   SER  28           HG       SER  28  -2.651  -2.344  10.049
  188    H    CYS  29           H        CYS  29   0.524  -2.738   6.943
  189    HA   CYS  29           HA       CYS  29   0.022  -2.219   4.227
  190   1HB   CYS  29          1HB       CYS  29   0.895  -4.778   5.558
  191   2HB   CYS  29          2HB       CYS  29   0.910  -4.496   3.834
  192    H    THR  30           H        THR  30  -0.984  -3.828   2.769
  193    HA   THR  30           HA       THR  30  -3.263  -5.260   3.870
  194    HB   THR  30           HB       THR  30  -4.125  -2.932   3.389
  195    HG1  THR  30           1HG      THR  30  -5.624  -4.533   3.170
  196   1HG2  THR  30          1HG2      THR  30  -4.332  -3.025   0.594
  197   2HG2  THR  30          2HG2      THR  30  -3.443  -1.859   1.579
  198   3HG2  THR  30          3HG2      THR  30  -2.628  -3.301   0.971
  199    H    SER  31           H        SER  31  -4.399  -6.400   2.058
  200    HA   SER  31           HA       SER  31  -2.583  -7.062  -0.143
  201   1HB   SER  31          1HB       SER  31  -3.320  -9.452   0.085
  202   2HB   SER  31          2HB       SER  31  -2.382  -8.869   1.471
  203    HG   SER  31           HG       SER  31  -4.113  -9.816   2.400
  204    H    ALA  32           H        ALA  32  -4.985  -5.386   0.506
  205    HA   ALA  32           HA       ALA  32  -7.317  -6.330  -0.708
  206   1HB   ALA  32          1HB       ALA  32  -6.435  -3.937   0.499
  207   2HB   ALA  32          2HB       ALA  32  -6.973  -3.492  -1.122
  208   3HB   ALA  32          3HB       ALA  32  -8.073  -4.324  -0.027
  209    H    GLY  33           H        GLY  33  -8.062  -6.355  -2.751
  210   1HA   GLY  33          1HA       GLY  33  -8.112  -6.041  -5.041
  211   2HA   GLY  33          2HA       GLY  33  -6.760  -4.927  -4.878
  212    H    ARG  34           H        ARG  34  -5.603  -7.440  -3.278
  213    HA   ARG  34           HA       ARG  34  -4.444  -8.638  -5.695
  214   1HB   ARG  34          1HB       ARG  34  -3.286  -8.642  -2.912
  215   2HB   ARG  34          2HB       ARG  34  -2.503  -9.152  -4.382
  216   1HG   ARG  34          1HG       ARG  34  -3.030  -6.595  -5.011
  217   2HG   ARG  34          2HG       ARG  34  -2.872  -6.456  -3.264
  218   1HD   ARG  34          1HD       ARG  34  -0.735  -6.087  -4.446
  219   2HD   ARG  34          2HD       ARG  34  -0.645  -7.465  -3.328
  220    HE   ARG  34           HE       ARG  34  -0.287  -8.848  -5.069
  221   1HH1  ARG  34          1HH1      ARG  34  -1.605  -5.824  -6.324
  222   2HH1  ARG  34          2HH1      ARG  34  -1.319  -6.247  -7.991
  223   1HH2  ARG  34          1HH2      ARG  34   0.081  -9.371  -7.265
  224   2HH2  ARG  34          2HH2      ARG  34  -0.374  -8.261  -8.518
  225    H    SER  35           H        SER  35  -5.697  -9.313  -2.476
  226    HA   SER  35           HA       SER  35  -6.709 -11.165  -1.581
  227   1HB   SER  35          1HB       SER  35  -6.123 -12.541  -4.229
  228   2HB   SER  35          2HB       SER  35  -7.073 -13.230  -2.912
  229    HG   SER  35           HG       SER  35  -7.858 -11.575  -4.879
  230    H    ASP  36           H        ASP  36  -3.997 -12.095  -3.680
  231    HA   ASP  36           HA       ASP  36  -2.471 -12.844  -1.332
  232   1HB   ASP  36          1HB       ASP  36  -1.397 -14.549  -3.002
  233   2HB   ASP  36          2HB       ASP  36  -2.886 -14.969  -2.177
  234    H    GLY  37           H        GLY  37  -1.158 -13.281  -4.407
  235   1HA   GLY  37          1HA       GLY  37   0.802 -12.303  -5.278
  236   2HA   GLY  37          2HA       GLY  37  -0.436 -11.132  -5.685
  237    H    LYS  38           H        LYS  38   1.179 -11.854  -2.715
  238    HA   LYS  38           HA       LYS  38   2.442 -10.807  -1.210
  239   1HB   LYS  38          1HB       LYS  38   2.767  -8.914  -3.460
  240   2HB   LYS  38          2HB       LYS  38   3.897  -9.178  -2.121
  241   1HG   LYS  38          1HG       LYS  38   3.098 -11.340  -4.008
  242   2HG   LYS  38          2HG       LYS  38   4.411 -10.286  -4.341
  243   1HD   LYS  38          1HD       LYS  38   4.220 -11.942  -1.860
  244   2HD   LYS  38          2HD       LYS  38   5.092 -12.445  -3.309
  245   1HE   LYS  38          1HE       LYS  38   6.596 -10.561  -3.106
  246   2HE   LYS  38          2HE       LYS  38   5.681  -9.945  -1.729
  247   1HZ   LYS  38          1HZ       LYS  38   7.022 -12.602  -1.748
  248   2HZ   LYS  38          2HZ       LYS  38   7.755 -11.189  -1.147
  249   3HZ   LYS  38          3HZ       LYS  38   6.346 -11.800  -0.413
  250    H    MET  39           H        MET  39   2.287  -9.212   0.341
  251    HA   MET  39           HA       MET  39  -0.088  -7.576   0.215
  252   1HB   MET  39          1HB       MET  39   2.025  -7.873   2.360
  253   2HB   MET  39          2HB       MET  39   0.580  -6.900   2.512
  254   1HG   MET  39          1HG       MET  39  -0.769  -8.963   2.177
  255   2HG   MET  39          2HG       MET  39   0.737  -9.881   2.230
  256   1HE   MET  39          1HE       MET  39  -1.160 -10.879   3.703
  257   2HE   MET  39          2HE       MET  39  -0.177 -11.243   5.123
  258   3HE   MET  39          3HE       MET  39  -1.641 -10.273   5.290
  259    H    TRP  40           H        TRP  40  -0.075  -5.293   0.352
  260    HA   TRP  40           HA       TRP  40   2.489  -4.008  -0.281
  261   1HB   TRP  40          1HB       TRP  40   1.358  -2.680  -2.035
  262   2HB   TRP  40          2HB       TRP  40   1.366  -4.404  -2.408
  263    HD1  TRP  40           HD1      TRP  40  -1.107  -5.694  -1.783
  264    HE1  TRP  40           1HE      TRP  40  -3.494  -4.768  -2.029
  265    HE3  TRP  40           3HE      TRP  40  -0.020  -0.722  -2.043
  266    HZ2  TRP  40           2HZ      TRP  40  -4.740  -2.263  -2.260
  267    HZ3  TRP  40           3HZ      TRP  40  -1.874   0.885  -2.250
  268    HH2  TRP  40           HH2      TRP  40  -4.186   0.123  -2.364
  269    H    CYS  41           H        CYS  41   1.805  -1.514  -0.658
  270    HA   CYS  41           HA       CYS  41   0.012  -0.512   1.392
  271   1HB   CYS  41          1HB       CYS  41   1.796   0.903   2.389
  272   2HB   CYS  41          2HB       CYS  41   2.085  -0.814   2.649
  273    H    ALA  42           H        ALA  42  -0.754   1.545   0.819
  274    HA   ALA  42           HA       ALA  42  -0.206   2.351  -1.878
  275   1HB   ALA  42          1HB       ALA  42  -2.152   3.077   0.177
  276   2HB   ALA  42          2HB       ALA  42  -1.620   4.439  -0.807
  277   3HB   ALA  42          3HB       ALA  42  -2.323   3.016  -1.577
  278    H    THR  43           H        THR  43   0.654   4.345  -2.560
  279    HA   THR  43           HA       THR  43   2.528   5.487  -0.610
  280    HB   THR  43           HB       THR  43   3.922   6.100  -2.537
  281    HG1  THR  43           1HG      THR  43   3.092   6.128  -4.456
  282   1HG2  THR  43          1HG2      THR  43   3.403   3.336  -3.290
  283   2HG2  THR  43          2HG2      THR  43   4.854   4.080  -2.623
  284   3HG2  THR  43          3HG2      THR  43   3.550   3.573  -1.547
  285    H    THR  44           H        THR  44  -0.360   6.073  -1.377
  286    HA   THR  44           HA       THR  44  -0.067   8.979  -1.406
  287    HB   THR  44           HB       THR  44  -2.074   9.130  -2.902
  288    HG1  THR  44           1HG      THR  44  -3.112   7.366  -3.275
  289   1HG2  THR  44          1HG2      THR  44  -0.875   8.141  -4.993
  290   2HG2  THR  44          2HG2      THR  44  -0.229   9.559  -4.167
  291   3HG2  THR  44          3HG2      THR  44   0.480   7.968  -3.877
  292    H    ALA  45           H        ALA  45  -1.770  10.064  -0.270
  293    HA   ALA  45           HA       ALA  45  -2.716   8.766   2.004
  294   1HB   ALA  45          1HB       ALA  45  -2.738  11.373   1.034
  295   2HB   ALA  45          2HB       ALA  45  -4.433  10.980   1.320
  296   3HB   ALA  45          3HB       ALA  45  -3.260  10.823   2.628
  297    H    ASN  46           H        ASN  46  -4.361   9.390  -1.065
  298    HA   ASN  46           HA       ASN  46  -6.460   7.513  -0.201
  299   1HB   ASN  46          1HB       ASN  46  -7.253   9.884  -0.580
  300   2HB   ASN  46          2HB       ASN  46  -6.803   9.687  -2.269
  301   1HD2  ASN  46          1HD2      ASN  46 -10.314   8.417  -0.946
  302   2HD2  ASN  46          2HD2      ASN  46  -9.237   9.417  -0.051
  303    H    TYR  47           H        TYR  47  -5.892   5.632  -1.078
  304    HA   TYR  47           HA       TYR  47  -4.374   5.456  -3.476
  305   1HB   TYR  47          1HB       TYR  47  -4.177   3.788  -1.661
  306   2HB   TYR  47          2HB       TYR  47  -5.817   3.243  -2.016
  307    HD1  TYR  47           1HD      TYR  47  -2.461   3.649  -3.561
  308    HD2  TYR  47           2HD      TYR  47  -6.188   1.605  -3.635
  309    HE1  TYR  47           1HE      TYR  47  -1.591   2.134  -5.284
  310    HE2  TYR  47           2HE      TYR  47  -5.321   0.082  -5.351
  311    HH   TYR  47           HH       TYR  47  -3.189   0.497  -7.258
  312    H    ASP  48           H        ASP  48  -7.789   5.064  -2.728
  313    HA   ASP  48           HA       ASP  48  -8.637   3.774  -5.007
  314   1HB   ASP  48          1HB       ASP  48 -10.001   5.797  -3.255
  315   2HB   ASP  48          2HB       ASP  48 -10.819   5.059  -4.628
  316    H    ASP  49           H        ASP  49  -8.018   7.220  -4.563
  317    HA   ASP  49           HA       ASP  49  -8.944   7.846  -7.218
  318   1HB   ASP  49          1HB       ASP  49  -7.842   9.442  -4.950
  319   2HB   ASP  49          2HB       ASP  49  -7.924  10.151  -6.556
  320    H    ASP  50           H        ASP  50  -5.737   7.951  -5.613
  321    HA   ASP  50           HA       ASP  50  -4.479   8.630  -8.119
  322   1HB   ASP  50          1HB       ASP  50  -3.402   8.130  -5.357
  323   2HB   ASP  50          2HB       ASP  50  -2.339   8.358  -6.741
  324    H    ARG  51           H        ARG  51  -4.815   5.725  -6.202
  325    HA   ARG  51           HA       ARG  51  -4.224   3.601  -6.499
  326   1HB   ARG  51          1HB       ARG  51  -4.517   4.392  -9.377
  327   2HB   ARG  51          2HB       ARG  51  -4.428   2.732  -8.787
  328   1HG   ARG  51          1HG       ARG  51  -6.326   4.089  -7.222
  329   2HG   ARG  51          2HG       ARG  51  -6.699   4.430  -8.916
  330   1HD   ARG  51          1HD       ARG  51  -6.203   1.697  -7.784
  331   2HD   ARG  51          2HD       ARG  51  -7.804   2.412  -7.956
  332    HE   ARG  51           HE       ARG  51  -6.253   1.182 -10.005
  333   1HH1  ARG  51          1HH1      ARG  51  -8.587   3.707  -9.401
  334   2HH1  ARG  51          2HH1      ARG  51  -9.124   3.808 -11.051
  335   1HH2  ARG  51          1HH2      ARG  51  -6.928   1.298 -12.174
  336   2HH2  ARG  51          2HH2      ARG  51  -8.171   2.416 -12.641
  337    H    LYS  52           H        LYS  52  -2.022   5.057  -5.887
  338    HA   LYS  52           HA       LYS  52   0.040   3.769  -7.531
  339   1HB   LYS  52          1HB       LYS  52   0.109   6.354  -5.999
  340   2HB   LYS  52          2HB       LYS  52   1.599   5.471  -6.301
  341   1HG   LYS  52          1HG       LYS  52   0.920   5.527  -8.772
  342   2HG   LYS  52          2HG       LYS  52  -0.260   6.744  -8.283
  343   1HD   LYS  52          1HD       LYS  52   2.703   6.945  -7.726
  344   2HD   LYS  52          2HD       LYS  52   1.922   7.667  -9.132
  345   1HE   LYS  52          1HE       LYS  52   1.123   8.277  -6.289
  346   2HE   LYS  52          2HE       LYS  52   2.312   9.219  -7.191
  347   1HZ   LYS  52          1HZ       LYS  52  -0.380   8.750  -8.309
  348   2HZ   LYS  52          2HZ       LYS  52  -0.129   9.984  -7.169
  349   3HZ   LYS  52          3HZ       LYS  52   0.714  10.002  -8.646
  350    H    TRP  53           H        TRP  53   0.871   2.074  -6.632
  351    HA   TRP  53           HA       TRP  53   0.888   1.865  -3.702
  352   1HB   TRP  53          1HB       TRP  53   0.191  -0.438  -3.942
  353   2HB   TRP  53          2HB       TRP  53  -0.944   0.614  -4.711
  354    HD1  TRP  53           HD1      TRP  53  -0.475   0.796  -7.596
  355    HE1  TRP  53           1HE      TRP  53   0.044  -1.218  -9.138
  356    HE3  TRP  53           3HE      TRP  53   1.082  -2.409  -4.060
  357    HZ2  TRP  53           2HZ      TRP  53   1.032  -3.879  -8.831
  358    HZ3  TRP  53           3HZ      TRP  53   1.828  -4.692  -4.707
  359    HH2  TRP  53           HH2      TRP  53   1.799  -5.403  -7.056
  360    H    GLY  54           H        GLY  54   2.065  -0.090  -2.978
  361   1HA   GLY  54          1HA       GLY  54   4.383  -0.949  -4.457
  362   2HA   GLY  54          2HA       GLY  54   4.766   0.155  -3.135
  363    H    PHE  55           H        PHE  55   5.190  -2.826  -3.582
  364    HA   PHE  55           HA       PHE  55   3.597  -4.251  -1.748
  365   1HB   PHE  55          1HB       PHE  55   6.275  -4.706  -3.025
  366   2HB   PHE  55          2HB       PHE  55   5.683  -5.800  -1.789
  367    HD1  PHE  55           1HD      PHE  55   2.765  -5.710  -2.560
  368    HD2  PHE  55           2HD      PHE  55   6.304  -6.169  -4.876
  369    HE1  PHE  55           1HE      PHE  55   1.517  -7.074  -4.187
  370    HE2  PHE  55           2HE      PHE  55   5.050  -7.519  -6.516
  371    HZ   PHE  55           HZ       PHE  55   2.661  -7.954  -6.183
  372    H    CYS  56           H        CYS  56   4.422  -5.292   0.224
  373    HA   CYS  56           HA       CYS  56   5.931  -3.392   1.866
  374   1HB   CYS  56          1HB       CYS  56   3.918  -5.550   2.553
  375   2HB   CYS  56          2HB       CYS  56   4.951  -4.802   3.782
  376    HA   PRO  57           HA       PRO  57   9.404  -6.107   2.154
  377   1HB   PRO  57          1HB       PRO  57  10.380  -5.599   4.574
  378   2HB   PRO  57          2HB       PRO  57  10.391  -4.375   3.292
  379   1HG   PRO  57          1HG       PRO  57   8.372  -4.799   5.452
  380   2HG   PRO  57          2HG       PRO  57   9.228  -3.292   5.064
  381   1HD   PRO  57          1HD       PRO  57   6.756  -3.713   4.158
  382   2HD   PRO  57          2HD       PRO  57   7.981  -2.984   3.096
  383    H    ASP  58           H        ASP  58  10.356  -7.095   4.670
  384    HA   ASP  58           HA       ASP  58   9.486  -9.695   4.642
  385   1HB   ASP  58          1HB       ASP  58  11.512  -8.900   5.835
  386   2HB   ASP  58          2HB       ASP  58  10.476  -8.229   7.091
  387    H    GLN  59           H        GLN  59   7.672 -10.647   5.101
  388    HA   GLN  59           HA       GLN  59   5.430  -9.330   6.170
  389   1HB   GLN  59          1HB       GLN  59   5.871 -12.314   5.965
  390   2HB   GLN  59          2HB       GLN  59   4.327 -11.478   6.051
  391   1HG   GLN  59          1HG       GLN  59   6.281 -11.077   3.807
  392   2HG   GLN  59          2HG       GLN  59   5.016 -12.303   3.776
  393   1HE2  GLN  59          1HE2      GLN  59   4.233  -8.616   2.633
  394   2HE2  GLN  59          2HE2      GLN  59   5.811  -9.280   2.852
  395    H    GLY  60           H        GLY  60   5.328  -8.643   8.204
  396   1HA   GLY  60          1HA       GLY  60   4.850 -10.073  10.408
  397   2HA   GLY  60          2HA       GLY  60   6.608 -10.110  10.353
  Start of MODEL    6
    1    H    SER   1           1H       SER   1  15.455   1.764  -3.251
    2    HA   SER   1           HA       SER   1  16.910   2.089  -1.697
    3   1HB   SER   1          1HB       SER   1  17.497   4.771  -2.988
    4   2HB   SER   1          2HB       SER   1  18.518   3.937  -1.815
    5    HG   SER   1           HG       SER   1  19.148   2.530  -3.308
    6    H    TRP   2           H        TRP   2  17.261   3.353   0.332
    7    HA   TRP   2           HA       TRP   2  16.451   4.433   2.169
    8   1HB   TRP   2          1HB       TRP   2  15.104   6.171   0.087
    9   2HB   TRP   2          2HB       TRP   2  15.092   6.512   1.810
   10    HD1  TRP   2           HD1      TRP   2  16.220   8.709   0.089
   11    HE1  TRP   2           1HE      TRP   2  18.701   9.380   0.132
   12    HE3  TRP   2           3HE      TRP   2  18.217   4.365   1.941
   13    HZ2  TRP   2           2HZ      TRP   2  21.163   8.245   0.876
   14    HZ3  TRP   2           3HZ      TRP   2  20.649   4.256   2.302
   15    HH2  TRP   2           HH2      TRP   2  22.090   6.156   1.779
   16    H    MET   3           H        MET   3  13.714   5.731   2.141
   17    HA   MET   3           HA       MET   3  12.260   3.328   2.789
   18   1HB   MET   3          1HB       MET   3  10.430   4.973   3.411
   19   2HB   MET   3          2HB       MET   3  11.911   5.065   4.347
   20   1HG   MET   3          1HG       MET   3  12.568   7.074   3.287
   21   2HG   MET   3          2HG       MET   3  11.359   6.879   2.013
   22   1HE   MET   3          1HE       MET   3  11.665   9.334   2.851
   23   2HE   MET   3          2HE       MET   3   9.937   9.686   2.806
   24   3HE   MET   3          3HE       MET   3  10.868  10.024   4.265
   25    H    SER   4           H        SER   4  11.965   2.317   0.843
   26    HA   SER   4           HA       SER   4  10.069   3.632  -0.977
   27   1HB   SER   4          1HB       SER   4  12.406   1.857  -1.703
   28   2HB   SER   4          2HB       SER   4  11.165   2.387  -2.840
   29    HG   SER   4           HG       SER   4  13.056   3.961  -1.437
   30    H    THR   5           H        THR   5   9.493   1.607  -2.649
   31    HA   THR   5           HA       THR   5   8.416  -0.476  -0.893
   32    HB   THR   5           HB       THR   5   6.567  -0.487  -2.751
   33    HG1  THR   5           1HG      THR   5   7.293   2.234  -2.894
   34   1HG2  THR   5          1HG2      THR   5   6.608   1.822  -0.838
   35   2HG2  THR   5          2HG2      THR   5   5.200   1.046  -1.561
   36   3HG2  THR   5          3HG2      THR   5   6.187   0.166  -0.396
   37    H    VAL   6           H        VAL   6   7.497  -2.272  -2.354
   38    HA   VAL   6           HA       VAL   6   9.363  -3.016  -4.476
   39    HB   VAL   6           HB       VAL   6  10.117  -4.596  -3.026
   40   1HG1  VAL   6          1HG1      VAL   6   7.767  -3.842  -1.411
   41   2HG1  VAL   6          2HG1      VAL   6   8.430  -5.451  -1.128
   42   3HG1  VAL   6          3HG1      VAL   6   9.456  -4.029  -0.939
   43   1HG2  VAL   6          1HG2      VAL   6   8.045  -5.670  -4.491
   44   2HG2  VAL   6          2HG2      VAL   6   9.308  -6.563  -3.645
   45   3HG2  VAL   6          3HG2      VAL   6   7.764  -6.256  -2.852
   46    H    GLY   7           H        GLY   7   8.152  -4.579  -6.018
   47   1HA   GLY   7          1HA       GLY   7   6.146  -5.165  -7.114
   48   2HA   GLY   7          2HA       GLY   7   5.328  -4.804  -5.627
   49    H    GLY   8           H        GLY   8   3.649  -3.728  -6.516
   50   1HA   GLY   8          1HA       GLY   8   2.471  -2.009  -7.473
   51   2HA   GLY   8          2HA       GLY   8   3.588  -1.045  -6.547
   52    H    ASN   9           H        ASN   9   3.645   0.634  -7.909
   53    HA   ASN   9           HA       ASN   9   5.073   0.225 -10.444
   54   1HB   ASN   9          1HB       ASN   9   3.562   2.518 -10.891
   55   2HB   ASN   9          2HB       ASN   9   3.264   0.944 -11.589
   56   1HD2  ASN   9          1HD2      ASN   9   0.626   2.600  -9.135
   57   2HD2  ASN   9          2HD2      ASN   9   2.038   3.394  -9.743
   58    H    SER  10           H        SER  10   4.335   2.164  -7.661
   59    HA   SER  10           HA       SER  10   5.789   4.470  -8.228
   60   1HB   SER  10          1HB       SER  10   5.572   3.266  -5.467
   61   2HB   SER  10          2HB       SER  10   5.617   4.966  -5.921
   62    HG   SER  10           HG       SER  10   3.484   4.412  -5.454
   63    H    GLY  11           H        GLY  11   6.824   1.663  -6.263
   64   1HA   GLY  11          1HA       GLY  11   8.888   0.651  -6.112
   65   2HA   GLY  11          2HA       GLY  11   9.440   1.675  -7.426
   66    H    GLY  12           H        GLY  12   9.947   3.958  -6.836
   67   1HA   GLY  12          1HA       GLY  12  11.561   3.939  -4.419
   68   2HA   GLY  12          2HA       GLY  12  11.584   5.158  -5.683
   69    H    ALA  13           H        ALA  13   8.593   4.130  -4.206
   70    HA   ALA  13           HA       ALA  13   8.508   6.676  -2.724
   71   1HB   ALA  13          1HB       ALA  13   7.050   6.496  -4.836
   72   2HB   ALA  13          2HB       ALA  13   6.042   5.417  -3.871
   73   3HB   ALA  13          3HB       ALA  13   6.303   7.082  -3.349
   74    HA   PRO  14           HA       PRO  14   7.504   4.053   0.697
   75   1HB   PRO  14          1HB       PRO  14   6.905   5.918   2.520
   76   2HB   PRO  14          2HB       PRO  14   8.549   5.734   1.899
   77   1HG   PRO  14          1HG       PRO  14   6.489   7.787   1.229
   78   2HG   PRO  14          2HG       PRO  14   8.246   7.960   1.351
   79   1HD   PRO  14          1HD       PRO  14   6.792   7.658  -1.011
   80   2HD   PRO  14          2HD       PRO  14   8.543   7.437  -0.842
   81    H    CYS  15           H        CYS  15   5.754   3.423   2.101
   82    HA   CYS  15           HA       CYS  15   3.174   3.760   0.827
   83   1HB   CYS  15          1HB       CYS  15   4.051   2.108   3.210
   84   2HB   CYS  15          2HB       CYS  15   2.416   2.109   2.554
   85    H    VAL  16           H        VAL  16   1.716   5.241   1.424
   86    HA   VAL  16           HA       VAL  16   2.155   6.780   3.852
   87    HB   VAL  16           HB       VAL  16   0.115   7.148   1.644
   88   1HG1  VAL  16          1HG1      VAL  16   0.568   8.562   4.198
   89   2HG1  VAL  16          2HG1      VAL  16   0.279   9.565   2.776
   90   3HG1  VAL  16          3HG1      VAL  16  -0.906   8.353   3.252
   91   1HG2  VAL  16          1HG2      VAL  16   2.907   7.900   1.884
   92   2HG2  VAL  16          2HG2      VAL  16   1.837   7.935   0.482
   93   3HG2  VAL  16          3HG2      VAL  16   1.854   9.289   1.612
   94    H    PHE  17           H        PHE  17   1.166   6.274   5.685
   95    HA   PHE  17           HA       PHE  17  -1.378   4.817   5.562
   96   1HB   PHE  17          1HB       PHE  17   0.791   4.796   7.665
   97   2HB   PHE  17          2HB       PHE  17  -0.772   4.032   7.857
   98    HD1  PHE  17           1HD      PHE  17  -1.386   2.426   5.763
   99    HD2  PHE  17           2HD      PHE  17   2.505   3.459   7.111
  100    HE1  PHE  17           1HE      PHE  17  -0.482   0.388   4.728
  101    HE2  PHE  17           2HE      PHE  17   3.426   1.428   6.091
  102    HZ   PHE  17           HZ       PHE  17   1.938  -0.139   4.878
  103    HA   PRO  18           HA       PRO  18  -2.900   4.300   6.726
  104   1HB   PRO  18          1HB       PRO  18  -5.546   5.230   7.090
  105   2HB   PRO  18          2HB       PRO  18  -4.583   4.299   8.238
  106   1HG   PRO  18          1HG       PRO  18  -5.433   6.942   8.578
  107   2HG   PRO  18          2HG       PRO  18  -4.172   6.126   9.517
  108   1HD   PRO  18          1HD       PRO  18  -3.907   8.017   7.217
  109   2HD   PRO  18          2HD       PRO  18  -2.869   7.821   8.648
  110    H    PHE  19           H        PHE  19  -3.392   3.612   4.695
  111    HA   PHE  19           HA       PHE  19  -4.405   5.665   2.852
  112   1HB   PHE  19          1HB       PHE  19  -3.682   4.296   1.003
  113   2HB   PHE  19          2HB       PHE  19  -2.339   4.531   2.114
  114    HD1  PHE  19           1HD      PHE  19  -1.862   2.618   3.771
  115    HD2  PHE  19           2HD      PHE  19  -4.261   2.188   0.288
  116    HE1  PHE  19           1HE      PHE  19  -1.511   0.184   3.820
  117    HE2  PHE  19           2HE      PHE  19  -3.912  -0.241   0.337
  118    HZ   PHE  19           HZ       PHE  19  -2.537  -1.241   2.110
  119    H    THR  20           H        THR  20  -6.397   5.587   2.117
  120    HA   THR  20           HA       THR  20  -8.039   3.402   3.095
  121    HB   THR  20           HB       THR  20  -8.930   5.916   1.661
  122    HG1  THR  20           1HG      THR  20  -8.270   6.887   3.398
  123   1HG2  THR  20          1HG2      THR  20 -10.819   5.275   3.540
  124   2HG2  THR  20          2HG2      THR  20 -10.933   4.967   1.805
  125   3HG2  THR  20          3HG2      THR  20 -10.352   3.703   2.888
  126    H    PHE  21           H        PHE  21  -8.745   1.809   1.972
  127    HA   PHE  21           HA       PHE  21  -8.945   2.011  -0.964
  128   1HB   PHE  21          1HB       PHE  21  -6.940   0.622   0.019
  129   2HB   PHE  21          2HB       PHE  21  -8.181  -0.524   0.447
  130    HD1  PHE  21           1HD      PHE  21  -9.013   1.158  -2.597
  131    HD2  PHE  21           2HD      PHE  21  -6.714  -2.022  -0.955
  132    HE1  PHE  21           1HE      PHE  21  -8.903   0.079  -4.796
  133    HE2  PHE  21           2HE      PHE  21  -6.603  -3.105  -3.142
  134    HZ   PHE  21           HZ       PHE  21  -7.690  -2.041  -5.093
  135    H    LEU  22           H        LEU  22 -10.725   0.839  -1.776
  136    HA   LEU  22           HA       LEU  22 -12.915   0.376  -1.784
  137   1HB   LEU  22          1HB       LEU  22 -11.612  -1.707  -0.138
  138   2HB   LEU  22          2HB       LEU  22 -13.178  -1.934  -0.899
  139    HG   LEU  22           HG       LEU  22 -12.004  -2.759  -2.623
  140   1HD1  LEU  22          1HD1      LEU  22 -11.761   0.024  -2.983
  141   2HD1  LEU  22          2HD1      LEU  22 -10.404  -0.846  -3.691
  142   3HD1  LEU  22          3HD1      LEU  22 -12.053  -1.254  -4.166
  143   1HD2  LEU  22          1HD2      LEU  22 -10.213  -3.025  -0.910
  144   2HD2  LEU  22          2HD2      LEU  22  -9.786  -3.159  -2.616
  145   3HD2  LEU  22          3HD2      LEU  22  -9.448  -1.667  -1.742
  146    H    GLY  23           H        GLY  23 -12.426   2.320   0.238
  147   1HA   GLY  23          1HA       GLY  23 -13.918   3.342   1.703
  148   2HA   GLY  23          2HA       GLY  23 -14.784   1.829   1.843
  149    H    ASN  24           H        ASN  24 -11.686   0.904   2.486
  150    HA   ASN  24           HA       ASN  24 -12.108   1.361   5.365
  151   1HB   ASN  24          1HB       ASN  24 -10.605  -0.830   3.928
  152   2HB   ASN  24          2HB       ASN  24 -10.771  -0.691   5.669
  153   1HD2  ASN  24          1HD2      ASN  24 -13.556  -2.490   3.490
  154   2HD2  ASN  24          2HD2      ASN  24 -12.006  -2.025   2.910
  155    H    LYS  25           H        LYS  25 -10.555   2.291   6.599
  156    HA   LYS  25           HA       LYS  25  -8.349   3.611   5.350
  157   1HB   LYS  25          1HB       LYS  25  -8.977   3.274   8.290
  158   2HB   LYS  25          2HB       LYS  25  -8.009   4.514   7.543
  159   1HG   LYS  25          1HG       LYS  25 -10.915   4.239   6.909
  160   2HG   LYS  25          2HG       LYS  25 -10.353   5.146   8.314
  161   1HD   LYS  25          1HD       LYS  25  -9.475   5.684   5.478
  162   2HD   LYS  25          2HD       LYS  25 -10.792   6.533   6.288
  163   1HE   LYS  25          1HE       LYS  25  -9.148   7.174   8.079
  164   2HE   LYS  25          2HE       LYS  25  -7.877   6.529   7.045
  165   1HZ   LYS  25          1HZ       LYS  25  -8.642   8.107   5.299
  166   2HZ   LYS  25          2HZ       LYS  25  -9.689   8.800   6.444
  167   3HZ   LYS  25          3HZ       LYS  25  -8.006   8.863   6.680
  168    H    TYR  26           H        TYR  26  -6.414   2.524   4.951
  169    HA   TYR  26           HA       TYR  26  -5.869   0.204   6.648
  170   1HB   TYR  26          1HB       TYR  26  -4.663   0.984   4.001
  171   2HB   TYR  26          2HB       TYR  26  -4.264  -0.462   4.918
  172    HD1  TYR  26           1HD      TYR  26  -7.298  -0.809   5.800
  173    HD2  TYR  26           2HD      TYR  26  -5.307  -0.335   2.077
  174    HE1  TYR  26           1HE      TYR  26  -9.091  -2.046   4.681
  175    HE2  TYR  26           2HE      TYR  26  -7.097  -1.566   0.957
  176    HH   TYR  26           HH       TYR  26  -9.874  -1.973   1.821
  177    H    GLU  27           H        GLU  27  -4.836   0.747   8.325
  178    HA   GLU  27           HA       GLU  27  -2.831   2.820   8.376
  179   1HB   GLU  27          1HB       GLU  27  -3.460   0.955  10.632
  180   2HB   GLU  27          2HB       GLU  27  -2.947   2.623  10.695
  181   1HG   GLU  27          1HG       GLU  27  -5.123   3.308   9.770
  182   2HG   GLU  27          2HG       GLU  27  -5.641   1.624   9.846
  183    H    SER  28           H        SER  28  -3.004  -0.510   7.891
  184    HA   SER  28           HA       SER  28  -0.094  -0.740   8.061
  185   1HB   SER  28          1HB       SER  28  -0.560  -3.182   8.638
  186   2HB   SER  28          2HB       SER  28  -0.856  -2.016   9.923
  187    HG   SER  28           HG       SER  28  -3.131  -2.149   8.728
  188    H    CYS  29           H        CYS  29   0.389  -3.033   6.775
  189    HA   CYS  29           HA       CYS  29  -0.372  -2.446   4.109
  190   1HB   CYS  29          1HB       CYS  29   0.809  -5.007   5.170
  191   2HB   CYS  29          2HB       CYS  29   0.771  -4.504   3.498
  192    H    THR  30           H        THR  30  -1.487  -3.913   2.690
  193    HA   THR  30           HA       THR  30  -3.541  -5.566   3.982
  194    HB   THR  30           HB       THR  30  -4.505  -3.284   3.534
  195    HG1  THR  30           1HG      THR  30  -5.999  -4.887   3.426
  196   1HG2  THR  30          1HG2      THR  30  -5.010  -2.905   1.034
  197   2HG2  THR  30          2HG2      THR  30  -3.435  -2.433   1.669
  198   3HG2  THR  30          3HG2      THR  30  -3.601  -3.932   0.756
  199    H    SER  31           H        SER  31  -4.865  -6.596   2.073
  200    HA   SER  31           HA       SER  31  -3.030  -7.392  -0.072
  201   1HB   SER  31          1HB       SER  31  -3.985  -9.718   0.147
  202   2HB   SER  31          2HB       SER  31  -3.011  -9.202   1.533
  203    HG   SER  31           HG       SER  31  -4.915 -10.121   2.309
  204    H    ALA  32           H        ALA  32  -5.369  -5.553   0.464
  205    HA   ALA  32           HA       ALA  32  -7.690  -6.403  -0.837
  206   1HB   ALA  32          1HB       ALA  32  -6.796  -4.080   0.440
  207   2HB   ALA  32          2HB       ALA  32  -7.183  -3.571  -1.205
  208   3HB   ALA  32          3HB       ALA  32  -8.408  -4.364  -0.216
  209    H    GLY  33           H        GLY  33  -8.456  -6.234  -2.874
  210   1HA   GLY  33          1HA       GLY  33  -8.452  -5.938  -5.150
  211   2HA   GLY  33          2HA       GLY  33  -7.064  -4.881  -4.954
  212    H    ARG  34           H        ARG  34  -6.080  -7.611  -3.463
  213    HA   ARG  34           HA       ARG  34  -4.803  -8.530  -5.931
  214   1HB   ARG  34          1HB       ARG  34  -4.032  -9.166  -3.088
  215   2HB   ARG  34          2HB       ARG  34  -3.111  -9.513  -4.532
  216   1HG   ARG  34          1HG       ARG  34  -3.376  -6.848  -4.777
  217   2HG   ARG  34          2HG       ARG  34  -3.383  -7.012  -3.019
  218   1HD   ARG  34          1HD       ARG  34  -1.112  -6.681  -3.984
  219   2HD   ARG  34          2HD       ARG  34  -1.268  -8.173  -3.054
  220    HE   ARG  34           HE       ARG  34  -0.831  -9.354  -4.943
  221   1HH1  ARG  34          1HH1      ARG  34  -1.849  -6.129  -5.865
  222   2HH1  ARG  34          2HH1      ARG  34  -1.545  -6.369  -7.559
  223   1HH2  ARG  34          1HH2      ARG  34  -0.421  -9.676  -7.162
  224   2HH2  ARG  34          2HH2      ARG  34  -0.729  -8.393  -8.293
  225    H    SER  35           H        SER  35  -4.498 -10.766  -6.319
  226    HA   SER  35           HA       SER  35  -6.436 -12.540  -5.002
  227   1HB   SER  35          1HB       SER  35  -6.840 -13.556  -7.299
  228   2HB   SER  35          2HB       SER  35  -7.526 -11.951  -7.040
  229    HG   SER  35           HG       SER  35  -6.303 -12.355  -9.075
  230    H    ASP  36           H        ASP  36  -3.349 -12.025  -5.217
  231    HA   ASP  36           HA       ASP  36  -2.566 -14.754  -5.890
  232   1HB   ASP  36          1HB       ASP  36  -0.213 -13.740  -5.803
  233   2HB   ASP  36          2HB       ASP  36  -1.229 -13.358  -7.170
  234    H    GLY  37           H        GLY  37  -1.079 -12.439  -3.730
  235   1HA   GLY  37          1HA       GLY  37  -1.842 -13.607  -1.335
  236   2HA   GLY  37          2HA       GLY  37  -0.375 -14.419  -1.840
  237    H    LYS  38           H        LYS  38   0.764 -11.929  -3.035
  238    HA   LYS  38           HA       LYS  38   2.162 -11.041  -0.781
  239   1HB   LYS  38          1HB       LYS  38   1.847  -9.487  -3.337
  240   2HB   LYS  38          2HB       LYS  38   3.206  -9.462  -2.217
  241   1HG   LYS  38          1HG       LYS  38   4.102 -10.829  -3.756
  242   2HG   LYS  38          2HG       LYS  38   3.222 -12.055  -2.864
  243   1HD   LYS  38          1HD       LYS  38   1.446 -12.017  -4.441
  244   2HD   LYS  38          2HD       LYS  38   2.110 -10.596  -5.247
  245   1HE   LYS  38          1HE       LYS  38   4.025 -11.884  -6.000
  246   2HE   LYS  38          2HE       LYS  38   3.440 -13.300  -5.119
  247   1HZ   LYS  38          1HZ       LYS  38   1.489 -12.197  -6.930
  248   2HZ   LYS  38          2HZ       LYS  38   2.904 -12.718  -7.722
  249   3HZ   LYS  38          3HZ       LYS  38   2.025 -13.799  -6.744
  250    H    MET  39           H        MET  39   1.912  -9.374   0.605
  251    HA   MET  39           HA       MET  39  -0.559  -7.861   0.391
  252   1HB   MET  39          1HB       MET  39   1.494  -7.746   2.609
  253   2HB   MET  39          2HB       MET  39  -0.160  -7.162   2.643
  254   1HG   MET  39          1HG       MET  39  -0.926  -9.519   2.367
  255   2HG   MET  39          2HG       MET  39   0.752 -10.018   2.559
  256   1HE   MET  39          1HE       MET  39  -1.515  -7.391   3.939
  257   2HE   MET  39          2HE       MET  39  -2.431  -8.528   4.928
  258   3HE   MET  39          3HE       MET  39  -1.281  -7.428   5.686
  259    H    TRP  40           H        TRP  40  -0.480  -5.496   0.596
  260    HA   TRP  40           HA       TRP  40   2.083  -4.295  -0.176
  261   1HB   TRP  40          1HB       TRP  40   0.971  -3.059  -2.014
  262   2HB   TRP  40          2HB       TRP  40   0.957  -4.800  -2.287
  263    HD1  TRP  40           HD1      TRP  40  -1.513  -6.023  -1.551
  264    HE1  TRP  40           1HE      TRP  40  -3.890  -5.087  -1.841
  265    HE3  TRP  40           3HE      TRP  40  -0.368  -1.099  -2.180
  266    HZ2  TRP  40           2HZ      TRP  40  -5.107  -2.592  -2.257
  267    HZ3  TRP  40           3HZ      TRP  40  -2.201   0.509  -2.509
  268    HH2  TRP  40           HH2      TRP  40  -4.524  -0.229  -2.551
  269    H    CYS  41           H        CYS  41   1.369  -1.794  -0.678
  270    HA   CYS  41           HA       CYS  41  -0.581  -0.724   1.116
  271   1HB   CYS  41          1HB       CYS  41   1.263   0.756   2.231
  272   2HB   CYS  41          2HB       CYS  41   0.929  -0.848   2.872
  273    H    ALA  42           H        ALA  42  -1.186   1.320   0.466
  274    HA   ALA  42           HA       ALA  42  -0.290   2.111  -2.116
  275   1HB   ALA  42          1HB       ALA  42  -2.341   3.056  -0.225
  276   2HB   ALA  42          2HB       ALA  42  -1.720   4.246  -1.370
  277   3HB   ALA  42          3HB       ALA  42  -2.441   2.748  -1.958
  278    H    THR  43           H        THR  43   0.560   4.119  -2.727
  279    HA   THR  43           HA       THR  43   2.473   5.146  -0.762
  280    HB   THR  43           HB       THR  43   3.775   5.913  -2.694
  281    HG1  THR  43           1HG      THR  43   2.508   6.331  -4.367
  282   1HG2  THR  43          1HG2      THR  43   3.644   3.458  -3.892
  283   2HG2  THR  43          2HG2      THR  43   4.611   3.859  -2.472
  284   3HG2  THR  43          3HG2      THR  43   3.014   3.136  -2.277
  285    H    THR  44           H        THR  44  -0.463   5.769  -1.456
  286    HA   THR  44           HA       THR  44  -0.195   8.675  -1.216
  287    HB   THR  44           HB       THR  44  -2.346   8.841  -2.567
  288    HG1  THR  44           1HG      THR  44  -3.231   7.048  -3.158
  289   1HG2  THR  44          1HG2      THR  44  -1.192   8.261  -4.810
  290   2HG2  THR  44          2HG2      THR  44  -0.556   9.571  -3.813
  291   3HG2  THR  44          3HG2      THR  44   0.232   7.994  -3.803
  292    H    ALA  45           H        ALA  45  -1.892   9.647   0.055
  293    HA   ALA  45           HA       ALA  45  -2.696   8.159   2.283
  294   1HB   ALA  45          1HB       ALA  45  -3.112  10.858   1.298
  295   2HB   ALA  45          2HB       ALA  45  -4.493  10.244   2.205
  296   3HB   ALA  45          3HB       ALA  45  -2.895  10.275   2.947
  297    H    ASN  46           H        ASN  46  -4.316   8.729  -0.759
  298    HA   ASN  46           HA       ASN  46  -6.418   6.881   0.096
  299   1HB   ASN  46          1HB       ASN  46  -7.337   9.189  -0.072
  300   2HB   ASN  46          2HB       ASN  46  -6.822   9.238  -1.758
  301   1HD2  ASN  46          1HD2      ASN  46 -10.306   7.645  -0.755
  302   2HD2  ASN  46          2HD2      ASN  46  -9.300   8.529   0.332
  303    H    TYR  47           H        TYR  47  -6.329   5.108  -1.048
  304    HA   TYR  47           HA       TYR  47  -4.745   5.035  -3.461
  305   1HB   TYR  47          1HB       TYR  47  -4.550   3.273  -1.715
  306   2HB   TYR  47          2HB       TYR  47  -6.192   2.758  -2.097
  307    HD1  TYR  47           1HD      TYR  47  -2.815   3.193  -3.552
  308    HD2  TYR  47           2HD      TYR  47  -6.585   1.260  -3.871
  309    HE1  TYR  47           1HE      TYR  47  -1.924   1.767  -5.333
  310    HE2  TYR  47           2HE      TYR  47  -5.698  -0.165  -5.660
  311    HH   TYR  47           HH       TYR  47  -3.071  -0.952  -6.244
  312    H    ASP  48           H        ASP  48  -8.136   4.833  -2.619
  313    HA   ASP  48           HA       ASP  48  -9.113   3.713  -4.979
  314   1HB   ASP  48          1HB       ASP  48 -10.276   5.462  -2.857
  315   2HB   ASP  48          2HB       ASP  48 -11.213   5.127  -4.307
  316    H    ASP  49           H        ASP  49  -8.156   6.980  -4.254
  317    HA   ASP  49           HA       ASP  49  -9.299   8.044  -6.695
  318   1HB   ASP  49          1HB       ASP  49  -7.917   9.235  -4.324
  319   2HB   ASP  49          2HB       ASP  49  -8.116  10.174  -5.797
  320    H    ASP  50           H        ASP  50  -6.007   7.638  -5.347
  321    HA   ASP  50           HA       ASP  50  -4.936   8.526  -7.921
  322   1HB   ASP  50          1HB       ASP  50  -3.809   8.367  -5.167
  323   2HB   ASP  50          2HB       ASP  50  -2.710   8.361  -6.544
  324    H    ARG  51           H        ARG  51  -5.374   5.616  -6.190
  325    HA   ARG  51           HA       ARG  51  -4.591   3.524  -6.391
  326   1HB   ARG  51          1HB       ARG  51  -4.819   4.262  -9.283
  327   2HB   ARG  51          2HB       ARG  51  -4.871   2.633  -8.618
  328   1HG   ARG  51          1HG       ARG  51  -6.744   3.812  -7.115
  329   2HG   ARG  51          2HG       ARG  51  -6.919   4.745  -8.605
  330   1HD   ARG  51          1HD       ARG  51  -6.804   1.762  -8.637
  331   2HD   ARG  51          2HD       ARG  51  -8.305   2.606  -8.263
  332    HE   ARG  51           HE       ARG  51  -8.506   3.221 -10.475
  333   1HH1  ARG  51          1HH1      ARG  51  -5.377   1.723  -9.987
  334   2HH1  ARG  51          2HH1      ARG  51  -4.931   1.826 -11.661
  335   1HH2  ARG  51          1HH2      ARG  51  -7.986   3.247 -12.654
  336   2HH2  ARG  51          2HH2      ARG  51  -6.458   2.621 -13.197
  337    H    LYS  52           H        LYS  52  -2.401   4.817  -5.692
  338    HA   LYS  52           HA       LYS  52  -0.351   3.672  -7.448
  339   1HB   LYS  52          1HB       LYS  52  -0.233   6.125  -5.696
  340   2HB   LYS  52          2HB       LYS  52   1.224   5.324  -6.270
  341   1HG   LYS  52          1HG       LYS  52   0.510   5.680  -8.587
  342   2HG   LYS  52          2HG       LYS  52  -0.941   6.494  -8.005
  343   1HD   LYS  52          1HD       LYS  52   0.347   8.269  -7.048
  344   2HD   LYS  52          2HD       LYS  52   1.862   7.405  -7.362
  345   1HE   LYS  52          1HE       LYS  52  -0.066   8.524  -9.414
  346   2HE   LYS  52          2HE       LYS  52   1.542   9.140  -9.027
  347   1HZ   LYS  52          1HZ       LYS  52   2.120   6.614  -9.645
  348   2HZ   LYS  52          2HZ       LYS  52   0.769   6.850 -10.645
  349   3HZ   LYS  52          3HZ       LYS  52   2.119   7.877 -10.780
  350    H    TRP  53           H        TRP  53   0.535   1.925  -6.641
  351    HA   TRP  53           HA       TRP  53   0.581   1.610  -3.723
  352   1HB   TRP  53          1HB       TRP  53  -0.191  -0.651  -3.984
  353   2HB   TRP  53          2HB       TRP  53  -1.303   0.432  -4.750
  354    HD1  TRP  53           HD1      TRP  53  -0.826   0.623  -7.619
  355    HE1  TRP  53           1HE      TRP  53  -0.320  -1.372  -9.180
  356    HE3  TRP  53           3HE      TRP  53   0.651  -2.644  -4.110
  357    HZ2  TRP  53           2HZ      TRP  53   0.607  -4.064  -8.888
  358    HZ3  TRP  53           3HZ      TRP  53   1.342  -4.941  -4.766
  359    HH2  TRP  53           HH2      TRP  53   1.317  -5.623  -7.118
  360    H    GLY  54           H        GLY  54   1.687  -0.432  -3.117
  361   1HA   GLY  54          1HA       GLY  54   3.891  -1.409  -4.629
  362   2HA   GLY  54          2HA       GLY  54   4.407  -0.285  -3.372
  363    H    PHE  55           H        PHE  55   4.643  -3.302  -3.685
  364    HA   PHE  55           HA       PHE  55   3.013  -4.601  -1.844
  365   1HB   PHE  55          1HB       PHE  55   5.751  -5.194  -2.926
  366   2HB   PHE  55          2HB       PHE  55   4.982  -6.244  -1.751
  367    HD1  PHE  55           1HD      PHE  55   2.200  -6.179  -2.650
  368    HD2  PHE  55           2HD      PHE  55   5.797  -6.437  -4.896
  369    HE1  PHE  55           1HE      PHE  55   0.999  -7.413  -4.404
  370    HE2  PHE  55           2HE      PHE  55   4.600  -7.666  -6.669
  371    HZ   PHE  55           HZ       PHE  55   2.199  -8.147  -6.427
  372    H    CYS  56           H        CYS  56   3.549  -5.491   0.218
  373    HA   CYS  56           HA       CYS  56   4.598  -3.516   2.018
  374   1HB   CYS  56          1HB       CYS  56   2.652  -5.146   2.425
  375   2HB   CYS  56          2HB       CYS  56   3.887  -6.374   2.678
  376    HA   PRO  57           HA       PRO  57   8.687  -5.357   1.786
  377   1HB   PRO  57          1HB       PRO  57  10.106  -3.324   2.584
  378   2HB   PRO  57          2HB       PRO  57   9.145  -3.146   1.101
  379   1HG   PRO  57          1HG       PRO  57   8.419  -2.387   3.896
  380   2HG   PRO  57          2HG       PRO  57   8.419  -1.330   2.466
  381   1HD   PRO  57          1HD       PRO  57   6.169  -2.577   3.359
  382   2HD   PRO  57          2HD       PRO  57   6.462  -2.286   1.628
  383    H    ASP  58           H        ASP  58  10.617  -4.789   3.558
  384    HA   ASP  58           HA       ASP  58  11.481  -5.926   5.373
  385   1HB   ASP  58          1HB       ASP  58  11.136  -3.456   5.823
  386   2HB   ASP  58          2HB       ASP  58   9.745  -3.928   6.782
  387    H    GLN  59           H        GLN  59  10.055  -7.904   4.890
  388    HA   GLN  59           HA       GLN  59   8.389  -8.425   7.269
  389   1HB   GLN  59          1HB       GLN  59   8.010  -9.547   4.483
  390   2HB   GLN  59          2HB       GLN  59   7.104 -10.057   5.894
  391   1HG   GLN  59          1HG       GLN  59   6.301  -7.681   6.085
  392   2HG   GLN  59          2HG       GLN  59   7.019  -7.402   4.499
  393   1HE2  GLN  59          1HE2      GLN  59   4.379  -8.792   2.756
  394   2HE2  GLN  59          2HE2      GLN  59   5.846  -7.874   2.760
  395    H    GLY  60           H        GLY  60   9.825 -10.309   4.631
  396   1HA   GLY  60          1HA       GLY  60  11.963 -11.490   5.729
  397   2HA   GLY  60          2HA       GLY  60  10.644 -12.375   6.491
  Start of MODEL    7
    1    H    SER   1           1H       SER   1  12.762   7.420   5.900
    2    HA   SER   1           HA       SER   1  11.269   5.658   7.676
    3   1HB   SER   1          1HB       SER   1  11.497   5.870   4.657
    4   2HB   SER   1          2HB       SER   1  10.280   4.973   5.568
    5    HG   SER   1           HG       SER   1   9.162   6.736   5.612
    6    H    TRP   2           H        TRP   2  11.434   3.321   7.174
    7    HA   TRP   2           HA       TRP   2  14.186   2.510   7.224
    8   1HB   TRP   2          1HB       TRP   2  12.363   1.427   8.587
    9   2HB   TRP   2          2HB       TRP   2  11.737   0.734   7.097
   10    HD1  TRP   2           HD1      TRP   2  12.226  -1.774   7.513
   11    HE1  TRP   2           1HE      TRP   2  14.358  -3.174   7.866
   12    HE3  TRP   2           3HE      TRP   2  15.588   2.021   8.149
   13    HZ2  TRP   2           2HZ      TRP   2  17.097  -2.723   8.361
   14    HZ3  TRP   2           3HZ      TRP   2  17.942   1.449   8.563
   15    HH2  TRP   2           HH2      TRP   2  18.682  -0.873   8.669
   16    H    MET   3           H        MET   3  11.788   0.704   5.386
   17    HA   MET   3           HA       MET   3  13.587   0.803   3.079
   18   1HB   MET   3          1HB       MET   3  11.349  -1.109   3.746
   19   2HB   MET   3          2HB       MET   3  12.373  -1.205   2.322
   20   1HG   MET   3          1HG       MET   3  13.359  -1.368   5.150
   21   2HG   MET   3          2HG       MET   3  12.995  -2.756   4.133
   22   1HE   MET   3          1HE       MET   3  15.309  -3.674   4.668
   23   2HE   MET   3          2HE       MET   3  16.846  -2.978   4.152
   24   3HE   MET   3          3HE       MET   3  15.978  -2.283   5.522
   25    H    SER   4           H        SER   4  12.535   0.754   0.921
   26    HA   SER   4           HA       SER   4  10.283   2.647   0.854
   27   1HB   SER   4          1HB       SER   4  12.286   1.884  -1.295
   28   2HB   SER   4          2HB       SER   4  10.993   3.071  -1.487
   29    HG   SER   4           HG       SER   4  13.225   3.203   0.275
   30    H    THR   5           H        THR   5   9.243   2.178  -1.615
   31    HA   THR   5           HA       THR   5   7.856  -0.286  -1.134
   32    HB   THR   5           HB       THR   5   6.664   0.460  -3.321
   33    HG1  THR   5           1HG      THR   5   7.323   3.048  -2.690
   34   1HG2  THR   5          1HG2      THR   5   6.069   2.542  -1.386
   35   2HG2  THR   5          2HG2      THR   5   5.052   1.245  -2.019
   36   3HG2  THR   5          3HG2      THR   5   6.142   0.931  -0.670
   37    H    VAL   6           H        VAL   6   7.484  -1.878  -2.633
   38    HA   VAL   6           HA       VAL   6   9.429  -2.314  -4.764
   39    HB   VAL   6           HB       VAL   6  10.394  -3.851  -3.385
   40   1HG1  VAL   6          1HG1      VAL   6   8.586  -2.967  -1.568
   41   2HG1  VAL   6          2HG1      VAL   6   8.170  -4.677  -1.677
   42   3HG1  VAL   6          3HG1      VAL   6   9.810  -4.196  -1.248
   43   1HG2  VAL   6          1HG2      VAL   6   8.260  -5.115  -4.744
   44   2HG2  VAL   6          2HG2      VAL   6   9.820  -5.790  -4.267
   45   3HG2  VAL   6          3HG2      VAL   6   8.446  -5.877  -3.165
   46    H    GLY   7           H        GLY   7   8.348  -4.028  -6.319
   47   1HA   GLY   7          1HA       GLY   7   6.383  -4.720  -7.418
   48   2HA   GLY   7          2HA       GLY   7   5.577  -4.549  -5.883
   49    H    GLY   8           H        GLY   8   3.749  -3.642  -6.822
   50   1HA   GLY   8          1HA       GLY   8   2.383  -1.970  -7.591
   51   2HA   GLY   8          2HA       GLY   8   3.440  -0.942  -6.648
   52    H    ASN   9           H        ASN   9   3.172   0.789  -8.042
   53    HA   ASN   9           HA       ASN   9   4.712   0.510 -10.515
   54   1HB   ASN   9          1HB       ASN   9   3.206   2.059 -11.699
   55   2HB   ASN   9          2HB       ASN   9   2.442   0.548 -11.277
   56   1HD2  ASN   9          1HD2      ASN   9   1.054   3.002  -8.548
   57   2HD2  ASN   9          2HD2      ASN   9   2.585   2.200  -8.503
   58    H    SER  10           H        SER  10   4.399   2.048  -7.600
   59    HA   SER  10           HA       SER  10   5.374   4.634  -8.389
   60   1HB   SER  10          1HB       SER  10   5.540   3.504  -5.597
   61   2HB   SER  10          2HB       SER  10   5.299   5.169  -6.102
   62    HG   SER  10           HG       SER  10   3.317   4.433  -5.463
   63    H    GLY  11           H        GLY  11   6.711   1.796  -6.705
   64   1HA   GLY  11          1HA       GLY  11   8.850   1.017  -6.458
   65   2HA   GLY  11          2HA       GLY  11   9.142   1.725  -8.030
   66    H    GLY  12           H        GLY  12   8.981   2.599  -4.570
   67   1HA   GLY  12          1HA       GLY  12  11.308   3.502  -3.928
   68   2HA   GLY  12          2HA       GLY  12  10.960   4.700  -5.164
   69    H    ALA  13           H        ALA  13   8.252   5.182  -4.624
   70    HA   ALA  13           HA       ALA  13   8.513   7.044  -2.515
   71   1HB   ALA  13          1HB       ALA  13   6.866   6.989  -4.560
   72   2HB   ALA  13          2HB       ALA  13   5.808   6.179  -3.402
   73   3HB   ALA  13          3HB       ALA  13   6.427   7.794  -3.055
   74    HA   PRO  14           HA       PRO  14   7.675   4.498   1.007
   75   1HB   PRO  14          1HB       PRO  14   6.757   6.946   2.337
   76   2HB   PRO  14          2HB       PRO  14   8.153   5.935   2.705
   77   1HG   PRO  14          1HG       PRO  14   8.366   8.420   1.632
   78   2HG   PRO  14          2HG       PRO  14   9.550   7.133   1.345
   79   1HD   PRO  14          1HD       PRO  14   7.398   8.162  -0.456
   80   2HD   PRO  14          2HD       PRO  14   9.014   7.544  -0.848
   81    H    CYS  15           H        CYS  15   5.856   3.743   2.215
   82    HA   CYS  15           HA       CYS  15   3.336   4.082   0.871
   83   1HB   CYS  15          1HB       CYS  15   3.654   2.815   3.598
   84   2HB   CYS  15          2HB       CYS  15   2.472   2.451   2.350
   85    H    VAL  16           H        VAL  16   1.640   5.402   1.469
   86    HA   VAL  16           HA       VAL  16   2.145   7.240   3.688
   87    HB   VAL  16           HB       VAL  16   0.060   7.352   1.495
   88   1HG1  VAL  16          1HG1      VAL  16   0.133   8.675   4.033
   89   2HG1  VAL  16          2HG1      VAL  16   0.371   9.861   2.748
   90   3HG1  VAL  16          3HG1      VAL  16  -1.053   8.822   2.736
   91   1HG2  VAL  16          1HG2      VAL  16   2.791   8.079   1.543
   92   2HG2  VAL  16          2HG2      VAL  16   1.604   8.365   0.269
   93   3HG2  VAL  16          3HG2      VAL  16   1.846   9.570   1.535
   94    H    PHE  17           H        PHE  17   1.364   6.698   5.601
   95    HA   PHE  17           HA       PHE  17  -1.217   5.311   5.723
   96   1HB   PHE  17          1HB       PHE  17   1.164   5.112   7.566
   97   2HB   PHE  17          2HB       PHE  17  -0.409   4.432   7.915
   98    HD1  PHE  17           1HD      PHE  17  -1.328   2.999   5.726
   99    HD2  PHE  17           2HD      PHE  17   2.698   3.626   6.922
  100    HE1  PHE  17           1HE      PHE  17  -0.667   0.936   4.576
  101    HE2  PHE  17           2HE      PHE  17   3.379   1.568   5.776
  102    HZ   PHE  17           HZ       PHE  17   1.700   0.190   4.583
  103    HA   PRO  18           HA       PRO  18  -2.615   4.859   6.943
  104   1HB   PRO  18          1HB       PRO  18  -5.156   5.614   7.579
  105   2HB   PRO  18          2HB       PRO  18  -3.996   4.992   8.751
  106   1HG   PRO  18          1HG       PRO  18  -5.035   7.707   8.435
  107   2HG   PRO  18          2HG       PRO  18  -4.171   6.993   9.803
  108   1HD   PRO  18          1HD       PRO  18  -3.155   8.724   7.730
  109   2HD   PRO  18          2HD       PRO  18  -2.310   8.106   9.163
  110    H    PHE  19           H        PHE  19  -3.400   4.262   4.997
  111    HA   PHE  19           HA       PHE  19  -4.456   6.440   3.315
  112   1HB   PHE  19          1HB       PHE  19  -3.918   5.167   1.348
  113   2HB   PHE  19          2HB       PHE  19  -2.487   5.272   2.353
  114    HD1  PHE  19           1HD      PHE  19  -1.838   3.230   3.721
  115    HD2  PHE  19           2HD      PHE  19  -4.751   3.121   0.621
  116    HE1  PHE  19           1HE      PHE  19  -1.530   0.798   3.516
  117    HE2  PHE  19           2HE      PHE  19  -4.442   0.691   0.411
  118    HZ   PHE  19           HZ       PHE  19  -2.831  -0.479   1.859
  119    H    THR  20           H        THR  20  -5.876   4.933   1.465
  120    HA   THR  20           HA       THR  20  -7.763   3.343   3.002
  121    HB   THR  20           HB       THR  20  -8.594   5.899   1.581
  122    HG1  THR  20           1HG      THR  20  -7.754   5.473   4.079
  123   1HG2  THR  20          1HG2      THR  20 -10.292   4.035   3.210
  124   2HG2  THR  20          2HG2      THR  20 -10.802   5.536   2.437
  125   3HG2  THR  20          3HG2      THR  20 -10.319   4.158   1.450
  126    H    PHE  21           H        PHE  21  -8.422   1.696   1.859
  127    HA   PHE  21           HA       PHE  21  -8.294   1.910  -1.085
  128   1HB   PHE  21          1HB       PHE  21  -6.565   0.405   0.045
  129   2HB   PHE  21          2HB       PHE  21  -7.910  -0.602   0.524
  130    HD1  PHE  21           1HD      PHE  21  -6.649   0.971  -2.627
  131    HD2  PHE  21           2HD      PHE  21  -8.365  -2.437  -0.763
  132    HE1  PHE  21           1HE      PHE  21  -6.401  -0.284  -4.711
  133    HE2  PHE  21           2HE      PHE  21  -8.122  -3.697  -2.837
  134    HZ   PHE  21           HZ       PHE  21  -7.128  -2.643  -4.821
  135    H    LEU  22           H        LEU  22 -10.021   1.361  -2.137
  136    HA   LEU  22           HA       LEU  22 -12.197   0.947  -2.568
  137   1HB   LEU  22          1HB       LEU  22 -10.820  -1.393  -1.415
  138   2HB   LEU  22          2HB       LEU  22 -12.479  -1.580  -1.945
  139    HG   LEU  22           HG       LEU  22 -11.810  -1.003  -4.182
  140   1HD1  LEU  22          1HD1      LEU  22 -10.187   0.643  -3.670
  141   2HD1  LEU  22          2HD1      LEU  22  -9.072  -0.654  -3.237
  142   3HD1  LEU  22          3HD1      LEU  22  -9.661  -0.514  -4.893
  143   1HD2  LEU  22          1HD2      LEU  22 -11.614  -3.330  -3.468
  144   2HD2  LEU  22          2HD2      LEU  22 -10.495  -2.896  -4.759
  145   3HD2  LEU  22          3HD2      LEU  22  -9.917  -3.012  -3.098
  146    H    GLY  23           H        GLY  23 -11.951   2.298   0.014
  147   1HA   GLY  23          1HA       GLY  23 -13.936   2.907   1.250
  148   2HA   GLY  23          2HA       GLY  23 -14.405   1.221   1.232
  149    H    ASN  24           H        ASN  24 -11.393   0.630   2.053
  150    HA   ASN  24           HA       ASN  24 -11.939   1.163   4.894
  151   1HB   ASN  24          1HB       ASN  24 -10.216  -1.013   3.726
  152   2HB   ASN  24          2HB       ASN  24 -10.722  -0.834   5.400
  153   1HD2  ASN  24          1HD2      ASN  24 -12.931  -2.904   2.853
  154   2HD2  ASN  24          2HD2      ASN  24 -11.312  -2.381   2.561
  155    H    LYS  25           H        LYS  25 -10.502   2.266   6.088
  156    HA   LYS  25           HA       LYS  25  -8.221   3.435   4.831
  157   1HB   LYS  25          1HB       LYS  25  -9.107   3.504   7.720
  158   2HB   LYS  25          2HB       LYS  25  -8.035   4.618   6.909
  159   1HG   LYS  25          1HG       LYS  25  -9.886   5.317   5.447
  160   2HG   LYS  25          2HG       LYS  25 -10.958   4.257   6.369
  161   1HD   LYS  25          1HD       LYS  25 -11.222   6.464   7.220
  162   2HD   LYS  25          2HD       LYS  25 -10.308   5.537   8.413
  163   1HE   LYS  25          1HE       LYS  25  -8.226   6.527   7.625
  164   2HE   LYS  25          2HE       LYS  25  -9.096   7.399   6.361
  165   1HZ   LYS  25          1HZ       LYS  25 -10.399   8.327   8.424
  166   2HZ   LYS  25          2HZ       LYS  25  -8.965   7.919   9.247
  167   3HZ   LYS  25          3HZ       LYS  25  -8.922   9.007   7.941
  168    H    TYR  26           H        TYR  26  -6.164   2.611   4.886
  169    HA   TYR  26           HA       TYR  26  -5.707   0.387   6.746
  170   1HB   TYR  26          1HB       TYR  26  -4.362   0.954   4.108
  171   2HB   TYR  26          2HB       TYR  26  -4.043  -0.416   5.159
  172    HD1  TYR  26           1HD      TYR  26  -7.022  -0.875   5.899
  173    HD2  TYR  26           2HD      TYR  26  -5.022  -0.319   2.194
  174    HE1  TYR  26           1HE      TYR  26  -8.755  -2.176   4.767
  175    HE2  TYR  26           2HE      TYR  26  -6.749  -1.615   1.059
  176    HH   TYR  26           HH       TYR  26  -8.730  -3.654   2.425
  177    H    GLU  27           H        GLU  27  -4.418   0.711   8.285
  178    HA   GLU  27           HA       GLU  27  -2.607   2.989   8.299
  179   1HB   GLU  27          1HB       GLU  27  -3.609   1.139  10.443
  180   2HB   GLU  27          2HB       GLU  27  -2.421   2.384  10.728
  181   1HG   GLU  27          1HG       GLU  27  -4.004   4.096  10.078
  182   2HG   GLU  27          2HG       GLU  27  -5.203   2.861   9.698
  183    H    SER  28           H        SER  28  -2.619  -0.323   7.785
  184    HA   SER  28           HA       SER  28   0.299  -0.445   7.967
  185   1HB   SER  28          1HB       SER  28  -0.104  -2.914   8.509
  186   2HB   SER  28          2HB       SER  28  -0.444  -1.770   9.808
  187    HG   SER  28           HG       SER  28  -2.070  -3.566   8.879
  188    H    CYS  29           H        CYS  29   0.811  -2.770   6.681
  189    HA   CYS  29           HA       CYS  29   0.083  -2.174   4.003
  190   1HB   CYS  29          1HB       CYS  29   1.353  -4.646   5.169
  191   2HB   CYS  29          2HB       CYS  29   1.161  -4.344   3.459
  192    H    THR  30           H        THR  30  -0.910  -3.844   2.573
  193    HA   THR  30           HA       THR  30  -2.989  -5.441   3.864
  194    HB   THR  30           HB       THR  30  -4.003  -3.177   3.476
  195    HG1  THR  30           1HG      THR  30  -5.493  -4.723   3.352
  196   1HG2  THR  30          1HG2      THR  30  -4.238  -3.463   0.602
  197   2HG2  THR  30          2HG2      THR  30  -3.842  -2.044   1.571
  198   3HG2  THR  30          3HG2      THR  30  -2.574  -3.181   1.110
  199    H    SER  31           H        SER  31  -4.150  -6.759   2.244
  200    HA   SER  31           HA       SER  31  -2.482  -7.327  -0.109
  201   1HB   SER  31          1HB       SER  31  -3.382  -9.740   0.220
  202   2HB   SER  31          2HB       SER  31  -2.076  -9.182   1.273
  203    HG   SER  31           HG       SER  31  -3.358  -9.285   2.937
  204    H    ALA  32           H        ALA  32  -4.765  -5.628   0.480
  205    HA   ALA  32           HA       ALA  32  -7.171  -6.651  -0.557
  206   1HB   ALA  32          1HB       ALA  32  -6.487  -4.400   0.768
  207   2HB   ALA  32          2HB       ALA  32  -6.606  -3.761  -0.870
  208   3HB   ALA  32          3HB       ALA  32  -7.993  -4.564  -0.139
  209    H    GLY  33           H        GLY  33  -8.061  -6.651  -2.541
  210   1HA   GLY  33          1HA       GLY  33  -8.243  -6.401  -4.823
  211   2HA   GLY  33          2HA       GLY  33  -6.950  -5.216  -4.751
  212    H    ARG  34           H        ARG  34  -5.600  -7.754  -3.230
  213    HA   ARG  34           HA       ARG  34  -4.431  -8.690  -5.751
  214   1HB   ARG  34          1HB       ARG  34  -3.395  -9.021  -2.929
  215   2HB   ARG  34          2HB       ARG  34  -2.588  -9.519  -4.394
  216   1HG   ARG  34          1HG       ARG  34  -2.902  -6.946  -4.979
  217   2HG   ARG  34          2HG       ARG  34  -2.882  -6.832  -3.217
  218   1HD   ARG  34          1HD       ARG  34  -0.630  -6.581  -4.198
  219   2HD   ARG  34          2HD       ARG  34  -0.745  -7.991  -3.136
  220    HE   ARG  34           HE       ARG  34  -0.286  -9.327  -4.914
  221   1HH1  ARG  34          1HH1      ARG  34  -1.414  -6.242  -6.162
  222   2HH1  ARG  34          2HH1      ARG  34  -1.123  -6.675  -7.818
  223   1HH2  ARG  34          1HH2      ARG  34   0.053  -9.886  -7.112
  224   2HH2  ARG  34          2HH2      ARG  34  -0.295  -8.723  -8.356
  225    H    SER  35           H        SER  35  -4.666 -10.301  -2.612
  226    HA   SER  35           HA       SER  35  -5.419 -12.347  -1.964
  227   1HB   SER  35          1HB       SER  35  -7.084 -12.368  -4.496
  228   2HB   SER  35          2HB       SER  35  -7.365 -13.301  -3.024
  229    HG   SER  35           HG       SER  35  -7.613 -11.203  -1.951
  230    H    ASP  36           H        ASP  36  -3.285 -11.805  -4.121
  231    HA   ASP  36           HA       ASP  36  -3.131 -14.430  -5.352
  232   1HB   ASP  36          1HB       ASP  36  -1.712 -13.485  -6.908
  233   2HB   ASP  36          2HB       ASP  36  -2.693 -12.101  -6.463
  234    H    GLY  37           H        GLY  37  -1.590 -12.412  -3.027
  235   1HA   GLY  37          1HA       GLY  37  -0.635 -14.216  -1.301
  236   2HA   GLY  37          2HA       GLY  37   0.589 -14.271  -2.557
  237    H    LYS  38           H        LYS  38   1.368 -11.957  -3.217
  238    HA   LYS  38           HA       LYS  38   2.687 -10.887  -1.021
  239   1HB   LYS  38          1HB       LYS  38   2.177  -9.676  -3.737
  240   2HB   LYS  38          2HB       LYS  38   3.387  -9.121  -2.586
  241   1HG   LYS  38          1HG       LYS  38   4.623 -10.425  -3.992
  242   2HG   LYS  38          2HG       LYS  38   4.280 -11.546  -2.693
  243   1HD   LYS  38          1HD       LYS  38   3.815 -12.872  -4.486
  244   2HD   LYS  38          2HD       LYS  38   2.227 -12.129  -4.275
  245   1HE   LYS  38          1HE       LYS  38   2.713 -10.501  -5.994
  246   2HE   LYS  38          2HE       LYS  38   4.366 -11.105  -6.145
  247   1HZ   LYS  38          1HZ       LYS  38   3.279 -13.311  -6.724
  248   2HZ   LYS  38          2HZ       LYS  38   1.844 -12.427  -6.934
  249   3HZ   LYS  38          3HZ       LYS  38   3.206 -12.080  -7.892
  250    H    MET  39           H        MET  39   2.588  -8.929   0.008
  251    HA   MET  39           HA       MET  39  -0.058  -7.685   0.100
  252   1HB   MET  39          1HB       MET  39   2.181  -7.470   2.122
  253   2HB   MET  39          2HB       MET  39   0.517  -6.960   2.316
  254   1HG   MET  39          1HG       MET  39  -0.259  -9.207   2.359
  255   2HG   MET  39          2HG       MET  39   1.341  -9.811   1.927
  256   1HE   MET  39          1HE       MET  39   3.411  -9.747   3.442
  257   2HE   MET  39          2HE       MET  39   3.292  -8.026   3.810
  258   3HE   MET  39          3HE       MET  39   3.437  -9.199   5.117
  259    H    TRP  40           H        TRP  40  -0.068  -5.298   0.349
  260    HA   TRP  40           HA       TRP  40   2.364  -3.985  -0.619
  261   1HB   TRP  40          1HB       TRP  40   1.091  -2.734  -2.327
  262   2HB   TRP  40          2HB       TRP  40   1.147  -4.464  -2.662
  263    HD1  TRP  40           HD1      TRP  40  -1.231  -5.806  -1.763
  264    HE1  TRP  40           1HE      TRP  40  -3.662  -4.991  -1.979
  265    HE3  TRP  40           3HE      TRP  40  -0.353  -0.846  -2.486
  266    HZ2  TRP  40           2HZ      TRP  40  -5.021  -2.563  -2.367
  267    HZ3  TRP  40           3HZ      TRP  40  -2.269   0.667  -2.744
  268    HH2  TRP  40           HH2      TRP  40  -4.555  -0.176  -2.692
  269    H    CYS  41           H        CYS  41   1.336  -1.511  -1.116
  270    HA   CYS  41           HA       CYS  41  -0.243  -0.520   1.076
  271   1HB   CYS  41          1HB       CYS  41   1.540   0.932   1.992
  272   2HB   CYS  41          2HB       CYS  41   1.956  -0.769   2.191
  273    H    ALA  42           H        ALA  42  -0.780   1.752   0.708
  274    HA   ALA  42           HA       ALA  42  -0.441   2.483  -2.092
  275   1HB   ALA  42          1HB       ALA  42  -2.516   2.857  -0.301
  276   2HB   ALA  42          2HB       ALA  42  -1.786   4.459  -0.440
  277   3HB   ALA  42          3HB       ALA  42  -2.355   3.620  -1.883
  278    H    THR  43           H        THR  43   0.507   4.413  -2.776
  279    HA   THR  43           HA       THR  43   2.445   5.476  -0.847
  280    HB   THR  43           HB       THR  43   3.762   6.144  -2.800
  281    HG1  THR  43           1HG      THR  43   2.438   6.541  -4.458
  282   1HG2  THR  43          1HG2      THR  43   3.414   3.560  -3.856
  283   2HG2  THR  43          2HG2      THR  43   4.627   4.103  -2.694
  284   3HG2  THR  43          3HG2      THR  43   3.088   3.449  -2.129
  285    H    THR  44           H        THR  44  -0.490   6.125  -1.681
  286    HA   THR  44           HA       THR  44  -0.160   9.030  -1.496
  287    HB   THR  44           HB       THR  44  -2.237   9.264  -2.890
  288    HG1  THR  44           1HG      THR  44  -3.282   7.499  -3.264
  289   1HG2  THR  44          1HG2      THR  44  -1.155   8.467  -5.095
  290   2HG2  THR  44          2HG2      THR  44  -0.395   9.764  -4.171
  291   3HG2  THR  44          3HG2      THR  44   0.247   8.123  -4.081
  292    H    ALA  45           H        ALA  45  -1.869  10.073  -0.298
  293    HA   ALA  45           HA       ALA  45  -2.679   8.697   1.993
  294   1HB   ALA  45          1HB       ALA  45  -3.612  11.269   0.765
  295   2HB   ALA  45          2HB       ALA  45  -4.277  10.659   2.280
  296   3HB   ALA  45          3HB       ALA  45  -2.556  11.027   2.156
  297    H    ASN  46           H        ASN  46  -4.597   9.525  -0.898
  298    HA   ASN  46           HA       ASN  46  -6.547   7.526   0.033
  299   1HB   ASN  46          1HB       ASN  46  -7.434   9.886  -0.119
  300   2HB   ASN  46          2HB       ASN  46  -7.148   9.812  -1.857
  301   1HD2  ASN  46          1HD2      ASN  46 -10.406   8.193  -0.206
  302   2HD2  ASN  46          2HD2      ASN  46  -9.222   9.066   0.692
  303    H    TYR  47           H        TYR  47  -6.018   5.729  -0.970
  304    HA   TYR  47           HA       TYR  47  -4.743   5.641  -3.491
  305   1HB   TYR  47          1HB       TYR  47  -4.482   3.888  -1.756
  306   2HB   TYR  47          2HB       TYR  47  -6.146   3.388  -2.048
  307    HD1  TYR  47           1HD      TYR  47  -6.756   2.359  -4.236
  308    HD2  TYR  47           2HD      TYR  47  -2.731   3.270  -3.225
  309    HE1  TYR  47           1HE      TYR  47  -5.969   0.882  -6.035
  310    HE2  TYR  47           2HE      TYR  47  -1.943   1.798  -5.016
  311    HH   TYR  47           HH       TYR  47  -3.426  -0.474  -6.326
  312    H    ASP  48           H        ASP  48  -8.113   5.251  -2.506
  313    HA   ASP  48           HA       ASP  48  -9.174   4.207  -4.831
  314   1HB   ASP  48          1HB       ASP  48 -10.250   6.034  -2.728
  315   2HB   ASP  48          2HB       ASP  48 -11.214   5.693  -4.160
  316    H    ASP  49           H        ASP  49  -8.038   7.420  -4.203
  317    HA   ASP  49           HA       ASP  49  -9.212   8.534  -6.599
  318   1HB   ASP  49          1HB       ASP  49  -7.592   9.620  -4.330
  319   2HB   ASP  49          2HB       ASP  49  -7.708  10.540  -5.825
  320    H    ASP  50           H        ASP  50  -5.859   8.673  -5.425
  321    HA   ASP  50           HA       ASP  50  -4.864   9.062  -8.071
  322   1HB   ASP  50          1HB       ASP  50  -3.471   8.691  -5.425
  323   2HB   ASP  50          2HB       ASP  50  -2.616   8.994  -6.932
  324    H    ARG  51           H        ARG  51  -5.335   6.224  -6.185
  325    HA   ARG  51           HA       ARG  51  -4.706   4.072  -6.405
  326   1HB   ARG  51          1HB       ARG  51  -5.146   4.931  -9.238
  327   2HB   ARG  51          2HB       ARG  51  -4.890   3.254  -8.783
  328   1HG   ARG  51          1HG       ARG  51  -6.828   4.541  -7.117
  329   2HG   ARG  51          2HG       ARG  51  -7.300   4.588  -8.813
  330   1HD   ARG  51          1HD       ARG  51  -6.461   2.128  -7.294
  331   2HD   ARG  51          2HD       ARG  51  -8.134   2.624  -7.522
  332    HE   ARG  51           HE       ARG  51  -8.019   1.968  -9.759
  333   1HH1  ARG  51          1HH1      ARG  51  -4.892   1.630  -8.215
  334   2HH1  ARG  51          2HH1      ARG  51  -4.221   0.672  -9.494
  335   1HH2  ARG  51          1HH2      ARG  51  -7.078   0.751 -11.485
  336   2HH2  ARG  51          2HH2      ARG  51  -5.442   0.183 -11.330
  337    H    LYS  52           H        LYS  52  -2.440   5.306  -5.786
  338    HA   LYS  52           HA       LYS  52  -0.494   4.080  -7.612
  339   1HB   LYS  52          1HB       LYS  52  -0.172   6.503  -5.828
  340   2HB   LYS  52          2HB       LYS  52   1.181   5.697  -6.617
  341   1HG   LYS  52          1HG       LYS  52   0.386   6.260  -8.770
  342   2HG   LYS  52          2HG       LYS  52  -1.178   6.759  -8.145
  343   1HD   LYS  52          1HD       LYS  52  -0.027   8.611  -6.939
  344   2HD   LYS  52          2HD       LYS  52   1.470   8.137  -7.741
  345   1HE   LYS  52          1HE       LYS  52   0.384   8.470  -9.926
  346   2HE   LYS  52          2HE       LYS  52  -1.074   9.020  -9.102
  347   1HZ   LYS  52          1HZ       LYS  52   1.584  10.341  -8.812
  348   2HZ   LYS  52          2HZ       LYS  52   0.403  10.816  -9.940
  349   3HZ   LYS  52          3HZ       LYS  52   0.081  10.920  -8.275
  350    H    TRP  53           H        TRP  53   0.341   2.321  -6.866
  351    HA   TRP  53           HA       TRP  53   0.506   1.919  -3.956
  352   1HB   TRP  53          1HB       TRP  53  -0.240  -0.345  -4.324
  353   2HB   TRP  53          2HB       TRP  53  -1.387   0.767  -4.971
  354    HD1  TRP  53           HD1      TRP  53  -0.971   1.188  -7.843
  355    HE1  TRP  53           1HE      TRP  53  -0.530  -0.690  -9.556
  356    HE3  TRP  53           3HE      TRP  53   0.544  -2.334  -4.608
  357    HZ2  TRP  53           2HZ      TRP  53   0.358  -3.419  -9.481
  358    HZ3  TRP  53           3HZ      TRP  53   1.178  -4.584  -5.453
  359    HH2  TRP  53           HH2      TRP  53   1.086  -5.107  -7.841
  360    H    GLY  54           H        GLY  54   1.698   0.004  -3.361
  361   1HA   GLY  54          1HA       GLY  54   3.828  -1.004  -4.981
  362   2HA   GLY  54          2HA       GLY  54   4.399   0.156  -3.783
  363    H    PHE  55           H        PHE  55   4.662  -2.838  -4.067
  364    HA   PHE  55           HA       PHE  55   3.202  -4.196  -2.154
  365   1HB   PHE  55          1HB       PHE  55   5.983  -4.547  -3.237
  366   2HB   PHE  55          2HB       PHE  55   5.308  -5.655  -2.056
  367    HD1  PHE  55           1HD      PHE  55   2.467  -4.922  -3.629
  368    HD2  PHE  55           2HD      PHE  55   6.205  -6.728  -4.561
  369    HE1  PHE  55           1HE      PHE  55   1.386  -6.244  -5.399
  370    HE2  PHE  55           2HE      PHE  55   5.125  -8.061  -6.324
  371    HZ   PHE  55           HZ       PHE  55   2.707  -7.808  -6.751
  372    H    CYS  56           H        CYS  56   3.778  -4.905  -0.036
  373    HA   CYS  56           HA       CYS  56   4.341  -2.877   1.761
  374   1HB   CYS  56          1HB       CYS  56   3.233  -5.136   2.180
  375   2HB   CYS  56          2HB       CYS  56   4.857  -5.797   2.315
  376    HA   PRO  57           HA       PRO  57   8.734  -2.447   1.544
  377   1HB   PRO  57          1HB       PRO  57   9.210  -1.116   3.804
  378   2HB   PRO  57          2HB       PRO  57   8.382  -0.357   2.434
  379   1HG   PRO  57          1HG       PRO  57   7.209  -1.711   4.818
  380   2HG   PRO  57          2HG       PRO  57   6.835  -0.083   4.211
  381   1HD   PRO  57          1HD       PRO  57   5.252  -2.151   3.633
  382   2HD   PRO  57          2HD       PRO  57   5.642  -0.951   2.377
  383    H    ASP  58           H        ASP  58   7.243  -4.488   3.359
  384    HA   ASP  58           HA       ASP  58   9.679  -5.753   4.334
  385   1HB   ASP  58          1HB       ASP  58   8.654  -4.501   6.233
  386   2HB   ASP  58          2HB       ASP  58   7.203  -5.478   6.041
  387    H    GLN  59           H        GLN  59   9.223  -7.024   2.415
  388    HA   GLN  59           HA       GLN  59   6.889  -8.777   2.562
  389   1HB   GLN  59          1HB       GLN  59   9.039  -8.554   0.440
  390   2HB   GLN  59          2HB       GLN  59   7.602  -9.560   0.333
  391   1HG   GLN  59          1HG       GLN  59   7.467  -6.577   0.641
  392   2HG   GLN  59          2HG       GLN  59   7.567  -7.377  -0.929
  393   1HE2  GLN  59          1HE2      GLN  59   4.188  -7.982  -1.094
  394   2HE2  GLN  59          2HE2      GLN  59   5.723  -7.841  -1.872
  395    H    GLY  60           H        GLY  60  10.414  -8.923   2.464
  396   1HA   GLY  60          1HA       GLY  60  10.635 -11.076   4.248
  397   2HA   GLY  60          2HA       GLY  60  10.722 -11.704   2.608
  Start of MODEL    8
    1    H    SER   1           1H       SER   1  16.224   9.110   1.693
    2    HA   SER   1           HA       SER   1  13.541   9.290   0.585
    3   1HB   SER   1          1HB       SER   1  15.361   6.865   0.363
    4   2HB   SER   1          2HB       SER   1  13.650   6.914  -0.059
    5    HG   SER   1           HG       SER   1  15.856   7.832  -1.457
    6    H    TRP   2           H        TRP   2  12.265   7.475   1.716
    7    HA   TRP   2           HA       TRP   2  13.196   7.245   4.509
    8   1HB   TRP   2          1HB       TRP   2  10.338   7.347   3.498
    9   2HB   TRP   2          2HB       TRP   2  10.834   7.187   5.184
   10    HD1  TRP   2           HD1      TRP   2  12.889   9.430   5.568
   11    HE1  TRP   2           1HE      TRP   2  12.280  11.918   5.329
   12    HE3  TRP   2           3HE      TRP   2   8.668   8.960   2.720
   13    HZ2  TRP   2           2HZ      TRP   2  10.266  13.474   4.113
   14    HZ3  TRP   2           3HZ      TRP   2   7.458  10.998   2.069
   15    HH2  TRP   2           HH2      TRP   2   8.243  13.216   2.750
   16    H    MET   3           H        MET   3  10.336   5.563   3.751
   17    HA   MET   3           HA       MET   3  11.795   3.039   3.826
   18   1HB   MET   3          1HB       MET   3   8.821   3.615   3.962
   19   2HB   MET   3          2HB       MET   3   9.548   2.019   4.095
   20   1HG   MET   3          1HG       MET   3  10.722   2.692   6.109
   21   2HG   MET   3          2HG       MET   3  10.045   4.315   5.975
   22   1HE   MET   3          1HE       MET   3   9.991   3.380   8.387
   23   2HE   MET   3          2HE       MET   3   8.384   4.030   8.717
   24   3HE   MET   3          3HE       MET   3   8.733   2.329   9.038
   25    H    SER   4           H        SER   4  11.076   1.295   2.216
   26    HA   SER   4           HA       SER   4  10.452   2.604  -0.350
   27   1HB   SER   4          1HB       SER   4  12.404   0.343   0.128
   28   2HB   SER   4          2HB       SER   4  11.991   1.014  -1.451
   29    HG   SER   4           HG       SER   4  13.366   2.252   0.701
   30    H    THR   5           H        THR   5   9.601   1.160  -2.022
   31    HA   THR   5           HA       THR   5   7.930  -0.967  -0.879
   32    HB   THR   5           HB       THR   5   6.437  -0.314  -2.903
   33    HG1  THR   5           1HG      THR   5   7.539   2.235  -2.509
   34   1HG2  THR   5          1HG2      THR   5   6.523   1.717  -0.703
   35   2HG2  THR   5          2HG2      THR   5   5.137   1.194  -1.662
   36   3HG2  THR   5          3HG2      THR   5   5.866   0.094  -0.493
   37    H    VAL   6           H        VAL   6   7.242  -2.568  -2.401
   38    HA   VAL   6           HA       VAL   6   9.184  -3.117  -4.567
   39    HB   VAL   6           HB       VAL   6   7.668  -5.418  -3.630
   40   1HG1  VAL   6          1HG1      VAL   6   9.718  -5.320  -5.115
   41   2HG1  VAL   6          2HG1      VAL   6  10.646  -5.080  -3.634
   42   3HG1  VAL   6          3HG1      VAL   6   9.703  -6.554  -3.854
   43   1HG2  VAL   6          1HG2      VAL   6   7.979  -4.083  -1.480
   44   2HG2  VAL   6          2HG2      VAL   6   8.528  -5.758  -1.484
   45   3HG2  VAL   6          3HG2      VAL   6   9.696  -4.442  -1.649
   46    H    GLY   7           H        GLY   7   7.721  -5.154  -5.719
   47   1HA   GLY   7          1HA       GLY   7   6.112  -5.302  -7.410
   48   2HA   GLY   7          2HA       GLY   7   5.059  -5.071  -6.049
   49    H    GLY   8           H        GLY   8   3.549  -3.740  -6.489
   50   1HA   GLY   8          1HA       GLY   8   2.366  -2.051  -7.557
   51   2HA   GLY   8          2HA       GLY   8   3.467  -1.136  -6.562
   52    H    ASN   9           H        ASN   9   3.817   0.596  -7.677
   53    HA   ASN   9           HA       ASN   9   5.441   0.448 -10.029
   54   1HB   ASN   9          1HB       ASN   9   3.966   1.893 -11.434
   55   2HB   ASN   9          2HB       ASN   9   3.361   0.267 -11.198
   56   1HD2  ASN   9          1HD2      ASN   9   1.239   2.395  -8.659
   57   2HD2  ASN   9          2HD2      ASN   9   2.850   1.828  -8.397
   58    H    SER  10           H        SER  10   5.627   1.399  -7.353
   59    HA   SER  10           HA       SER  10   5.602   4.290  -7.501
   60   1HB   SER  10          1HB       SER  10   6.774   3.716  -5.143
   61   2HB   SER  10          2HB       SER  10   5.026   3.755  -5.357
   62    HG   SER  10           HG       SER  10   6.352   1.749  -4.468
   63    H    GLY  11           H        GLY  11   7.972   1.666  -7.107
   64   1HA   GLY  11          1HA       GLY  11  10.147   1.680  -8.041
   65   2HA   GLY  11          2HA       GLY  11  10.020   3.419  -8.247
   66    H    GLY  12           H        GLY  12  10.043   4.735  -6.238
   67   1HA   GLY  12          1HA       GLY  12  11.538   3.401  -4.072
   68   2HA   GLY  12          2HA       GLY  12  12.135   4.898  -4.766
   69    H    ALA  13           H        ALA  13   8.717   4.577  -4.513
   70    HA   ALA  13           HA       ALA  13   8.673   6.701  -2.529
   71   1HB   ALA  13          1HB       ALA  13   7.155   6.392  -4.667
   72   2HB   ALA  13          2HB       ALA  13   6.170   5.456  -3.541
   73   3HB   ALA  13          3HB       ALA  13   6.535   7.147  -3.196
   74    HA   PRO  14           HA       PRO  14   7.787   3.882   0.770
   75   1HB   PRO  14          1HB       PRO  14   7.272   5.671   2.707
   76   2HB   PRO  14          2HB       PRO  14   8.896   5.458   2.039
   77   1HG   PRO  14          1HG       PRO  14   6.924   7.635   1.577
   78   2HG   PRO  14          2HG       PRO  14   8.693   7.692   1.582
   79   1HD   PRO  14          1HD       PRO  14   7.016   7.572  -0.683
   80   2HD   PRO  14          2HD       PRO  14   8.775   7.355  -0.662
   81    H    CYS  15           H        CYS  15   6.044   3.341   2.336
   82    HA   CYS  15           HA       CYS  15   3.452   3.644   1.086
   83   1HB   CYS  15          1HB       CYS  15   3.820   2.412   3.799
   84   2HB   CYS  15          2HB       CYS  15   2.708   1.953   2.520
   85    H    VAL  16           H        VAL  16   1.823   5.005   1.783
   86    HA   VAL  16           HA       VAL  16   2.474   6.800   4.008
   87    HB   VAL  16           HB       VAL  16   0.340   7.010   1.873
   88   1HG1  VAL  16          1HG1      VAL  16   1.033   8.929   4.098
   89   2HG1  VAL  16          2HG1      VAL  16  -0.088   9.259   2.775
   90   3HG1  VAL  16          3HG1      VAL  16  -0.458   7.996   3.948
   91   1HG2  VAL  16          1HG2      VAL  16   2.724   7.394   1.192
   92   2HG2  VAL  16          2HG2      VAL  16   1.655   8.778   0.954
   93   3HG2  VAL  16          3HG2      VAL  16   2.763   8.744   2.325
   94    H    PHE  17           H        PHE  17   1.705   6.289   5.947
   95    HA   PHE  17           HA       PHE  17  -0.868   4.877   6.100
   96   1HB   PHE  17          1HB       PHE  17   1.576   4.704   7.853
   97   2HB   PHE  17          2HB       PHE  17   0.022   4.043   8.313
   98    HD1  PHE  17           1HD      PHE  17  -0.236   3.422   5.061
   99    HD2  PHE  17           2HD      PHE  17   2.264   2.328   8.312
  100    HE1  PHE  17           1HE      PHE  17   0.379   1.358   3.887
  101    HE2  PHE  17           2HE      PHE  17   2.896   0.257   7.160
  102    HZ   PHE  17           HZ       PHE  17   1.963  -0.256   4.918
  103    HA   PRO  18           HA       PRO  18  -2.296   4.384   7.333
  104   1HB   PRO  18          1HB       PRO  18  -4.853   5.397   7.957
  105   2HB   PRO  18          2HB       PRO  18  -3.837   4.393   8.991
  106   1HG   PRO  18          1HG       PRO  18  -4.557   7.077   9.446
  107   2HG   PRO  18          2HG       PRO  18  -3.322   6.153  10.313
  108   1HD   PRO  18          1HD       PRO  18  -3.012   8.141   8.124
  109   2HD   PRO  18          2HD       PRO  18  -1.911   7.746   9.462
  110    H    PHE  19           H        PHE  19  -3.084   3.815   5.329
  111    HA   PHE  19           HA       PHE  19  -4.085   6.070   3.715
  112   1HB   PHE  19          1HB       PHE  19  -3.444   4.896   1.725
  113   2HB   PHE  19          2HB       PHE  19  -2.069   4.915   2.806
  114    HD1  PHE  19           1HD      PHE  19  -4.584   2.837   1.176
  115    HD2  PHE  19           2HD      PHE  19  -1.213   2.887   3.760
  116    HE1  PHE  19           1HE      PHE  19  -4.316   0.429   0.843
  117    HE2  PHE  19           2HE      PHE  19  -0.939   0.455   3.443
  118    HZ   PHE  19           HZ       PHE  19  -2.484  -0.775   1.977
  119    H    THR  20           H        THR  20  -5.453   4.728   1.764
  120    HA   THR  20           HA       THR  20  -7.370   3.017   3.119
  121    HB   THR  20           HB       THR  20  -8.132   5.689   1.887
  122    HG1  THR  20           1HG      THR  20  -7.436   5.095   4.326
  123   1HG2  THR  20          1HG2      THR  20 -10.391   4.860   3.070
  124   2HG2  THR  20          2HG2      THR  20 -10.043   4.647   1.354
  125   3HG2  THR  20          3HG2      THR  20  -9.765   3.318   2.484
  126    H    PHE  21           H        PHE  21  -7.991   1.446   1.818
  127    HA   PHE  21           HA       PHE  21  -7.674   1.849  -1.098
  128   1HB   PHE  21          1HB       PHE  21  -6.147   0.112  -0.036
  129   2HB   PHE  21          2HB       PHE  21  -7.593  -0.766   0.402
  130    HD1  PHE  21           1HD      PHE  21  -5.889   0.626  -2.607
  131    HD2  PHE  21           2HD      PHE  21  -8.483  -2.357  -1.034
  132    HE1  PHE  21           1HE      PHE  21  -5.796  -0.571  -4.739
  133    HE2  PHE  21           2HE      PHE  21  -8.399  -3.550  -3.176
  134    HZ   PHE  21           HZ       PHE  21  -7.056  -2.660  -5.040
  135    H    LEU  22           H        LEU  22  -9.370   1.473  -2.287
  136    HA   LEU  22           HA       LEU  22 -11.580   1.392  -2.757
  137   1HB   LEU  22          1HB       LEU  22 -10.352  -1.195  -2.073
  138   2HB   LEU  22          2HB       LEU  22 -12.005  -1.170  -2.659
  139    HG   LEU  22           HG       LEU  22 -10.309  -1.560  -4.426
  140   1HD1  LEU  22          1HD1      LEU  22 -12.522   0.071  -4.377
  141   2HD1  LEU  22          2HD1      LEU  22 -11.301   0.946  -5.303
  142   3HD1  LEU  22          3HD1      LEU  22 -11.769  -0.686  -5.783
  143   1HD2  LEU  22          1HD2      LEU  22  -8.695   0.147  -3.386
  144   2HD2  LEU  22          2HD2      LEU  22  -8.817   0.023  -5.138
  145   3HD2  LEU  22          3HD2      LEU  22  -9.649   1.327  -4.290
  146    H    GLY  23           H        GLY  23 -11.556   2.446  -0.289
  147   1HA   GLY  23          1HA       GLY  23 -13.483   2.937   1.025
  148   2HA   GLY  23          2HA       GLY  23 -14.002   1.276   0.841
  149    H    ASN  24           H        ASN  24 -11.027   0.492   1.751
  150    HA   ASN  24           HA       ASN  24 -11.725   0.824   4.599
  151   1HB   ASN  24          1HB       ASN  24  -9.959  -1.313   3.407
  152   2HB   ASN  24          2HB       ASN  24 -10.666  -1.266   5.018
  153   1HD2  ASN  24          1HD2      ASN  24 -12.574  -3.085   2.093
  154   2HD2  ASN  24          2HD2      ASN  24 -10.904  -2.632   2.081
  155    H    LYS  25           H        LYS  25 -10.314   1.730   5.994
  156    HA   LYS  25           HA       LYS  25  -7.987   3.050   5.019
  157   1HB   LYS  25          1HB       LYS  25  -8.543   2.661   7.920
  158   2HB   LYS  25          2HB       LYS  25  -7.995   4.077   7.060
  159   1HG   LYS  25          1HG       LYS  25 -10.152   4.625   6.313
  160   2HG   LYS  25          2HG       LYS  25 -10.787   3.048   6.795
  161   1HD   LYS  25          1HD       LYS  25  -9.708   5.146   8.670
  162   2HD   LYS  25          2HD       LYS  25 -11.419   4.842   8.352
  163   1HE   LYS  25          1HE       LYS  25 -11.288   2.662   9.298
  164   2HE   LYS  25          2HE       LYS  25  -9.530   2.741   9.402
  165   1HZ   LYS  25          1HZ       LYS  25 -10.046   4.793  10.909
  166   2HZ   LYS  25          2HZ       LYS  25 -11.558   4.035  11.098
  167   3HZ   LYS  25          3HZ       LYS  25 -10.132   3.222  11.545
  168    H    TYR  26           H        TYR  26  -5.907   2.228   5.004
  169    HA   TYR  26           HA       TYR  26  -5.445  -0.142   6.662
  170   1HB   TYR  26          1HB       TYR  26  -4.128   0.562   4.049
  171   2HB   TYR  26          2HB       TYR  26  -3.790  -0.857   5.026
  172    HD1  TYR  26           1HD      TYR  26  -6.778  -1.309   5.776
  173    HD2  TYR  26           2HD      TYR  26  -4.775  -0.669   2.094
  174    HE1  TYR  26           1HE      TYR  26  -8.540  -2.528   4.602
  175    HE2  TYR  26           2HE      TYR  26  -6.536  -1.875   0.908
  176    HH   TYR  26           HH       TYR  26  -8.526  -3.913   2.154
  177    H    GLU  27           H        GLU  27  -4.417   0.375   8.295
  178    HA   GLU  27           HA       GLU  27  -2.565   2.588   8.414
  179   1HB   GLU  27          1HB       GLU  27  -3.451   0.667  10.559
  180   2HB   GLU  27          2HB       GLU  27  -2.662   2.205  10.793
  181   1HG   GLU  27          1HG       GLU  27  -4.545   3.426  10.152
  182   2HG   GLU  27          2HG       GLU  27  -5.303   2.023   9.406
  183    H    SER  28           H        SER  28  -2.463  -0.647   7.743
  184    HA   SER  28           HA       SER  28   0.429  -0.758   8.155
  185   1HB   SER  28          1HB       SER  28   0.076  -3.215   8.630
  186   2HB   SER  28          2HB       SER  28  -0.510  -2.148   9.899
  187    HG   SER  28           HG       SER  28  -2.019  -3.501   7.905
  188    H    CYS  29           H        CYS  29   0.838  -3.191   6.841
  189    HA   CYS  29           HA       CYS  29   0.241  -2.423   4.144
  190   1HB   CYS  29          1HB       CYS  29   1.522  -4.938   5.214
  191   2HB   CYS  29          2HB       CYS  29   1.391  -4.522   3.521
  192    H    THR  30           H        THR  30  -0.714  -4.115   2.653
  193    HA   THR  30           HA       THR  30  -2.800  -5.733   3.906
  194    HB   THR  30           HB       THR  30  -3.816  -3.463   3.525
  195    HG1  THR  30           1HG      THR  30  -5.266  -5.104   3.410
  196   1HG2  THR  30          1HG2      THR  30  -4.310  -3.369   0.836
  197   2HG2  THR  30          2HG2      THR  30  -3.152  -2.360   1.706
  198   3HG2  THR  30          3HG2      THR  30  -2.609  -3.830   0.897
  199    H    SER  31           H        SER  31  -4.030  -6.946   2.149
  200    HA   SER  31           HA       SER  31  -2.247  -7.542  -0.106
  201   1HB   SER  31          1HB       SER  31  -3.169  -9.925   0.100
  202   2HB   SER  31          2HB       SER  31  -2.027  -9.402   1.347
  203    HG   SER  31           HG       SER  31  -4.872  -9.514   1.546
  204    H    ALA  32           H        ALA  32  -4.613  -5.806   0.426
  205    HA   ALA  32           HA       ALA  32  -6.941  -6.741  -0.802
  206   1HB   ALA  32          1HB       ALA  32  -6.000  -4.305   0.305
  207   2HB   ALA  32          2HB       ALA  32  -6.631  -3.938  -1.302
  208   3HB   ALA  32          3HB       ALA  32  -7.657  -4.739  -0.112
  209    H    GLY  33           H        GLY  33  -7.724  -6.728  -2.847
  210   1HA   GLY  33          1HA       GLY  33  -7.752  -6.530  -5.141
  211   2HA   GLY  33          2HA       GLY  33  -6.407  -5.402  -5.016
  212    H    ARG  34           H        ARG  34  -5.438  -8.070  -3.351
  213    HA   ARG  34           HA       ARG  34  -4.102  -9.123  -5.743
  214   1HB   ARG  34          1HB       ARG  34  -3.262  -9.337  -2.850
  215   2HB   ARG  34          2HB       ARG  34  -2.376  -9.937  -4.226
  216   1HG   ARG  34          1HG       ARG  34  -2.611  -7.350  -4.926
  217   2HG   ARG  34          2HG       ARG  34  -2.593  -7.212  -3.171
  218   1HD   ARG  34          1HD       ARG  34  -0.327  -7.094  -4.175
  219   2HD   ARG  34          2HD       ARG  34  -0.516  -8.430  -3.037
  220    HE   ARG  34           HE       ARG  34  -0.148  -9.897  -4.738
  221   1HH1  ARG  34          1HH1      ARG  34  -0.875  -6.752  -6.081
  222   2HH1  ARG  34          2HH1      ARG  34  -0.602  -7.233  -7.729
  223   1HH2  ARG  34          1HH2      ARG  34   0.185 -10.551  -6.913
  224   2HH2  ARG  34          2HH2      ARG  34  -0.032  -9.406  -8.200
  225    H    SER  35           H        SER  35  -5.013 -10.328  -2.534
  226    HA   SER  35           HA       SER  35  -6.004 -12.228  -1.807
  227   1HB   SER  35          1HB       SER  35  -7.728 -11.557  -3.550
  228   2HB   SER  35          2HB       SER  35  -6.948 -12.700  -4.644
  229    HG   SER  35           HG       SER  35  -7.451 -14.365  -3.216
  230    H    ASP  36           H        ASP  36  -3.298 -12.156  -3.319
  231    HA   ASP  36           HA       ASP  36  -3.087 -15.011  -3.861
  232   1HB   ASP  36          1HB       ASP  36  -0.736 -14.258  -4.703
  233   2HB   ASP  36          2HB       ASP  36  -2.147 -14.010  -5.707
  234    H    GLY  37           H        GLY  37  -0.576 -12.857  -2.778
  235   1HA   GLY  37          1HA       GLY  37  -0.543 -13.949  -0.149
  236   2HA   GLY  37          2HA       GLY  37   0.760 -14.561  -1.141
  237    H    LYS  38           H        LYS  38   1.473 -12.286  -2.574
  238    HA   LYS  38           HA       LYS  38   3.104 -10.968  -0.735
  239   1HB   LYS  38          1HB       LYS  38   2.298 -10.148  -3.525
  240   2HB   LYS  38          2HB       LYS  38   3.652  -9.486  -2.618
  241   1HG   LYS  38          1HG       LYS  38   4.568 -11.043  -4.092
  242   2HG   LYS  38          2HG       LYS  38   4.588 -11.823  -2.525
  243   1HD   LYS  38          1HD       LYS  38   3.918 -13.419  -4.165
  244   2HD   LYS  38          2HD       LYS  38   2.502 -13.011  -3.194
  245   1HE   LYS  38          1HE       LYS  38   1.723 -11.504  -4.937
  246   2HE   LYS  38          2HE       LYS  38   3.168 -11.832  -5.892
  247   1HZ   LYS  38          1HZ       LYS  38   1.430 -14.071  -5.090
  248   2HZ   LYS  38          2HZ       LYS  38   0.972 -13.082  -6.398
  249   3HZ   LYS  38          3HZ       LYS  38   2.448 -13.923  -6.444
  250    H    MET  39           H        MET  39   2.659  -9.375   0.644
  251    HA   MET  39           HA       MET  39   0.172  -7.911   0.310
  252   1HB   MET  39          1HB       MET  39   2.160  -7.803   2.589
  253   2HB   MET  39          2HB       MET  39   0.545  -7.115   2.564
  254   1HG   MET  39          1HG       MET  39  -0.379  -9.402   2.308
  255   2HG   MET  39          2HG       MET  39   1.255 -10.033   2.512
  256   1HE   MET  39          1HE       MET  39  -1.044 -11.014   3.995
  257   2HE   MET  39          2HE       MET  39   0.341 -11.531   4.954
  258   3HE   MET  39          3HE       MET  39  -1.016 -10.722   5.736
  259    H    TRP  40           H        TRP  40   0.104  -5.623   0.305
  260    HA   TRP  40           HA       TRP  40   2.629  -4.313  -0.426
  261   1HB   TRP  40          1HB       TRP  40   1.378  -3.015  -2.143
  262   2HB   TRP  40          2HB       TRP  40   1.423  -4.741  -2.493
  263    HD1  TRP  40           HD1      TRP  40  -0.957  -6.098  -1.670
  264    HE1  TRP  40           1HE      TRP  40  -3.379  -5.259  -1.849
  265    HE3  TRP  40           3HE      TRP  40  -0.058  -1.107  -2.247
  266    HZ2  TRP  40           2HZ      TRP  40  -4.725  -2.817  -2.168
  267    HZ3  TRP  40           3HZ      TRP  40  -1.971   0.415  -2.461
  268    HH2  TRP  40           HH2      TRP  40  -4.251  -0.429  -2.432
  269    H    CYS  41           H        CYS  41   1.691  -1.792  -0.860
  270    HA   CYS  41           HA       CYS  41   0.049  -0.851   1.312
  271   1HB   CYS  41          1HB       CYS  41   1.889   0.607   2.233
  272   2HB   CYS  41          2HB       CYS  41   2.095  -1.108   2.572
  273    H    ALA  42           H        ALA  42  -0.675   1.278   0.886
  274    HA   ALA  42           HA       ALA  42  -0.258   2.164  -1.820
  275   1HB   ALA  42          1HB       ALA  42  -2.417   2.399  -0.441
  276   2HB   ALA  42          2HB       ALA  42  -1.625   3.787   0.303
  277   3HB   ALA  42          3HB       ALA  42  -1.916   3.767  -1.437
  278    H    THR  43           H        THR  43   0.698   4.124  -2.457
  279    HA   THR  43           HA       THR  43   2.706   5.078  -0.550
  280    HB   THR  43           HB       THR  43   3.980   5.780  -2.530
  281    HG1  THR  43           1HG      THR  43   2.657   6.201  -4.161
  282   1HG2  THR  43          1HG2      THR  43   3.565   3.223  -3.609
  283   2HG2  THR  43          2HG2      THR  43   4.817   3.731  -2.476
  284   3HG2  THR  43          3HG2      THR  43   3.290   3.089  -1.872
  285    H    THR  44           H        THR  44  -0.208   5.808  -1.108
  286    HA   THR  44           HA       THR  44   0.157   8.695  -0.894
  287    HB   THR  44           HB       THR  44  -1.928   8.984  -2.314
  288    HG1  THR  44           1HG      THR  44  -2.870   7.265  -3.024
  289   1HG2  THR  44          1HG2      THR  44  -0.273   7.812  -4.331
  290   2HG2  THR  44          2HG2      THR  44  -0.599   9.514  -3.997
  291   3HG2  THR  44          3HG2      THR  44   0.720   8.686  -3.165
  292    H    ALA  45           H        ALA  45  -1.614   9.719   0.254
  293    HA   ALA  45           HA       ALA  45  -2.500   8.238   2.466
  294   1HB   ALA  45          1HB       ALA  45  -3.000  10.958   1.412
  295   2HB   ALA  45          2HB       ALA  45  -4.174  10.320   2.564
  296   3HB   ALA  45          3HB       ALA  45  -2.473  10.432   3.012
  297    H    ASN  46           H        ASN  46  -4.295   9.304  -0.423
  298    HA   ASN  46           HA       ASN  46  -6.372   7.347   0.297
  299   1HB   ASN  46          1HB       ASN  46  -7.150   9.744   0.231
  300   2HB   ASN  46          2HB       ASN  46  -6.761   9.758  -1.491
  301   1HD2  ASN  46          1HD2      ASN  46 -10.173   8.179  -0.143
  302   2HD2  ASN  46          2HD2      ASN  46  -9.009   8.913   0.895
  303    H    TYR  47           H        TYR  47  -5.949   5.582  -0.788
  304    HA   TYR  47           HA       TYR  47  -4.602   5.579  -3.304
  305   1HB   TYR  47          1HB       TYR  47  -4.343   3.789  -1.594
  306   2HB   TYR  47          2HB       TYR  47  -5.998   3.289  -1.912
  307    HD1  TYR  47           1HD      TYR  47  -6.554   2.544  -4.335
  308    HD2  TYR  47           2HD      TYR  47  -2.592   2.912  -2.833
  309    HE1  TYR  47           1HE      TYR  47  -5.730   1.075  -6.127
  310    HE2  TYR  47           2HE      TYR  47  -1.773   1.447  -4.620
  311    HH   TYR  47           HH       TYR  47  -3.391  -0.554  -6.265
  312    H    ASP  48           H        ASP  48  -7.945   5.261  -2.275
  313    HA   ASP  48           HA       ASP  48  -9.171   4.189  -4.466
  314   1HB   ASP  48          1HB       ASP  48 -10.105   6.471  -2.732
  315   2HB   ASP  48          2HB       ASP  48 -11.127   5.655  -3.904
  316    H    ASP  49           H        ASP  49  -8.090   7.518  -4.077
  317    HA   ASP  49           HA       ASP  49  -9.051   8.212  -6.740
  318   1HB   ASP  49          1HB       ASP  49  -8.259   9.731  -4.319
  319   2HB   ASP  49          2HB       ASP  49  -7.962  10.507  -5.876
  320    H    ASP  50           H        ASP  50  -5.958   7.886  -5.041
  321    HA   ASP  50           HA       ASP  50  -4.550   8.914  -7.359
  322   1HB   ASP  50          1HB       ASP  50  -3.668   8.030  -4.635
  323   2HB   ASP  50          2HB       ASP  50  -2.504   8.363  -5.914
  324    H    ARG  51           H        ARG  51  -5.155   5.780  -5.928
  325    HA   ARG  51           HA       ARG  51  -4.538   3.687  -6.451
  326   1HB   ARG  51          1HB       ARG  51  -4.747   4.858  -9.197
  327   2HB   ARG  51          2HB       ARG  51  -4.806   3.140  -8.811
  328   1HG   ARG  51          1HG       ARG  51  -6.622   4.270  -7.089
  329   2HG   ARG  51          2HG       ARG  51  -6.867   5.150  -8.602
  330   1HD   ARG  51          1HD       ARG  51  -6.675   2.174  -8.522
  331   2HD   ARG  51          2HD       ARG  51  -8.191   3.005  -8.181
  332    HE   ARG  51           HE       ARG  51  -8.368   3.586 -10.420
  333   1HH1  ARG  51          1HH1      ARG  51  -5.318   1.958  -9.858
  334   2HH1  ARG  51          2HH1      ARG  51  -4.928   1.830 -11.543
  335   1HH2  ARG  51          1HH2      ARG  51  -7.878   3.399 -12.623
  336   2HH2  ARG  51          2HH2      ARG  51  -6.372   2.680 -13.109
  337    H    LYS  52           H        LYS  52  -2.290   4.929  -5.652
  338    HA   LYS  52           HA       LYS  52  -0.267   3.824  -7.468
  339   1HB   LYS  52          1HB       LYS  52  -0.097   6.234  -5.657
  340   2HB   LYS  52          2HB       LYS  52   1.333   5.464  -6.344
  341   1HG   LYS  52          1HG       LYS  52   0.899   6.223  -8.453
  342   2HG   LYS  52          2HG       LYS  52  -0.850   6.191  -8.223
  343   1HD   LYS  52          1HD       LYS  52  -0.241   8.461  -8.411
  344   2HD   LYS  52          2HD       LYS  52  -0.542   8.176  -6.696
  345   1HE   LYS  52          1HE       LYS  52   1.833   8.014  -6.270
  346   2HE   LYS  52          2HE       LYS  52   2.186   8.162  -7.991
  347   1HZ   LYS  52          1HZ       LYS  52   0.582  10.322  -6.961
  348   2HZ   LYS  52          2HZ       LYS  52   2.097  10.210  -6.206
  349   3HZ   LYS  52          3HZ       LYS  52   2.001  10.370  -7.900
  350    H    TRP  53           H        TRP  53   0.579   2.028  -6.713
  351    HA   TRP  53           HA       TRP  53   0.734   1.671  -3.799
  352   1HB   TRP  53          1HB       TRP  53  -0.090  -0.572  -4.059
  353   2HB   TRP  53          2HB       TRP  53  -1.204   0.529  -4.765
  354    HD1  TRP  53           HD1      TRP  53  -0.820   0.742  -7.673
  355    HE1  TRP  53           1HE      TRP  53  -0.467  -1.266  -9.258
  356    HE3  TRP  53           3HE      TRP  53   0.674  -2.597  -4.238
  357    HZ2  TRP  53           2HZ      TRP  53   0.353  -3.992  -9.022
  358    HZ3  TRP  53           3HZ      TRP  53   1.242  -4.920  -4.944
  359    HH2  TRP  53           HH2      TRP  53   1.082  -5.586  -7.288
  360    H    GLY  54           H        GLY  54   1.901  -0.336  -3.241
  361   1HA   GLY  54          1HA       GLY  54   3.995  -1.339  -4.901
  362   2HA   GLY  54          2HA       GLY  54   4.602  -0.185  -3.712
  363    H    PHE  55           H        PHE  55   4.971  -3.158  -3.914
  364    HA   PHE  55           HA       PHE  55   3.459  -4.471  -1.966
  365   1HB   PHE  55          1HB       PHE  55   6.209  -4.968  -3.081
  366   2HB   PHE  55          2HB       PHE  55   5.510  -6.003  -1.852
  367    HD1  PHE  55           1HD      PHE  55   2.647  -5.478  -3.198
  368    HD2  PHE  55           2HD      PHE  55   6.401  -6.963  -4.529
  369    HE1  PHE  55           1HE      PHE  55   1.496  -6.851  -4.880
  370    HE2  PHE  55           2HE      PHE  55   5.256  -8.338  -6.224
  371    HZ   PHE  55           HZ       PHE  55   2.802  -8.272  -6.409
  372    H    CYS  56           H        CYS  56   4.058  -5.187   0.126
  373    HA   CYS  56           HA       CYS  56   4.903  -3.135   1.875
  374   1HB   CYS  56          1HB       CYS  56   3.342  -5.122   2.344
  375   2HB   CYS  56          2HB       CYS  56   4.793  -6.098   2.511
  376    HA   PRO  57           HA       PRO  57   9.285  -3.565   1.749
  377   1HB   PRO  57          1HB       PRO  57  10.003  -2.710   4.190
  378   2HB   PRO  57          2HB       PRO  57   9.394  -1.617   2.934
  379   1HG   PRO  57          1HG       PRO  57   7.888  -2.993   5.109
  380   2HG   PRO  57          2HG       PRO  57   7.892  -1.258   4.736
  381   1HD   PRO  57          1HD       PRO  57   5.911  -2.788   3.867
  382   2HD   PRO  57          2HD       PRO  57   6.640  -1.596   2.764
  383    H    ASP  58           H        ASP  58   7.461  -5.556   3.357
  384    HA   ASP  58           HA       ASP  58   9.720  -7.218   4.257
  385   1HB   ASP  58          1HB       ASP  58   8.311  -6.416   6.159
  386   2HB   ASP  58          2HB       ASP  58   6.934  -7.247   5.443
  387    H    GLN  59           H        GLN  59   9.953  -8.468   2.450
  388    HA   GLN  59           HA       GLN  59   7.566  -9.818   1.406
  389   1HB   GLN  59          1HB       GLN  59  10.348  -9.538   0.266
  390   2HB   GLN  59          2HB       GLN  59   9.065 -10.480  -0.484
  391   1HG   GLN  59          1HG       GLN  59   8.880  -7.536   0.112
  392   2HG   GLN  59          2HG       GLN  59   9.353  -8.213  -1.447
  393   1HE2  GLN  59          1HE2      GLN  59   5.505  -7.718  -0.609
  394   2HE2  GLN  59          2HE2      GLN  59   6.812  -7.001   0.269
  395    H    GLY  60           H        GLY  60   8.233 -10.727   3.849
  396   1HA   GLY  60          1HA       GLY  60   9.522 -13.313   3.244
  397   2HA   GLY  60          2HA       GLY  60   9.694 -12.499   4.794
  Start of MODEL    9
    1    H    SER   1           1H       SER   1  17.962   4.662   6.856
    2    HA   SER   1           HA       SER   1  17.303   5.590   4.691
    3   1HB   SER   1          1HB       SER   1  18.738   3.100   3.723
    4   2HB   SER   1          2HB       SER   1  17.774   4.193   2.725
    5    HG   SER   1           HG       SER   1  19.287   5.787   3.001
    6    H    TRP   2           H        TRP   2  15.246   5.004   4.160
    7    HA   TRP   2           HA       TRP   2  14.194   2.655   5.561
    8   1HB   TRP   2          1HB       TRP   2  12.797   5.040   4.323
    9   2HB   TRP   2          2HB       TRP   2  11.980   3.717   5.151
   10    HD1  TRP   2           HD1      TRP   2  12.759   3.416   7.847
   11    HE1  TRP   2           1HE      TRP   2  13.228   5.264   9.574
   12    HE3  TRP   2           3HE      TRP   2  13.563   7.330   4.648
   13    HZ2  TRP   2           2HZ      TRP   2  13.855   8.017   9.579
   14    HZ3  TRP   2           3HZ      TRP   2  14.098   9.536   5.600
   15    HH2  TRP   2           HH2      TRP   2  14.240   9.870   8.015
   16    H    MET   3           H        MET   3  13.643   0.870   4.471
   17    HA   MET   3           HA       MET   3  14.030   0.659   1.696
   18   1HB   MET   3          1HB       MET   3  14.450  -1.299   2.819
   19   2HB   MET   3          2HB       MET   3  13.134  -1.060   3.957
   20   1HG   MET   3          1HG       MET   3  12.530  -2.876   2.707
   21   2HG   MET   3          2HG       MET   3  11.585  -1.548   2.052
   22   1HE   MET   3          1HE       MET   3  11.103  -3.381   0.501
   23   2HE   MET   3          2HE       MET   3  11.732  -3.181  -1.133
   24   3HE   MET   3          3HE       MET   3  12.371  -4.456  -0.095
   25    H    SER   4           H        SER   4  12.693   1.436   0.208
   26    HA   SER   4           HA       SER   4   9.966   2.097   0.842
   27   1HB   SER   4          1HB       SER   4  11.411   2.325  -1.808
   28   2HB   SER   4          2HB       SER   4   9.906   3.128  -1.350
   29    HG   SER   4           HG       SER   4  12.102   4.263  -1.138
   30    H    THR   5           H        THR   5   8.766   1.714  -1.639
   31    HA   THR   5           HA       THR   5   7.783  -0.915  -1.328
   32    HB   THR   5           HB       THR   5   6.546  -0.347  -3.479
   33    HG1  THR   5           1HG      THR   5   7.435   2.282  -3.070
   34   1HG2  THR   5          1HG2      THR   5   5.491   1.807  -2.277
   35   2HG2  THR   5          2HG2      THR   5   5.129   0.145  -1.808
   36   3HG2  THR   5          3HG2      THR   5   6.334   1.070  -0.914
   37    H    VAL   6           H        VAL   6   7.523  -2.379  -3.291
   38    HA   VAL   6           HA       VAL   6  10.018  -2.624  -4.739
   39    HB   VAL   6           HB       VAL   6  10.385  -4.435  -3.485
   40   1HG1  VAL   6          1HG1      VAL   6   7.948  -3.766  -2.366
   41   2HG1  VAL   6          2HG1      VAL   6   7.828  -5.477  -2.775
   42   3HG1  VAL   6          3HG1      VAL   6   9.136  -4.909  -1.738
   43   1HG2  VAL   6          1HG2      VAL   6   8.191  -5.573  -5.168
   44   2HG2  VAL   6          2HG2      VAL   6   9.905  -5.507  -5.579
   45   3HG2  VAL   6          3HG2      VAL   6   9.354  -6.525  -4.247
   46    H    GLY   7           H        GLY   7   6.878  -3.580  -4.507
   47   1HA   GLY   7          1HA       GLY   7   6.464  -4.195  -7.284
   48   2HA   GLY   7          2HA       GLY   7   5.263  -4.290  -6.028
   49    H    GLY   8           H        GLY   8   3.858  -3.292  -7.670
   50   1HA   GLY   8          1HA       GLY   8   2.580  -1.433  -8.146
   51   2HA   GLY   8          2HA       GLY   8   3.640  -0.491  -7.125
   52    H    ASN   9           H        ASN   9   3.396   1.202  -8.646
   53    HA   ASN   9           HA       ASN   9   4.977   0.838 -11.116
   54   1HB   ASN   9          1HB       ASN   9   3.768   3.019 -11.793
   55   2HB   ASN   9          2HB       ASN   9   2.854   1.538 -11.874
   56   1HD2  ASN   9          1HD2      ASN   9   0.802   2.408  -9.114
   57   2HD2  ASN   9          2HD2      ASN   9   1.689   1.094  -9.790
   58    H    SER  10           H        SER  10   4.380   2.631  -8.239
   59    HA   SER  10           HA       SER  10   5.806   4.957  -8.566
   60   1HB   SER  10          1HB       SER  10   5.830   3.369  -6.004
   61   2HB   SER  10          2HB       SER  10   5.776   5.125  -6.210
   62    HG   SER  10           HG       SER  10   3.695   4.576  -5.805
   63    H    GLY  11           H        GLY  11   7.068   1.816  -7.451
   64   1HA   GLY  11          1HA       GLY  11   9.199   0.970  -7.900
   65   2HA   GLY  11          2HA       GLY  11   9.667   2.549  -8.510
   66    H    GLY  12           H        GLY  12  10.354   4.170  -7.015
   67   1HA   GLY  12          1HA       GLY  12  11.344   2.986  -4.499
   68   2HA   GLY  12          2HA       GLY  12  12.113   4.311  -5.355
   69    H    ALA  13           H        ALA  13   8.706   3.877  -4.464
   70    HA   ALA  13           HA       ALA  13   8.936   6.375  -2.917
   71   1HB   ALA  13          1HB       ALA  13   7.293   5.912  -5.052
   72   2HB   ALA  13          2HB       ALA  13   6.230   5.584  -3.683
   73   3HB   ALA  13          3HB       ALA  13   7.040   7.145  -3.817
   74    HA   PRO  14           HA       PRO  14   7.722   4.038   0.624
   75   1HB   PRO  14          1HB       PRO  14   6.860   6.408   1.989
   76   2HB   PRO  14          2HB       PRO  14   8.386   5.545   2.166
   77   1HG   PRO  14          1HG       PRO  14   8.106   8.076   1.081
   78   2HG   PRO  14          2HG       PRO  14   9.499   7.008   0.834
   79   1HD   PRO  14          1HD       PRO  14   7.200   7.581  -0.979
   80   2HD   PRO  14          2HD       PRO  14   8.894   7.222  -1.368
   81    H    CYS  15           H        CYS  15   5.877   3.382   1.813
   82    HA   CYS  15           HA       CYS  15   3.388   3.784   0.421
   83   1HB   CYS  15          1HB       CYS  15   3.489   2.471   3.109
   84   2HB   CYS  15          2HB       CYS  15   2.550   2.034   1.688
   85    H    VAL  16           H        VAL  16   1.583   4.951   1.154
   86    HA   VAL  16           HA       VAL  16   2.151   6.748   3.419
   87    HB   VAL  16           HB       VAL  16   0.191   7.206   1.164
   88   1HG1  VAL  16          1HG1      VAL  16   0.988   8.818   3.564
   89   2HG1  VAL  16          2HG1      VAL  16   0.402   9.608   2.098
   90   3HG1  VAL  16          3HG1      VAL  16  -0.624   8.455   2.949
   91   1HG2  VAL  16          1HG2      VAL  16   2.996   7.479   1.194
   92   2HG2  VAL  16          2HG2      VAL  16   1.859   8.001  -0.052
   93   3HG2  VAL  16          3HG2      VAL  16   2.312   9.103   1.248
   94    H    PHE  17           H        PHE  17   1.348   5.488   5.103
   95    HA   PHE  17           HA       PHE  17  -1.434   4.685   4.919
   96   1HB   PHE  17          1HB       PHE  17   0.259   4.201   7.339
   97   2HB   PHE  17          2HB       PHE  17  -1.156   3.340   6.790
   98    HD1  PHE  17           1HD      PHE  17  -0.985   1.836   4.812
   99    HD2  PHE  17           2HD      PHE  17   2.373   3.523   6.771
  100    HE1  PHE  17           1HE      PHE  17   0.439   0.080   3.851
  101    HE2  PHE  17           2HE      PHE  17   3.826   1.777   5.813
  102    HZ   PHE  17           HZ       PHE  17   2.864   0.025   4.339
  103    HA   PRO  18           HA       PRO  18  -2.912   4.125   6.115
  104   1HB   PRO  18          1HB       PRO  18  -5.478   5.274   6.432
  105   2HB   PRO  18          2HB       PRO  18  -4.655   4.177   7.540
  106   1HG   PRO  18          1HG       PRO  18  -5.267   6.868   8.047
  107   2HG   PRO  18          2HG       PRO  18  -4.139   5.863   8.973
  108   1HD   PRO  18          1HD       PRO  18  -3.587   7.900   6.866
  109   2HD   PRO  18          2HD       PRO  18  -2.625   7.446   8.290
  110    H    PHE  19           H        PHE  19  -3.290   3.621   3.984
  111    HA   PHE  19           HA       PHE  19  -4.022   5.869   2.240
  112   1HB   PHE  19          1HB       PHE  19  -3.969   4.080   0.384
  113   2HB   PHE  19          2HB       PHE  19  -2.450   4.648   1.042
  114    HD1  PHE  19           1HD      PHE  19  -1.288   3.143   2.769
  115    HD2  PHE  19           2HD      PHE  19  -4.489   1.869   0.279
  116    HE1  PHE  19           1HE      PHE  19  -0.593   0.802   3.058
  117    HE2  PHE  19           2HE      PHE  19  -3.786  -0.470   0.555
  118    HZ   PHE  19           HZ       PHE  19  -1.836  -1.009   1.954
  119    H    THR  20           H        THR  20  -5.661   4.412   0.364
  120    HA   THR  20           HA       THR  20  -7.743   3.425   2.129
  121    HB   THR  20           HB       THR  20  -8.363   5.753   0.307
  122    HG1  THR  20           1HG      THR  20  -7.178   5.733   2.756
  123   1HG2  THR  20          1HG2      THR  20  -9.964   5.025   2.702
  124   2HG2  THR  20          2HG2      THR  20 -10.449   5.835   1.213
  125   3HG2  THR  20          3HG2      THR  20 -10.172   4.095   1.212
  126    H    PHE  21           H        PHE  21  -8.667   1.848   1.469
  127    HA   PHE  21           HA       PHE  21  -9.246   1.519  -1.274
  128   1HB   PHE  21          1HB       PHE  21  -8.076  -0.414   0.362
  129   2HB   PHE  21          2HB       PHE  21  -9.521  -1.061  -0.297
  130    HD1  PHE  21           1HD      PHE  21  -7.359  -2.482  -0.786
  131    HD2  PHE  21           2HD      PHE  21  -8.492   1.097  -2.748
  132    HE1  PHE  21           1HE      PHE  21  -6.428  -3.362  -2.855
  133    HE2  PHE  21           2HE      PHE  21  -7.632   0.194  -4.853
  134    HZ   PHE  21           HZ       PHE  21  -6.552  -2.013  -4.920
  135    H    LEU  22           H        LEU  22 -10.710  -0.586  -1.245
  136    HA   LEU  22           HA       LEU  22 -13.124   0.354  -1.812
  137   1HB   LEU  22          1HB       LEU  22 -12.737  -2.500  -1.104
  138   2HB   LEU  22          2HB       LEU  22 -13.593  -1.821  -2.464
  139    HG   LEU  22           HG       LEU  22 -11.720  -2.730  -3.507
  140   1HD1  LEU  22          1HD1      LEU  22 -11.143   0.075  -2.918
  141   2HD1  LEU  22          2HD1      LEU  22  -9.928  -0.919  -3.726
  142   3HD1  LEU  22          3HD1      LEU  22 -11.529  -0.714  -4.444
  143   1HD2  LEU  22          1HD2      LEU  22 -10.586  -2.453  -0.881
  144   2HD2  LEU  22          2HD2      LEU  22 -10.422  -3.739  -2.077
  145   3HD2  LEU  22          3HD2      LEU  22  -9.442  -2.279  -2.216
  146    H    GLY  23           H        GLY  23 -12.818   1.304   0.634
  147   1HA   GLY  23          1HA       GLY  23 -14.801   1.700   2.033
  148   2HA   GLY  23          2HA       GLY  23 -14.943  -0.044   2.177
  149    H    ASN  24           H        ASN  24 -11.646   0.639   2.336
  150    HA   ASN  24           HA       ASN  24 -11.791   1.082   5.225
  151   1HB   ASN  24          1HB       ASN  24  -9.936  -0.948   4.066
  152   2HB   ASN  24          2HB       ASN  24 -10.510  -0.808   5.698
  153   1HD2  ASN  24          1HD2      ASN  24 -12.360  -3.166   3.066
  154   2HD2  ASN  24          2HD2      ASN  24 -10.866  -2.359   2.759
  155    H    LYS  25           H        LYS  25 -10.185   2.318   6.065
  156    HA   LYS  25           HA       LYS  25  -8.259   3.471   4.273
  157   1HB   LYS  25          1HB       LYS  25  -7.653   4.212   6.872
  158   2HB   LYS  25          2HB       LYS  25  -8.578   5.154   5.732
  159   1HG   LYS  25          1HG       LYS  25  -9.904   5.164   7.619
  160   2HG   LYS  25          2HG       LYS  25 -10.596   3.844   6.678
  161   1HD   LYS  25          1HD       LYS  25  -9.475   2.210   8.022
  162   2HD   LYS  25          2HD       LYS  25  -8.530   3.453   8.838
  163   1HE   LYS  25          1HE       LYS  25 -10.365   2.642  10.241
  164   2HE   LYS  25          2HE       LYS  25 -10.538   4.355   9.855
  165   1HZ   LYS  25          1HZ       LYS  25 -11.880   2.924   7.876
  166   2HZ   LYS  25          2HZ       LYS  25 -12.348   2.252   9.367
  167   3HZ   LYS  25          3HZ       LYS  25 -12.553   3.911   9.082
  168    H    TYR  26           H        TYR  26  -6.297   2.503   3.969
  169    HA   TYR  26           HA       TYR  26  -5.712   0.279   5.727
  170   1HB   TYR  26          1HB       TYR  26  -4.697   1.025   3.003
  171   2HB   TYR  26          2HB       TYR  26  -4.091  -0.352   3.924
  172    HD1  TYR  26           1HD      TYR  26  -7.047  -0.657   5.158
  173    HD2  TYR  26           2HD      TYR  26  -5.467  -0.638   1.208
  174    HE1  TYR  26           1HE      TYR  26  -8.853  -2.091   4.450
  175    HE2  TYR  26           2HE      TYR  26  -7.282  -2.072   0.508
  176    HH   TYR  26           HH       TYR  26  -9.199  -3.819   2.527
  177    H    GLU  27           H        GLU  27  -4.832   0.909   7.436
  178    HA   GLU  27           HA       GLU  27  -2.791   2.906   7.671
  179   1HB   GLU  27          1HB       GLU  27  -3.704   0.902   9.720
  180   2HB   GLU  27          2HB       GLU  27  -2.974   2.461  10.003
  181   1HG   GLU  27          1HG       GLU  27  -4.907   3.625   9.415
  182   2HG   GLU  27          2HG       GLU  27  -5.601   2.219   8.605
  183    H    SER  28           H        SER  28  -2.773  -0.370   6.917
  184    HA   SER  28           HA       SER  28   0.112  -0.492   7.282
  185   1HB   SER  28          1HB       SER  28  -0.274  -2.946   7.890
  186   2HB   SER  28          2HB       SER  28  -0.647  -1.768   9.139
  187    HG   SER  28           HG       SER  28  -2.666  -2.363   9.062
  188    H    CYS  29           H        CYS  29   0.750  -2.745   6.005
  189    HA   CYS  29           HA       CYS  29  -0.041  -2.239   3.345
  190   1HB   CYS  29          1HB       CYS  29   1.286  -4.690   4.490
  191   2HB   CYS  29          2HB       CYS  29   1.099  -4.359   2.786
  192    H    THR  30           H        THR  30  -1.070  -3.888   1.948
  193    HA   THR  30           HA       THR  30  -3.041  -5.589   3.287
  194    HB   THR  30           HB       THR  30  -4.203  -3.391   2.922
  195    HG1  THR  30           1HG      THR  30  -5.607  -5.015   2.758
  196   1HG2  THR  30          1HG2      THR  30  -4.744  -2.985   0.431
  197   2HG2  THR  30          2HG2      THR  30  -3.241  -2.358   1.107
  198   3HG2  THR  30          3HG2      THR  30  -3.228  -3.835   0.141
  199    H    SER  31           H        SER  31  -4.266  -6.856   1.580
  200    HA   SER  31           HA       SER  31  -2.542  -7.414  -0.738
  201   1HB   SER  31          1HB       SER  31  -3.218  -9.815  -0.525
  202   2HB   SER  31          2HB       SER  31  -2.268  -9.240   0.853
  203    HG   SER  31           HG       SER  31  -4.074  -9.201   2.104
  204    H    ALA  32           H        ALA  32  -5.014  -5.837   0.013
  205    HA   ALA  32           HA       ALA  32  -7.299  -6.877  -1.267
  206   1HB   ALA  32          1HB       ALA  32  -6.388  -4.194  -0.335
  207   2HB   ALA  32          2HB       ALA  32  -7.750  -4.258  -1.452
  208   3HB   ALA  32          3HB       ALA  32  -7.842  -5.098   0.096
  209    H    GLY  33           H        GLY  33  -8.182  -6.457  -3.300
  210   1HA   GLY  33          1HA       GLY  33  -8.205  -5.872  -5.533
  211   2HA   GLY  33          2HA       GLY  33  -6.814  -4.841  -5.235
  212    H    ARG  34           H        ARG  34  -5.879  -7.690  -4.002
  213    HA   ARG  34           HA       ARG  34  -4.674  -8.549  -6.536
  214   1HB   ARG  34          1HB       ARG  34  -3.657  -8.975  -3.727
  215   2HB   ARG  34          2HB       ARG  34  -2.842  -9.411  -5.214
  216   1HG   ARG  34          1HG       ARG  34  -3.083  -6.839  -5.705
  217   2HG   ARG  34          2HG       ARG  34  -3.176  -6.759  -3.947
  218   1HD   ARG  34          1HD       ARG  34  -0.866  -6.514  -4.783
  219   2HD   ARG  34          2HD       ARG  34  -1.058  -7.931  -3.743
  220    HE   ARG  34           HE       ARG  34  -0.579  -9.281  -5.531
  221   1HH1  ARG  34          1HH1      ARG  34  -1.264  -6.037  -6.653
  222   2HH1  ARG  34          2HH1      ARG  34  -0.846  -6.372  -8.305
  223   1HH2  ARG  34          1HH2      ARG  34  -0.041  -9.744  -7.705
  224   2HH2  ARG  34          2HH2      ARG  34  -0.127  -8.489  -8.898
  225    H    SER  35           H        SER  35  -5.349  -9.941  -3.349
  226    HA   SER  35           HA       SER  35  -6.319 -11.864  -2.650
  227   1HB   SER  35          1HB       SER  35  -7.378 -12.049  -5.480
  228   2HB   SER  35          2HB       SER  35  -7.892 -13.064  -4.133
  229    HG   SER  35           HG       SER  35  -9.105 -11.500  -3.424
  230    H    ASP  36           H        ASP  36  -3.683 -11.697  -4.303
  231    HA   ASP  36           HA       ASP  36  -3.424 -14.515  -4.995
  232   1HB   ASP  36          1HB       ASP  36  -1.022 -13.662  -5.638
  233   2HB   ASP  36          2HB       ASP  36  -2.383 -13.392  -6.704
  234    H    GLY  37           H        GLY  37  -0.974 -12.448  -3.648
  235   1HA   GLY  37          1HA       GLY  37  -0.983 -13.640  -1.083
  236   2HA   GLY  37          2HA       GLY  37   0.277 -14.330  -2.085
  237    H    LYS  38           H        LYS  38   0.817 -11.875  -3.537
  238    HA   LYS  38           HA       LYS  38   2.709 -10.726  -1.776
  239   1HB   LYS  38          1HB       LYS  38   1.740  -9.578  -4.390
  240   2HB   LYS  38          2HB       LYS  38   3.302  -9.341  -3.625
  241   1HG   LYS  38          1HG       LYS  38   3.804 -10.828  -5.278
  242   2HG   LYS  38          2HG       LYS  38   3.567 -11.896  -3.917
  243   1HD   LYS  38          1HD       LYS  38   1.374 -12.493  -4.701
  244   2HD   LYS  38          2HD       LYS  38   1.464 -11.274  -5.979
  245   1HE   LYS  38          1HE       LYS  38   3.306 -12.478  -7.015
  246   2HE   LYS  38          2HE       LYS  38   3.296 -13.663  -5.707
  247   1HZ   LYS  38          1HZ       LYS  38   1.034 -13.181  -7.582
  248   2HZ   LYS  38          2HZ       LYS  38   2.151 -14.460  -7.707
  249   3HZ   LYS  38          3HZ       LYS  38   1.104 -14.378  -6.370
  250    H    MET  39           H        MET  39   2.333  -9.211  -0.266
  251    HA   MET  39           HA       MET  39  -0.118  -7.661  -0.423
  252   1HB   MET  39          1HB       MET  39   1.961  -7.762   1.773
  253   2HB   MET  39          2HB       MET  39   0.384  -7.003   1.860
  254   1HG   MET  39          1HG       MET  39  -0.703  -9.155   1.629
  255   2HG   MET  39          2HG       MET  39   0.868  -9.946   1.511
  256   1HE   MET  39          1HE       MET  39  -1.251 -10.907   3.279
  257   2HE   MET  39          2HE       MET  39   0.259 -11.626   3.844
  258   3HE   MET  39          3HE       MET  39  -0.835 -10.855   4.991
  259    H    TRP  40           H        TRP  40  -0.161  -5.445  -0.579
  260    HA   TRP  40           HA       TRP  40   2.400  -4.138  -1.261
  261   1HB   TRP  40          1HB       TRP  40   1.052  -2.725  -2.826
  262   2HB   TRP  40          2HB       TRP  40   1.066  -4.430  -3.285
  263    HD1  TRP  40           HD1      TRP  40  -1.246  -5.843  -2.439
  264    HE1  TRP  40           1HE      TRP  40  -3.663  -5.028  -2.276
  265    HE3  TRP  40           3HE      TRP  40  -0.433  -0.795  -2.563
  266    HZ2  TRP  40           2HZ      TRP  40  -5.037  -2.619  -2.161
  267    HZ3  TRP  40           3HZ      TRP  40  -2.392   0.707  -2.383
  268    HH2  TRP  40           HH2      TRP  40  -4.679  -0.211  -2.174
  269    H    CYS  41           H        CYS  41   1.629  -1.630  -1.510
  270    HA   CYS  41           HA       CYS  41  -0.035  -0.670   0.618
  271   1HB   CYS  41          1HB       CYS  41   1.824   0.713   1.622
  272   2HB   CYS  41          2HB       CYS  41   1.938  -1.010   1.970
  273    H    ALA  42           H        ALA  42  -0.843   1.314   0.008
  274    HA   ALA  42           HA       ALA  42  -0.176   2.223  -2.619
  275   1HB   ALA  42          1HB       ALA  42  -2.428   2.420  -1.237
  276   2HB   ALA  42          2HB       ALA  42  -1.734   3.986  -0.815
  277   3HB   ALA  42          3HB       ALA  42  -2.000   3.569  -2.508
  278    H    THR  43           H        THR  43   0.740   4.188  -3.219
  279    HA   THR  43           HA       THR  43   2.602   5.227  -1.217
  280    HB   THR  43           HB       THR  43   3.912   6.002  -3.163
  281    HG1  THR  43           1HG      THR  43   2.716   6.293  -4.900
  282   1HG2  THR  43          1HG2      THR  43   4.140   3.648  -4.259
  283   2HG2  THR  43          2HG2      THR  43   4.629   3.898  -2.582
  284   3HG2  THR  43          3HG2      THR  43   3.072   3.155  -2.945
  285    H    THR  44           H        THR  44  -0.310   5.878  -1.887
  286    HA   THR  44           HA       THR  44  -0.018   8.778  -1.663
  287    HB   THR  44           HB       THR  44  -2.146   8.986  -3.043
  288    HG1  THR  44           1HG      THR  44  -3.036   7.200  -3.631
  289   1HG2  THR  44          1HG2      THR  44   0.113   7.857  -4.660
  290   2HG2  THR  44          2HG2      THR  44  -1.098   9.042  -5.150
  291   3HG2  THR  44          3HG2      THR  44   0.132   9.477  -3.964
  292    H    ALA  45           H        ALA  45  -1.620   9.752  -0.373
  293    HA   ALA  45           HA       ALA  45  -2.535   8.283   1.812
  294   1HB   ALA  45          1HB       ALA  45  -2.251  10.730   1.813
  295   2HB   ALA  45          2HB       ALA  45  -3.689  10.875   0.801
  296   3HB   ALA  45          3HB       ALA  45  -3.825  10.228   2.434
  297    H    ASN  46           H        ASN  46  -4.145   9.063  -1.214
  298    HA   ASN  46           HA       ASN  46  -6.332   7.267  -0.425
  299   1HB   ASN  46          1HB       ASN  46  -7.053   9.682  -0.761
  300   2HB   ASN  46          2HB       ASN  46  -6.577   9.510  -2.451
  301   1HD2  ASN  46          1HD2      ASN  46 -10.162   8.351  -1.252
  302   2HD2  ASN  46          2HD2      ASN  46  -9.075   9.313  -0.318
  303    H    TYR  47           H        TYR  47  -6.168   5.442  -1.495
  304    HA   TYR  47           HA       TYR  47  -4.547   5.314  -3.882
  305   1HB   TYR  47          1HB       TYR  47  -4.294   3.596  -2.109
  306   2HB   TYR  47          2HB       TYR  47  -5.936   3.044  -2.451
  307    HD1  TYR  47           1HD      TYR  47  -2.710   3.695  -4.220
  308    HD2  TYR  47           2HD      TYR  47  -6.231   1.346  -3.953
  309    HE1  TYR  47           1HE      TYR  47  -1.881   2.267  -6.040
  310    HE2  TYR  47           2HE      TYR  47  -5.414  -0.090  -5.765
  311    HH   TYR  47           HH       TYR  47  -2.888  -0.650  -6.695
  312    H    ASP  48           H        ASP  48  -7.920   4.642  -2.967
  313    HA   ASP  48           HA       ASP  48  -8.982   3.571  -5.212
  314   1HB   ASP  48          1HB       ASP  48 -10.075   5.674  -3.372
  315   2HB   ASP  48          2HB       ASP  48 -11.034   5.064  -4.716
  316    H    ASP  49           H        ASP  49  -8.092   6.984  -4.847
  317    HA   ASP  49           HA       ASP  49  -9.122   7.614  -7.486
  318   1HB   ASP  49          1HB       ASP  49  -7.930   9.276  -5.279
  319   2HB   ASP  49          2HB       ASP  49  -8.269   9.942  -6.872
  320    H    ASP  50           H        ASP  50  -6.008   8.403  -5.929
  321    HA   ASP  50           HA       ASP  50  -4.668   8.908  -8.337
  322   1HB   ASP  50          1HB       ASP  50  -3.563   8.251  -5.609
  323   2HB   ASP  50          2HB       ASP  50  -2.586   8.813  -6.959
  324    H    ARG  51           H        ARG  51  -5.187   5.928  -6.668
  325    HA   ARG  51           HA       ARG  51  -4.428   3.830  -6.916
  326   1HB   ARG  51          1HB       ARG  51  -4.785   4.629  -9.776
  327   2HB   ARG  51          2HB       ARG  51  -4.745   2.973  -9.172
  328   1HG   ARG  51          1HG       ARG  51  -6.545   4.198  -7.517
  329   2HG   ARG  51          2HG       ARG  51  -6.891   4.928  -9.090
  330   1HD   ARG  51          1HD       ARG  51  -6.664   1.976  -8.586
  331   2HD   ARG  51          2HD       ARG  51  -8.184   2.867  -8.541
  332    HE   ARG  51           HE       ARG  51  -6.826   1.946 -10.862
  333   1HH1  ARG  51          1HH1      ARG  51  -8.759   4.595  -9.652
  334   2HH1  ARG  51          2HH1      ARG  51  -9.319   5.092 -11.218
  335   1HH2  ARG  51          1HH2      ARG  51  -7.575   2.565 -12.941
  336   2HH2  ARG  51          2HH2      ARG  51  -8.679   3.904 -13.095
  337    H    LYS  52           H        LYS  52  -2.278   5.072  -6.215
  338    HA   LYS  52           HA       LYS  52  -0.193   3.978  -7.975
  339   1HB   LYS  52          1HB       LYS  52  -0.056   6.367  -6.114
  340   2HB   LYS  52          2HB       LYS  52   1.361   5.635  -6.858
  341   1HG   LYS  52          1HG       LYS  52   0.917   6.521  -8.896
  342   2HG   LYS  52          2HG       LYS  52  -0.832   6.429  -8.677
  343   1HD   LYS  52          1HD       LYS  52  -0.779   8.344  -7.202
  344   2HD   LYS  52          2HD       LYS  52   0.981   8.413  -7.309
  345   1HE   LYS  52          1HE       LYS  52  -0.910   8.744  -9.641
  346   2HE   LYS  52          2HE       LYS  52  -0.166  10.074  -8.751
  347   1HZ   LYS  52          1HZ       LYS  52   1.852   8.277  -9.538
  348   2HZ   LYS  52          2HZ       LYS  52   0.892   8.623 -10.896
  349   3HZ   LYS  52          3HZ       LYS  52   1.614   9.888 -10.027
  350    H    TRP  53           H        TRP  53   0.576   2.204  -7.180
  351    HA   TRP  53           HA       TRP  53   0.718   1.860  -4.265
  352   1HB   TRP  53          1HB       TRP  53   0.003  -0.445  -4.604
  353   2HB   TRP  53          2HB       TRP  53  -1.177   0.657  -5.227
  354    HD1  TRP  53           HD1      TRP  53  -0.982   1.031  -8.089
  355    HE1  TRP  53           1HE      TRP  53  -0.509  -0.812  -9.830
  356    HE3  TRP  53           3HE      TRP  53   1.028  -2.351  -4.988
  357    HZ2  TRP  53           2HZ      TRP  53   0.625  -3.432  -9.843
  358    HZ3  TRP  53           3HZ      TRP  53   1.810  -4.537  -5.885
  359    HH2  TRP  53           HH2      TRP  53   1.607  -5.052  -8.269
  360    H    GLY  54           H        GLY  54   1.935  -0.135  -3.740
  361   1HA   GLY  54          1HA       GLY  54   4.101  -0.966  -5.414
  362   2HA   GLY  54          2HA       GLY  54   4.619   0.117  -4.119
  363    H    PHE  55           H        PHE  55   4.972  -2.877  -4.599
  364    HA   PHE  55           HA       PHE  55   3.441  -4.265  -2.726
  365   1HB   PHE  55          1HB       PHE  55   6.073  -4.759  -4.048
  366   2HB   PHE  55          2HB       PHE  55   5.546  -5.824  -2.759
  367    HD1  PHE  55           1HD      PHE  55   2.503  -5.223  -3.722
  368    HD2  PHE  55           2HD      PHE  55   6.049  -6.747  -5.513
  369    HE1  PHE  55           1HE      PHE  55   1.144  -6.508  -5.321
  370    HE2  PHE  55           2HE      PHE  55   4.699  -8.031  -7.116
  371    HZ   PHE  55           HZ       PHE  55   2.242  -7.910  -7.019
  372    H    CYS  56           H        CYS  56   3.829  -4.936  -0.654
  373    HA   CYS  56           HA       CYS  56   4.741  -3.022   1.137
  374   1HB   CYS  56          1HB       CYS  56   3.131  -4.982   1.540
  375   2HB   CYS  56          2HB       CYS  56   4.574  -5.957   1.788
  376    HA   PRO  57           HA       PRO  57   9.125  -3.676   1.116
  377   1HB   PRO  57          1HB       PRO  57   9.795  -2.103   3.140
  378   2HB   PRO  57          2HB       PRO  57   9.137  -1.424   1.643
  379   1HG   PRO  57          1HG       PRO  57   7.698  -2.146   4.154
  380   2HG   PRO  57          2HG       PRO  57   7.683  -0.579   3.319
  381   1HD   PRO  57          1HD       PRO  57   5.716  -2.359   2.959
  382   2HD   PRO  57          2HD       PRO  57   6.343  -1.411   1.590
  383    H    ASP  58           H        ASP  58  10.343  -3.332   3.741
  384    HA   ASP  58           HA       ASP  58  10.615  -6.033   4.483
  385   1HB   ASP  58          1HB       ASP  58  12.291  -4.189   4.899
  386   2HB   ASP  58          2HB       ASP  58  11.255  -3.634   6.207
  387    H    GLN  59           H        GLN  59   8.867  -7.138   5.213
  388    HA   GLN  59           HA       GLN  59   6.896  -5.901   6.914
  389   1HB   GLN  59          1HB       GLN  59   7.232  -8.739   5.941
  390   2HB   GLN  59          2HB       GLN  59   5.901  -8.220   6.967
  391   1HG   GLN  59          1HG       GLN  59   5.298  -6.570   5.199
  392   2HG   GLN  59          2HG       GLN  59   6.530  -7.309   4.172
  393   1HE2  GLN  59          1HE2      GLN  59   4.292  -9.633   2.980
  394   2HE2  GLN  59          2HE2      GLN  59   5.609  -8.545   2.715
  395    H    GLY  60           H        GLY  60   7.622  -5.423   8.903
  396   1HA   GLY  60          1HA       GLY  60   8.194  -7.608  10.698
  397   2HA   GLY  60          2HA       GLY  60   9.552  -6.517  10.444
  Start of MODEL   10
    1    H    SER   1           1H       SER   1  11.326   7.104  10.805
    2    HA   SER   1           HA       SER   1  10.454   7.469   8.375
    3   1HB   SER   1          1HB       SER   1  13.204   6.393   9.061
    4   2HB   SER   1          2HB       SER   1  12.789   7.532   7.778
    5    HG   SER   1           HG       SER   1  12.946   9.088   9.183
    6    H    TRP   2           H        TRP   2   9.439   6.199   6.970
    7    HA   TRP   2           HA       TRP   2   9.945   3.352   6.888
    8   1HB   TRP   2          1HB       TRP   2   7.995   5.137   5.446
    9   2HB   TRP   2          2HB       TRP   2   8.208   3.444   5.005
   10    HD1  TRP   2           HD1      TRP   2   7.375   5.461   8.237
   11    HE1  TRP   2           1HE      TRP   2   5.719   4.059   9.630
   12    HE3  TRP   2           3HE      TRP   2   7.144   1.291   5.276
   13    HZ2  TRP   2           2HZ      TRP   2   4.478   1.523   9.483
   14    HZ3  TRP   2           3HZ      TRP   2   5.718  -0.583   5.989
   15    HH2  TRP   2           HH2      TRP   2   4.415  -0.471   8.048
   16    H    MET   3           H        MET   3  10.526   2.188   5.030
   17    HA   MET   3           HA       MET   3  12.561   3.529   3.462
   18   1HB   MET   3          1HB       MET   3  11.728   0.615   3.496
   19   2HB   MET   3          2HB       MET   3  13.167   1.272   2.730
   20   1HG   MET   3          1HG       MET   3  14.034   1.941   4.901
   21   2HG   MET   3          2HG       MET   3  12.583   1.314   5.680
   22   1HE   MET   3          1HE       MET   3  14.913   0.702   6.854
   23   2HE   MET   3          2HE       MET   3  14.172  -0.833   7.308
   24   3HE   MET   3          3HE       MET   3  15.765  -0.811   6.550
   25    H    SER   4           H        SER   4  12.656   2.408   1.075
   26    HA   SER   4           HA       SER   4  10.377   3.519  -0.279
   27   1HB   SER   4          1HB       SER   4  12.725   3.701  -1.140
   28   2HB   SER   4          2HB       SER   4  12.679   1.978  -1.496
   29    HG   SER   4           HG       SER   4  11.861   2.593  -3.329
   30    H    THR   5           H        THR   5   9.546   2.130  -2.250
   31    HA   THR   5           HA       THR   5   8.525  -0.333  -1.062
   32    HB   THR   5           HB       THR   5   6.865  -0.150  -2.985
   33    HG1  THR   5           1HG      THR   5   7.666   2.550  -3.076
   34   1HG2  THR   5          1HG2      THR   5   6.448   2.316  -1.486
   35   2HG2  THR   5          2HG2      THR   5   5.413   0.899  -1.663
   36   3HG2  THR   5          3HG2      THR   5   6.733   0.886  -0.491
   37    H    VAL   6           H        VAL   6   7.855  -1.967  -2.711
   38    HA   VAL   6           HA       VAL   6   9.799  -2.430  -4.826
   39    HB   VAL   6           HB       VAL   6  10.726  -3.962  -3.402
   40   1HG1  VAL   6          1HG1      VAL   6   8.696  -3.192  -1.695
   41   2HG1  VAL   6          2HG1      VAL   6   8.487  -4.937  -1.833
   42   3HG1  VAL   6          3HG1      VAL   6  10.029  -4.274  -1.295
   43   1HG2  VAL   6          1HG2      VAL   6   9.687  -5.388  -5.065
   44   2HG2  VAL   6          2HG2      VAL   6   9.750  -6.189  -3.493
   45   3HG2  VAL   6          3HG2      VAL   6   8.236  -5.492  -4.069
   46    H    GLY   7           H        GLY   7   8.709  -4.029  -6.424
   47   1HA   GLY   7          1HA       GLY   7   6.729  -4.784  -7.472
   48   2HA   GLY   7          2HA       GLY   7   5.951  -4.595  -5.934
   49    H    GLY   8           H        GLY   8   4.094  -3.704  -6.794
   50   1HA   GLY   8          1HA       GLY   8   2.707  -2.048  -7.572
   51   2HA   GLY   8          2HA       GLY   8   3.789  -1.009  -6.677
   52    H    ASN   9           H        ASN   9   3.590   0.706  -8.031
   53    HA   ASN   9           HA       ASN   9   5.104   0.476 -10.509
   54   1HB   ASN   9          1HB       ASN   9   3.454   1.785 -11.782
   55   2HB   ASN   9          2HB       ASN   9   2.816   0.242 -11.262
   56   1HD2  ASN   9          1HD2      ASN   9   1.256   2.783  -8.687
   57   2HD2  ASN   9          2HD2      ASN   9   2.860   2.147  -8.619
   58    H    SER  10           H        SER  10   5.261   1.700  -7.713
   59    HA   SER  10           HA       SER  10   5.327   4.526  -8.107
   60   1HB   SER  10          1HB       SER  10   6.731   4.214  -5.870
   61   2HB   SER  10          2HB       SER  10   4.978   4.035  -5.883
   62    HG   SER  10           HG       SER  10   6.335   2.291  -4.869
   63    H    GLY  11           H        GLY  11   7.961   2.288  -7.225
   64   1HA   GLY  11          1HA       GLY  11   9.952   2.115  -8.611
   65   2HA   GLY  11          2HA       GLY  11   9.723   3.805  -9.039
   66    H    GLY  12           H        GLY  12   9.541   5.215  -6.913
   67   1HA   GLY  12          1HA       GLY  12  11.567   4.343  -4.976
   68   2HA   GLY  12          2HA       GLY  12  11.818   5.852  -5.835
   69    H    ALA  13           H        ALA  13   8.609   4.836  -4.919
   70    HA   ALA  13           HA       ALA  13   8.532   7.069  -3.008
   71   1HB   ALA  13          1HB       ALA  13   6.804   6.323  -5.097
   72   2HB   ALA  13          2HB       ALA  13   5.936   6.018  -3.591
   73   3HB   ALA  13          3HB       ALA  13   6.589   7.622  -3.924
   74    HA   PRO  14           HA       PRO  14   7.840   4.084   0.206
   75   1HB   PRO  14          1HB       PRO  14   7.413   5.817   2.233
   76   2HB   PRO  14          2HB       PRO  14   9.005   5.583   1.504
   77   1HG   PRO  14          1HG       PRO  14   7.141   7.857   1.260
   78   2HG   PRO  14          2HG       PRO  14   8.897   7.818   1.040
   79   1HD   PRO  14          1HD       PRO  14   6.869   7.784  -0.984
   80   2HD   PRO  14          2HD       PRO  14   8.628   7.686  -1.192
   81    H    CYS  15           H        CYS  15   6.174   3.499   1.856
   82    HA   CYS  15           HA       CYS  15   3.537   3.794   0.737
   83   1HB   CYS  15          1HB       CYS  15   4.063   2.654   3.477
   84   2HB   CYS  15          2HB       CYS  15   2.814   2.219   2.321
   85    H    VAL  16           H        VAL  16   1.817   4.997   1.579
   86    HA   VAL  16           HA       VAL  16   2.517   6.865   3.756
   87    HB   VAL  16           HB       VAL  16   0.510   7.259   1.520
   88   1HG1  VAL  16          1HG1      VAL  16   1.133   8.848   3.975
   89   2HG1  VAL  16          2HG1      VAL  16   0.593   9.664   2.509
   90   3HG1  VAL  16          3HG1      VAL  16  -0.432   8.446   3.270
   91   1HG2  VAL  16          1HG2      VAL  16   3.301   7.702   1.611
   92   2HG2  VAL  16          2HG2      VAL  16   2.164   8.161   0.342
   93   3HG2  VAL  16          3HG2      VAL  16   2.514   9.281   1.659
   94    H    PHE  17           H        PHE  17   1.588   6.336   5.620
   95    HA   PHE  17           HA       PHE  17  -1.046   5.048   5.545
   96   1HB   PHE  17          1HB       PHE  17   1.179   4.790   7.574
   97   2HB   PHE  17          2HB       PHE  17  -0.417   4.088   7.746
   98    HD1  PHE  17           1HD      PHE  17  -1.132   2.692   5.514
   99    HD2  PHE  17           2HD      PHE  17   2.808   3.366   6.953
  100    HE1  PHE  17           1HE      PHE  17  -0.367   0.683   4.343
  101    HE2  PHE  17           2HE      PHE  17   3.594   1.355   5.780
  102    HZ   PHE  17           HZ       PHE  17   2.016  -0.013   4.457
  103    HA   PRO  18           HA       PRO  18  -2.536   4.515   6.834
  104   1HB   PRO  18          1HB       PRO  18  -5.105   5.632   7.325
  105   2HB   PRO  18          2HB       PRO  18  -4.186   4.564   8.385
  106   1HG   PRO  18          1HG       PRO  18  -4.809   7.231   8.905
  107   2HG   PRO  18          2HG       PRO  18  -3.560   6.281   9.725
  108   1HD   PRO  18          1HD       PRO  18  -3.287   8.274   7.517
  109   2HD   PRO  18          2HD       PRO  18  -2.196   7.935   8.877
  110    H    PHE  19           H        PHE  19  -3.161   3.931   4.812
  111    HA   PHE  19           HA       PHE  19  -4.107   6.108   3.069
  112   1HB   PHE  19          1HB       PHE  19  -3.280   4.922   1.189
  113   2HB   PHE  19          2HB       PHE  19  -2.013   4.860   2.405
  114    HD1  PHE  19           1HD      PHE  19  -4.698   2.890   0.780
  115    HD2  PHE  19           2HD      PHE  19  -1.175   2.804   3.166
  116    HE1  PHE  19           1HE      PHE  19  -4.553   0.450   0.473
  117    HE2  PHE  19           2HE      PHE  19  -1.028   0.365   2.868
  118    HZ   PHE  19           HZ       PHE  19  -2.717  -0.811   1.507
  119    H    THR  20           H        THR  20  -5.757   5.462   1.423
  120    HA   THR  20           HA       THR  20  -7.592   3.509   2.648
  121    HB   THR  20           HB       THR  20  -8.306   6.020   1.090
  122    HG1  THR  20           1HG      THR  20  -7.826   6.846   2.982
  123   1HG2  THR  20          1HG2      THR  20 -10.588   5.663   1.854
  124   2HG2  THR  20          2HG2      THR  20 -10.029   4.328   0.846
  125   3HG2  THR  20          3HG2      THR  20 -10.104   4.135   2.597
  126    H    PHE  21           H        PHE  21  -8.038   1.820   1.469
  127    HA   PHE  21           HA       PHE  21  -7.835   2.012  -1.472
  128   1HB   PHE  21          1HB       PHE  21  -6.114   0.473  -0.366
  129   2HB   PHE  21          2HB       PHE  21  -7.466  -0.497   0.168
  130    HD1  PHE  21           1HD      PHE  21  -6.031   0.909  -2.953
  131    HD2  PHE  21           2HD      PHE  21  -8.235  -2.243  -1.153
  132    HE1  PHE  21           1HE      PHE  21  -5.931  -0.340  -5.044
  133    HE2  PHE  21           2HE      PHE  21  -8.128  -3.511  -3.247
  134    HZ   PHE  21           HZ       PHE  21  -6.984  -2.561  -5.214
  135    H    LEU  22           H        LEU  22  -9.573   1.379  -2.544
  136    HA   LEU  22           HA       LEU  22 -11.777   1.079  -2.887
  137   1HB   LEU  22          1HB       LEU  22 -10.355  -1.287  -1.896
  138   2HB   LEU  22          2HB       LEU  22 -12.036  -1.460  -2.355
  139    HG   LEU  22           HG       LEU  22 -10.378  -2.008  -4.147
  140   1HD1  LEU  22          1HD1      LEU  22 -12.743  -1.224  -4.419
  141   2HD1  LEU  22          2HD1      LEU  22 -12.041   0.335  -4.835
  142   3HD1  LEU  22          3HD1      LEU  22 -11.670  -1.086  -5.816
  143   1HD2  LEU  22          1HD2      LEU  22  -8.807  -0.170  -3.656
  144   2HD2  LEU  22          2HD2      LEU  22  -9.295  -0.278  -5.344
  145   3HD2  LEU  22          3HD2      LEU  22 -10.008   0.952  -4.300
  146    H    GLY  23           H        GLY  23 -11.718   2.512  -0.649
  147   1HA   GLY  23          1HA       GLY  23 -13.377   3.198   0.817
  148   2HA   GLY  23          2HA       GLY  23 -14.135   1.630   0.656
  149    H    ASN  24           H        ASN  24 -11.009   0.857   1.547
  150    HA   ASN  24           HA       ASN  24 -11.837   0.897   4.382
  151   1HB   ASN  24          1HB       ASN  24  -9.796  -0.916   3.085
  152   2HB   ASN  24          2HB       ASN  24 -10.504  -1.073   4.684
  153   1HD2  ASN  24          1HD2      ASN  24 -12.157  -2.885   1.600
  154   2HD2  ASN  24          2HD2      ASN  24 -10.564  -2.215   1.639
  155    H    LYS  25           H        LYS  25 -10.213   1.211   5.996
  156    HA   LYS  25           HA       LYS  25  -8.178   3.098   5.184
  157   1HB   LYS  25          1HB       LYS  25  -9.252   2.253   7.877
  158   2HB   LYS  25          2HB       LYS  25  -8.104   3.535   7.596
  159   1HG   LYS  25          1HG       LYS  25 -10.938   3.461   6.610
  160   2HG   LYS  25          2HG       LYS  25 -10.308   4.469   7.919
  161   1HD   LYS  25          1HD       LYS  25  -8.840   5.608   6.354
  162   2HD   LYS  25          2HD       LYS  25  -9.419   4.580   5.041
  163   1HE   LYS  25          1HE       LYS  25 -11.693   5.476   5.395
  164   2HE   LYS  25          2HE       LYS  25 -11.058   6.548   6.641
  165   1HZ   LYS  25          1HZ       LYS  25  -9.725   6.668   4.057
  166   2HZ   LYS  25          2HZ       LYS  25 -11.314   7.258   4.092
  167   3HZ   LYS  25          3HZ       LYS  25 -10.137   7.921   5.130
  168    H    TYR  26           H        TYR  26  -6.036   2.593   5.222
  169    HA   TYR  26           HA       TYR  26  -5.292   0.044   6.459
  170   1HB   TYR  26          1HB       TYR  26  -4.254   1.291   3.920
  171   2HB   TYR  26          2HB       TYR  26  -3.674  -0.206   4.638
  172    HD1  TYR  26           1HD      TYR  26  -5.026  -2.212   4.596
  173    HD2  TYR  26           2HD      TYR  26  -6.411   1.386   2.825
  174    HE1  TYR  26           1HE      TYR  26  -6.765  -3.468   3.422
  175    HE2  TYR  26           2HE      TYR  26  -8.152   0.139   1.646
  176    HH   TYR  26           HH       TYR  26  -8.577  -3.361   2.130
  177    H    GLU  27           H        GLU  27  -4.232   0.507   8.188
  178    HA   GLU  27           HA       GLU  27  -2.388   2.757   8.290
  179   1HB   GLU  27          1HB       GLU  27  -3.410   0.863  10.391
  180   2HB   GLU  27          2HB       GLU  27  -2.279   2.154  10.701
  181   1HG   GLU  27          1HG       GLU  27  -3.952   3.784   9.910
  182   2HG   GLU  27          2HG       GLU  27  -5.091   2.456   9.702
  183    H    SER  28           H        SER  28  -2.462  -0.520   7.702
  184    HA   SER  28           HA       SER  28   0.444  -0.762   7.967
  185   1HB   SER  28          1HB       SER  28  -0.120  -3.256   8.318
  186   2HB   SER  28          2HB       SER  28  -0.397  -2.179   9.680
  187    HG   SER  28           HG       SER  28  -2.244  -3.442   7.979
  188    H    CYS  29           H        CYS  29   0.937  -2.990   6.532
  189    HA   CYS  29           HA       CYS  29   0.265  -2.222   3.875
  190   1HB   CYS  29          1HB       CYS  29   1.488  -4.779   4.915
  191   2HB   CYS  29          2HB       CYS  29   1.324  -4.376   3.219
  192    H    THR  30           H        THR  30  -0.705  -3.885   2.347
  193    HA   THR  30           HA       THR  30  -2.876  -5.398   3.597
  194    HB   THR  30           HB       THR  30  -3.795  -3.131   3.107
  195    HG1  THR  30           1HG      THR  30  -5.300  -4.697   2.934
  196   1HG2  THR  30          1HG2      THR  30  -4.189  -2.953   0.459
  197   2HG2  THR  30          2HG2      THR  30  -2.877  -2.137   1.309
  198   3HG2  THR  30          3HG2      THR  30  -2.575  -3.662   0.477
  199    H    SER  31           H        SER  31  -4.099  -6.622   1.907
  200    HA   SER  31           HA       SER  31  -2.373  -7.358  -0.346
  201   1HB   SER  31          1HB       SER  31  -3.261  -9.703  -0.074
  202   2HB   SER  31          2HB       SER  31  -2.211  -9.166   1.242
  203    HG   SER  31           HG       SER  31  -5.057  -9.252   1.256
  204    H    ALA  32           H        ALA  32  -4.732  -5.604   0.348
  205    HA   ALA  32           HA       ALA  32  -7.110  -6.454  -0.779
  206   1HB   ALA  32          1HB       ALA  32  -5.930  -3.958   0.080
  207   2HB   ALA  32          2HB       ALA  32  -6.939  -3.726  -1.347
  208   3HB   ALA  32          3HB       ALA  32  -7.621  -4.459   0.106
  209    H    GLY  33           H        GLY  33  -7.972  -6.561  -2.737
  210   1HA   GLY  33          1HA       GLY  33  -8.166  -6.389  -5.032
  211   2HA   GLY  33          2HA       GLY  33  -6.786  -5.298  -5.028
  212    H    ARG  34           H        ARG  34  -5.352  -7.510  -3.414
  213    HA   ARG  34           HA       ARG  34  -4.406  -8.924  -5.791
  214   1HB   ARG  34          1HB       ARG  34  -3.206  -8.808  -3.016
  215   2HB   ARG  34          2HB       ARG  34  -2.478  -9.554  -4.422
  216   1HG   ARG  34          1HG       ARG  34  -2.758  -7.115  -5.416
  217   2HG   ARG  34          2HG       ARG  34  -2.708  -6.694  -3.704
  218   1HD   ARG  34          1HD       ARG  34  -0.483  -6.658  -4.782
  219   2HD   ARG  34          2HD       ARG  34  -0.582  -7.810  -3.447
  220    HE   ARG  34           HE       ARG  34  -0.166  -9.485  -4.921
  221   1HH1  ARG  34          1HH1      ARG  34  -1.238  -6.678  -6.723
  222   2HH1  ARG  34          2HH1      ARG  34  -1.044  -7.444  -8.270
  223   1HH2  ARG  34          1HH2      ARG  34   0.086 -10.495  -6.915
  224   2HH2  ARG  34          2HH2      ARG  34  -0.291  -9.641  -8.382
  225    H    SER  35           H        SER  35  -4.389  -9.967  -2.442
  226    HA   SER  35           HA       SER  35  -5.049 -11.848  -1.387
  227   1HB   SER  35          1HB       SER  35  -7.151 -11.916  -3.568
  228   2HB   SER  35          2HB       SER  35  -7.166 -12.929  -2.123
  229    HG   SER  35           HG       SER  35  -8.159 -10.502  -2.379
  230    H    ASP  36           H        ASP  36  -3.251 -11.856  -3.886
  231    HA   ASP  36           HA       ASP  36  -3.484 -14.624  -4.719
  232   1HB   ASP  36          1HB       ASP  36  -2.132 -14.060  -6.518
  233   2HB   ASP  36          2HB       ASP  36  -2.973 -12.559  -6.209
  234    H    GLY  37           H        GLY  37  -1.489 -12.488  -2.906
  235   1HA   GLY  37          1HA       GLY  37  -0.531 -14.250  -1.078
  236   2HA   GLY  37          2HA       GLY  37   0.602 -14.397  -2.409
  237    H    LYS  38           H        LYS  38   1.371 -12.136  -3.230
  238    HA   LYS  38           HA       LYS  38   2.864 -10.970  -1.184
  239   1HB   LYS  38          1HB       LYS  38   2.198  -9.679  -3.820
  240   2HB   LYS  38          2HB       LYS  38   3.638  -9.442  -2.839
  241   1HG   LYS  38          1HG       LYS  38   4.422 -10.793  -4.504
  242   2HG   LYS  38          2HG       LYS  38   4.040 -11.971  -3.269
  243   1HD   LYS  38          1HD       LYS  38   2.017 -12.579  -4.384
  244   2HD   LYS  38          2HD       LYS  38   2.172 -11.229  -5.509
  245   1HE   LYS  38          1HE       LYS  38   4.133 -12.219  -6.499
  246   2HE   LYS  38          2HE       LYS  38   4.137 -13.510  -5.299
  247   1HZ   LYS  38          1HZ       LYS  38   1.631 -13.398  -6.647
  248   2HZ   LYS  38          2HZ       LYS  38   2.912 -13.543  -7.763
  249   3HZ   LYS  38          3HZ       LYS  38   2.733 -14.683  -6.521
  250    H    MET  39           H        MET  39   2.585  -9.244   0.103
  251    HA   MET  39           HA       MET  39   0.041  -7.820  -0.071
  252   1HB   MET  39          1HB       MET  39   2.114  -7.787   2.142
  253   2HB   MET  39          2HB       MET  39   0.552  -7.001   2.175
  254   1HG   MET  39          1HG       MET  39   0.223  -8.891   3.449
  255   2HG   MET  39          2HG       MET  39  -0.445  -9.323   1.878
  256   1HE   MET  39          1HE       MET  39   0.085 -11.204   4.120
  257   2HE   MET  39          2HE       MET  39  -0.183 -12.154   2.659
  258   3HE   MET  39          3HE       MET  39   1.210 -12.490   3.685
  259    H    TRP  40           H        TRP  40   0.034  -5.503  -0.008
  260    HA   TRP  40           HA       TRP  40   2.579  -4.250  -0.769
  261   1HB   TRP  40          1HB       TRP  40   1.348  -2.917  -2.480
  262   2HB   TRP  40          2HB       TRP  40   1.398  -4.638  -2.853
  263    HD1  TRP  40           HD1      TRP  40  -1.017  -6.001  -2.116
  264    HE1  TRP  40           1HE      TRP  40  -3.433  -5.143  -2.323
  265    HE3  TRP  40           3HE      TRP  40  -0.071  -1.008  -2.507
  266    HZ2  TRP  40           2HZ      TRP  40  -4.756  -2.680  -2.575
  267    HZ3  TRP  40           3HZ      TRP  40  -1.972   0.538  -2.693
  268    HH2  TRP  40           HH2      TRP  40  -4.260  -0.285  -2.733
  269    H    CYS  41           H        CYS  41   1.657  -1.722  -1.222
  270    HA   CYS  41           HA       CYS  41   0.060  -0.739   0.973
  271   1HB   CYS  41          1HB       CYS  41   1.847   0.641   1.944
  272   2HB   CYS  41          2HB       CYS  41   2.275  -1.065   2.056
  273    H    ALA  42           H        ALA  42  -0.527   1.491   0.614
  274    HA   ALA  42           HA       ALA  42  -0.158   2.299  -2.151
  275   1HB   ALA  42          1HB       ALA  42  -2.177   2.733  -0.227
  276   2HB   ALA  42          2HB       ALA  42  -1.495   4.310  -0.627
  277   3HB   ALA  42          3HB       ALA  42  -2.135   3.276  -1.906
  278    H    THR  43           H        THR  43   0.810   4.242  -2.787
  279    HA   THR  43           HA       THR  43   2.777   5.197  -0.841
  280    HB   THR  43           HB       THR  43   4.078   5.901  -2.793
  281    HG1  THR  43           1HG      THR  43   2.946   6.308  -4.517
  282   1HG2  THR  43          1HG2      THR  43   3.043   3.128  -3.292
  283   2HG2  THR  43          2HG2      THR  43   4.643   3.773  -3.658
  284   3HG2  THR  43          3HG2      THR  43   4.154   3.524  -1.982
  285    H    THR  44           H        THR  44  -0.151   5.966  -1.520
  286    HA   THR  44           HA       THR  44   0.292   8.850  -1.272
  287    HB   THR  44           HB       THR  44  -1.778   9.195  -2.661
  288    HG1  THR  44           1HG      THR  44  -2.875   7.511  -3.229
  289   1HG2  THR  44          1HG2      THR  44  -0.062   7.706  -4.520
  290   2HG2  THR  44          2HG2      THR  44  -0.638   9.372  -4.586
  291   3HG2  THR  44          3HG2      THR  44   0.743   8.954  -3.570
  292    H    ALA  45           H        ALA  45  -1.332   9.914   0.002
  293    HA   ALA  45           HA       ALA  45  -2.225   8.502   2.239
  294   1HB   ALA  45          1HB       ALA  45  -1.945  11.024   1.949
  295   2HB   ALA  45          2HB       ALA  45  -3.568  11.005   1.261
  296   3HB   ALA  45          3HB       ALA  45  -3.309  10.471   2.921
  297    H    ASN  46           H        ASN  46  -3.898   9.230  -0.775
  298    HA   ASN  46           HA       ASN  46  -6.000   7.370   0.074
  299   1HB   ASN  46          1HB       ASN  46  -6.816   9.763  -0.010
  300   2HB   ASN  46          2HB       ASN  46  -6.478   9.742  -1.741
  301   1HD2  ASN  46          1HD2      ASN  46  -9.901   8.322  -0.328
  302   2HD2  ASN  46          2HD2      ASN  46  -8.767   9.240   0.594
  303    H    TYR  47           H        TYR  47  -5.744   5.594  -1.064
  304    HA   TYR  47           HA       TYR  47  -4.280   5.538  -3.508
  305   1HB   TYR  47          1HB       TYR  47  -4.276   3.686  -1.836
  306   2HB   TYR  47          2HB       TYR  47  -5.936   3.325  -2.293
  307    HD1  TYR  47           1HD      TYR  47  -6.400   2.598  -4.687
  308    HD2  TYR  47           2HD      TYR  47  -2.483   2.880  -3.076
  309    HE1  TYR  47           1HE      TYR  47  -5.557   1.145  -6.485
  310    HE2  TYR  47           2HE      TYR  47  -1.637   1.435  -4.853
  311    HH   TYR  47           HH       TYR  47  -2.826  -0.453  -6.411
  312    H    ASP  48           H        ASP  48  -7.710   5.387  -2.691
  313    HA   ASP  48           HA       ASP  48  -8.731   4.551  -5.122
  314   1HB   ASP  48          1HB       ASP  48  -9.818   6.456  -3.067
  315   2HB   ASP  48          2HB       ASP  48 -10.742   5.982  -4.484
  316    H    ASP  49           H        ASP  49  -7.580   7.681  -4.141
  317    HA   ASP  49           HA       ASP  49  -8.493   9.095  -6.445
  318   1HB   ASP  49          1HB       ASP  49  -6.793   9.726  -4.088
  319   2HB   ASP  49          2HB       ASP  49  -6.690  10.779  -5.494
  320    H    ASP  50           H        ASP  50  -5.123   8.747  -5.340
  321    HA   ASP  50           HA       ASP  50  -4.168   9.206  -8.007
  322   1HB   ASP  50          1HB       ASP  50  -2.765   8.722  -5.392
  323   2HB   ASP  50          2HB       ASP  50  -1.895   8.939  -6.909
  324    H    ARG  51           H        ARG  51  -4.815   6.328  -6.243
  325    HA   ARG  51           HA       ARG  51  -4.280   4.167  -6.505
  326   1HB   ARG  51          1HB       ARG  51  -4.619   5.016  -9.358
  327   2HB   ARG  51          2HB       ARG  51  -4.658   3.347  -8.795
  328   1HG   ARG  51          1HG       ARG  51  -6.362   4.600  -7.079
  329   2HG   ARG  51          2HG       ARG  51  -6.698   5.406  -8.618
  330   1HD   ARG  51          1HD       ARG  51  -6.519   2.434  -8.378
  331   2HD   ARG  51          2HD       ARG  51  -8.007   3.302  -8.000
  332    HE   ARG  51           HE       ARG  51  -7.259   4.200 -10.498
  333   1HH1  ARG  51          1HH1      ARG  51  -7.932   1.063  -9.110
  334   2HH1  ARG  51          2HH1      ARG  51  -8.690   0.450 -10.550
  335   1HH2  ARG  51          1HH2      ARG  51  -8.228   3.390 -12.390
  336   2HH2  ARG  51          2HH2      ARG  51  -8.862   1.773 -12.410
  337    H    LYS  52           H        LYS  52  -2.006   5.109  -5.800
  338    HA   LYS  52           HA       LYS  52  -0.086   3.892  -7.659
  339   1HB   LYS  52          1HB       LYS  52   0.341   6.232  -5.792
  340   2HB   LYS  52          2HB       LYS  52   1.645   5.396  -6.630
  341   1HG   LYS  52          1HG       LYS  52   0.823   6.058  -8.756
  342   2HG   LYS  52          2HG       LYS  52  -0.676   6.671  -8.055
  343   1HD   LYS  52          1HD       LYS  52   0.721   8.343  -6.793
  344   2HD   LYS  52          2HD       LYS  52   2.103   7.797  -7.749
  345   1HE   LYS  52          1HE       LYS  52  -0.430   9.073  -8.770
  346   2HE   LYS  52          2HE       LYS  52   1.194   9.761  -8.788
  347   1HZ   LYS  52          1HZ       LYS  52   1.791   7.758 -10.222
  348   2HZ   LYS  52          2HZ       LYS  52   0.116   7.538 -10.426
  349   3HZ   LYS  52          3HZ       LYS  52   0.852   8.977 -10.944
  350    H    TRP  53           H        TRP  53   0.730   2.098  -6.917
  351    HA   TRP  53           HA       TRP  53   0.799   1.663  -4.015
  352   1HB   TRP  53          1HB       TRP  53   0.043  -0.591  -4.388
  353   2HB   TRP  53          2HB       TRP  53  -1.067   0.514  -5.104
  354    HD1  TRP  53           HD1      TRP  53  -0.529   0.890  -7.950
  355    HE1  TRP  53           1HE      TRP  53  -0.041  -1.008  -9.629
  356    HE3  TRP  53           3HE      TRP  53   0.861  -2.603  -4.638
  357    HZ2  TRP  53           2HZ      TRP  53   0.848  -3.723  -9.506
  358    HZ3  TRP  53           3HZ      TRP  53   1.547  -4.861  -5.441
  359    HH2  TRP  53           HH2      TRP  53   1.535  -5.393  -7.832
  360    H    GLY  54           H        GLY  54   2.019  -0.222  -3.394
  361   1HA   GLY  54          1HA       GLY  54   4.238  -1.132  -4.976
  362   2HA   GLY  54          2HA       GLY  54   4.712  -0.018  -3.694
  363    H    PHE  55           H        PHE  55   5.040  -3.035  -4.120
  364    HA   PHE  55           HA       PHE  55   3.514  -4.421  -2.247
  365   1HB   PHE  55          1HB       PHE  55   6.249  -4.888  -3.403
  366   2HB   PHE  55          2HB       PHE  55   5.557  -5.980  -2.222
  367    HD1  PHE  55           1HD      PHE  55   2.719  -5.916  -3.126
  368    HD2  PHE  55           2HD      PHE  55   6.339  -6.219  -5.336
  369    HE1  PHE  55           1HE      PHE  55   1.524  -7.161  -4.885
  370    HE2  PHE  55           2HE      PHE  55   5.154  -7.459  -7.101
  371    HZ   PHE  55           HZ       PHE  55   2.753  -7.928  -6.887
  372    H    CYS  56           H        CYS  56   4.076  -5.210  -0.169
  373    HA   CYS  56           HA       CYS  56   5.015  -3.193   1.582
  374   1HB   CYS  56          1HB       CYS  56   3.316  -5.072   2.049
  375   2HB   CYS  56          2HB       CYS  56   4.715  -6.112   2.290
  376    HA   PRO  57           HA       PRO  57   9.380  -3.968   1.552
  377   1HB   PRO  57          1HB       PRO  57  10.073  -3.004   3.954
  378   2HB   PRO  57          2HB       PRO  57   9.553  -1.950   2.629
  379   1HG   PRO  57          1HG       PRO  57   7.929  -3.110   4.842
  380   2HG   PRO  57          2HG       PRO  57   8.049  -1.402   4.376
  381   1HD   PRO  57          1HD       PRO  57   5.996  -2.865   3.556
  382   2HD   PRO  57          2HD       PRO  57   6.799  -1.761   2.414
  383    H    ASP  58           H        ASP  58  10.697  -4.345   4.110
  384    HA   ASP  58           HA       ASP  58  11.158  -7.038   4.155
  385   1HB   ASP  58          1HB       ASP  58  12.539  -5.365   5.333
  386   2HB   ASP  58          2HB       ASP  58  11.274  -5.196   6.546
  387    H    GLN  59           H        GLN  59   9.663  -8.571   4.276
  388    HA   GLN  59           HA       GLN  59   7.336  -8.321   5.971
  389   1HB   GLN  59          1HB       GLN  59   8.253 -10.594   4.206
  390   2HB   GLN  59          2HB       GLN  59   6.694 -10.495   5.004
  391   1HG   GLN  59          1HG       GLN  59   7.650  -8.447   3.036
  392   2HG   GLN  59          2HG       GLN  59   6.732  -9.879   2.568
  393   1HE2  GLN  59          1HE2      GLN  59   3.724  -8.317   3.157
  394   2HE2  GLN  59          2HE2      GLN  59   4.681  -9.441   2.254
  395    H    GLY  60           H        GLY  60   6.948  -9.304   7.857
  396   1HA   GLY  60          1HA       GLY  60   7.715 -11.587   8.967
  397   2HA   GLY  60          2HA       GLY  60   9.190 -10.645   9.151
  Start of MODEL   11
    1    H    SER   1           1H       SER   1  16.540   6.395   8.656
    2    HA   SER   1           HA       SER   1  14.229   6.869   8.142
    3   1HB   SER   1          1HB       SER   1  14.787   9.141   7.169
    4   2HB   SER   1          2HB       SER   1  15.715   8.682   8.596
    5    HG   SER   1           HG       SER   1  16.533   8.911   5.920
    6    H    TRP   2           H        TRP   2  12.612   6.827   6.720
    7    HA   TRP   2           HA       TRP   2  11.414   6.562   4.819
    8   1HB   TRP   2          1HB       TRP   2  12.362   8.540   3.942
    9   2HB   TRP   2          2HB       TRP   2  13.919   7.770   3.666
   10    HD1  TRP   2           HD1      TRP   2  10.298   7.459   2.261
   11    HE1  TRP   2           1HE      TRP   2  10.491   6.906  -0.251
   12    HE3  TRP   2           3HE      TRP   2  15.382   7.113   1.886
   13    HZ2  TRP   2           2HZ      TRP   2  12.524   6.393  -2.132
   14    HZ3  TRP   2           3HZ      TRP   2  16.377   6.577  -0.301
   15    HH2  TRP   2           HH2      TRP   2  14.972   6.224  -2.268
   16    H    MET   3           H        MET   3  10.960   4.476   4.508
   17    HA   MET   3           HA       MET   3  12.996   2.785   3.261
   18   1HB   MET   3          1HB       MET   3  11.622   0.883   3.969
   19   2HB   MET   3          2HB       MET   3  12.096   1.865   5.337
   20   1HG   MET   3          1HG       MET   3   9.909   2.812   5.494
   21   2HG   MET   3          2HG       MET   3   9.412   2.028   3.991
   22   1HE   MET   3          1HE       MET   3  10.748   1.587   7.504
   23   2HE   MET   3          2HE       MET   3  10.134   0.024   8.051
   24   3HE   MET   3          3HE       MET   3  11.520   0.099   6.963
   25    H    SER   4           H        SER   4  12.642   1.959   1.243
   26    HA   SER   4           HA       SER   4  10.479   3.176  -0.251
   27   1HB   SER   4          1HB       SER   4  12.660   1.306  -1.224
   28   2HB   SER   4          2HB       SER   4  11.605   2.309  -2.223
   29    HG   SER   4           HG       SER   4  12.532   4.140  -1.029
   30    H    THR   5           H        THR   5   9.682   1.583  -2.133
   31    HA   THR   5           HA       THR   5   8.392  -0.655  -0.741
   32    HB   THR   5           HB       THR   5   6.787  -0.350  -2.787
   33    HG1  THR   5           1HG      THR   5   7.323   2.334  -2.664
   34   1HG2  THR   5          1HG2      THR   5   5.724   1.700  -1.563
   35   2HG2  THR   5          2HG2      THR   5   5.703   0.092  -0.840
   36   3HG2  THR   5          3HG2      THR   5   6.896   1.282  -0.311
   37    H    VAL   6           H        VAL   6   7.423  -2.157  -2.501
   38    HA   VAL   6           HA       VAL   6   9.439  -2.974  -4.492
   39    HB   VAL   6           HB       VAL   6   7.832  -5.185  -3.542
   40   1HG1  VAL   6          1HG1      VAL   6  10.792  -4.699  -3.660
   41   2HG1  VAL   6          2HG1      VAL   6  10.058  -6.246  -3.241
   42   3HG1  VAL   6          3HG1      VAL   6   9.792  -5.549  -4.841
   43   1HG2  VAL   6          1HG2      VAL   6   7.883  -3.935  -1.412
   44   2HG2  VAL   6          2HG2      VAL   6   8.709  -5.493  -1.332
   45   3HG2  VAL   6          3HG2      VAL   6   9.644  -4.004  -1.456
   46    H    GLY   7           H        GLY   7   7.971  -4.960  -5.633
   47   1HA   GLY   7          1HA       GLY   7   6.407  -5.099  -7.364
   48   2HA   GLY   7          2HA       GLY   7   5.332  -4.925  -6.008
   49    H    GLY   8           H        GLY   8   3.738  -3.685  -6.630
   50   1HA   GLY   8          1HA       GLY   8   2.548  -1.962  -7.591
   51   2HA   GLY   8          2HA       GLY   8   3.703  -1.014  -6.691
   52    H    ASN   9           H        ASN   9   3.776   0.670  -8.034
   53    HA   ASN   9           HA       ASN   9   5.317   0.256 -10.471
   54   1HB   ASN   9          1HB       ASN   9   3.873   2.190 -11.512
   55   2HB   ASN   9          2HB       ASN   9   3.339   0.534 -11.619
   56   1HD2  ASN   9          1HD2      ASN   9   1.403   2.416  -8.658
   57   2HD2  ASN   9          2HD2      ASN   9   3.113   2.218  -8.662
   58    H    SER  10           H        SER  10   4.625   1.867  -7.623
   59    HA   SER  10           HA       SER  10   6.198   4.232  -8.290
   60   1HB   SER  10          1HB       SER  10   5.151   3.681  -5.544
   61   2HB   SER  10          2HB       SER  10   5.292   5.210  -6.393
   62    HG   SER  10           HG       SER  10   3.091   4.272  -6.110
   63    H    GLY  11           H        GLY  11   7.620   1.873  -8.431
   64   1HA   GLY  11          1HA       GLY  11   8.821   0.887  -6.146
   65   2HA   GLY  11          2HA       GLY  11   9.602   0.958  -7.718
   66    H    GLY  12           H        GLY  12   9.423   2.302  -4.564
   67   1HA   GLY  12          1HA       GLY  12  11.685   3.313  -3.985
   68   2HA   GLY  12          2HA       GLY  12  11.362   4.383  -5.344
   69    H    ALA  13           H        ALA  13   8.454   4.520  -4.689
   70    HA   ALA  13           HA       ALA  13   8.667   6.703  -2.812
   71   1HB   ALA  13          1HB       ALA  13   6.805   5.839  -4.813
   72   2HB   ALA  13          2HB       ALA  13   5.953   6.134  -3.295
   73   3HB   ALA  13          3HB       ALA  13   6.938   7.407  -4.018
   74    HA   PRO  14           HA       PRO  14   7.599   4.293   0.717
   75   1HB   PRO  14          1HB       PRO  14   6.976   6.275   2.440
   76   2HB   PRO  14          2HB       PRO  14   8.631   5.973   1.907
   77   1HG   PRO  14          1HG       PRO  14   6.733   8.104   1.079
   78   2HG   PRO  14          2HG       PRO  14   8.498   8.162   1.229
   79   1HD   PRO  14          1HD       PRO  14   7.047   7.855  -1.145
   80   2HD   PRO  14          2HD       PRO  14   8.775   7.533  -0.940
   81    H    CYS  15           H        CYS  15   5.782   3.602   1.951
   82    HA   CYS  15           HA       CYS  15   3.263   3.962   0.634
   83   1HB   CYS  15          1HB       CYS  15   3.414   2.757   3.367
   84   2HB   CYS  15          2HB       CYS  15   2.479   2.236   1.973
   85    H    VAL  16           H        VAL  16   1.636   5.354   1.169
   86    HA   VAL  16           HA       VAL  16   2.114   7.253   3.313
   87    HB   VAL  16           HB       VAL  16  -0.090   7.130   1.240
   88   1HG1  VAL  16          1HG1      VAL  16   0.494   9.184   3.358
   89   2HG1  VAL  16          2HG1      VAL  16  -0.493   9.513   1.936
   90   3HG1  VAL  16          3HG1      VAL  16  -1.004   8.289   3.101
   91   1HG2  VAL  16          1HG2      VAL  16   2.574   7.927   1.030
   92   2HG2  VAL  16          2HG2      VAL  16   1.272   8.236  -0.123
   93   3HG2  VAL  16          3HG2      VAL  16   1.638   9.419   1.128
   94    H    PHE  17           H        PHE  17   1.548   6.618   5.311
   95    HA   PHE  17           HA       PHE  17  -0.969   5.141   5.608
   96   1HB   PHE  17          1HB       PHE  17   1.567   5.034   7.222
   97   2HB   PHE  17          2HB       PHE  17   0.048   4.376   7.795
   98    HD1  PHE  17           1HD      PHE  17  -1.127   2.922   5.717
   99    HD2  PHE  17           2HD      PHE  17   3.002   3.457   6.544
  100    HE1  PHE  17           1HE      PHE  17  -0.622   0.810   4.572
  101    HE2  PHE  17           2HE      PHE  17   3.527   1.356   5.401
  102    HZ   PHE  17           HZ       PHE  17   1.711   0.008   4.385
  103    HA   PRO  18           HA       PRO  18  -2.323   4.593   6.874
  104   1HB   PRO  18          1HB       PRO  18  -4.877   5.548   7.622
  105   2HB   PRO  18          2HB       PRO  18  -3.810   4.523   8.582
  106   1HG   PRO  18          1HG       PRO  18  -4.544   7.156   9.192
  107   2HG   PRO  18          2HG       PRO  18  -3.200   6.259   9.919
  108   1HD   PRO  18          1HD       PRO  18  -3.168   8.292   7.732
  109   2HD   PRO  18          2HD       PRO  18  -1.965   7.978   9.003
  110    H    PHE  19           H        PHE  19  -3.153   4.066   4.865
  111    HA   PHE  19           HA       PHE  19  -4.244   6.323   3.335
  112   1HB   PHE  19          1HB       PHE  19  -3.925   5.014   1.307
  113   2HB   PHE  19          2HB       PHE  19  -2.420   5.129   2.200
  114    HD1  PHE  19           1HD      PHE  19  -1.614   3.126   3.479
  115    HD2  PHE  19           2HD      PHE  19  -4.877   2.952   0.758
  116    HE1  PHE  19           1HE      PHE  19  -1.329   0.686   3.290
  117    HE2  PHE  19           2HE      PHE  19  -4.606   0.514   0.572
  118    HZ   PHE  19           HZ       PHE  19  -2.834  -0.622   1.843
  119    H    THR  20           H        THR  20  -5.806   5.010   1.494
  120    HA   THR  20           HA       THR  20  -7.721   3.499   3.078
  121    HB   THR  20           HB       THR  20  -8.364   6.109   1.676
  122    HG1  THR  20           1HG      THR  20  -7.700   5.511   4.172
  123   1HG2  THR  20          1HG2      THR  20 -10.660   5.671   2.793
  124   2HG2  THR  20          2HG2      THR  20 -10.293   4.940   1.230
  125   3HG2  THR  20          3HG2      THR  20 -10.179   3.975   2.702
  126    H    PHE  21           H        PHE  21  -8.385   1.854   2.019
  127    HA   PHE  21           HA       PHE  21  -8.522   1.954  -0.922
  128   1HB   PHE  21          1HB       PHE  21  -6.633   0.499   0.187
  129   2HB   PHE  21          2HB       PHE  21  -7.950  -0.581   0.586
  130    HD1  PHE  21           1HD      PHE  21  -8.595   1.100  -2.491
  131    HD2  PHE  21           2HD      PHE  21  -6.494  -2.161  -0.758
  132    HE1  PHE  21           1HE      PHE  21  -8.459   0.007  -4.677
  133    HE2  PHE  21           2HE      PHE  21  -6.348  -3.249  -2.938
  134    HZ   PHE  21           HZ       PHE  21  -7.323  -2.159  -4.923
  135    H    LEU  22           H        LEU  22 -10.349   0.933  -1.767
  136    HA   LEU  22           HA       LEU  22 -12.550   0.581  -1.874
  137   1HB   LEU  22          1HB       LEU  22 -11.468  -1.522  -0.106
  138   2HB   LEU  22          2HB       LEU  22 -12.996  -1.681  -0.953
  139    HG   LEU  22           HG       LEU  22 -11.773  -2.626  -2.578
  140   1HD1  LEU  22          1HD1      LEU  22 -11.745  -0.004  -3.165
  141   2HD1  LEU  22          2HD1      LEU  22 -10.067  -0.506  -3.367
  142   3HD1  LEU  22          3HD1      LEU  22 -11.349  -1.331  -4.257
  143   1HD2  LEU  22          1HD2      LEU  22  -9.828  -2.260  -0.654
  144   2HD2  LEU  22          2HD2      LEU  22  -9.912  -3.472  -1.935
  145   3HD2  LEU  22          3HD2      LEU  22  -9.125  -1.922  -2.237
  146    H    GLY  23           H        GLY  23 -11.866   2.431   0.360
  147   1HA   GLY  23          1HA       GLY  23 -13.471   3.597   1.650
  148   2HA   GLY  23          2HA       GLY  23 -14.388   2.111   1.809
  149    H    ASN  24           H        ASN  24 -11.359   1.068   2.535
  150    HA   ASN  24           HA       ASN  24 -11.826   1.581   5.399
  151   1HB   ASN  24          1HB       ASN  24 -10.126  -0.539   4.076
  152   2HB   ASN  24          2HB       ASN  24 -10.510  -0.433   5.782
  153   1HD2  ASN  24          1HD2      ASN  24 -12.840  -2.481   3.351
  154   2HD2  ASN  24          2HD2      ASN  24 -11.229  -1.955   3.006
  155    H    LYS  25           H        LYS  25 -10.090   2.177   6.785
  156    HA   LYS  25           HA       LYS  25  -7.975   3.639   5.476
  157   1HB   LYS  25          1HB       LYS  25  -8.807   3.274   8.355
  158   2HB   LYS  25          2HB       LYS  25  -7.530   4.331   7.821
  159   1HG   LYS  25          1HG       LYS  25  -9.095   5.720   6.620
  160   2HG   LYS  25          2HG       LYS  25 -10.406   4.595   7.000
  161   1HD   LYS  25          1HD       LYS  25 -10.353   5.130   9.281
  162   2HD   LYS  25          2HD       LYS  25  -8.769   5.900   9.148
  163   1HE   LYS  25          1HE       LYS  25 -10.423   7.622   9.386
  164   2HE   LYS  25          2HE       LYS  25  -9.811   7.664   7.732
  165   1HZ   LYS  25          1HZ       LYS  25 -11.876   6.116   7.327
  166   2HZ   LYS  25          2HZ       LYS  25 -12.455   6.886   8.728
  167   3HZ   LYS  25          3HZ       LYS  25 -12.034   7.806   7.361
  168    H    TYR  26           H        TYR  26  -6.043   2.627   5.067
  169    HA   TYR  26           HA       TYR  26  -5.432   0.264   6.680
  170   1HB   TYR  26          1HB       TYR  26  -4.377   1.095   3.978
  171   2HB   TYR  26          2HB       TYR  26  -3.895  -0.352   4.851
  172    HD1  TYR  26           1HD      TYR  26  -6.901   1.335   3.444
  173    HD2  TYR  26           2HD      TYR  26  -5.068  -2.334   4.528
  174    HE1  TYR  26           1HE      TYR  26  -8.773   0.114   2.451
  175    HE2  TYR  26           2HE      TYR  26  -6.929  -3.569   3.535
  176    HH   TYR  26           HH       TYR  26  -8.862  -3.453   2.439
  177    H    GLU  27           H        GLU  27  -4.179   0.598   8.248
  178    HA   GLU  27           HA       GLU  27  -2.278   2.789   8.270
  179   1HB   GLU  27          1HB       GLU  27  -3.104   0.851  10.424
  180   2HB   GLU  27          2HB       GLU  27  -2.096   2.257  10.654
  181   1HG   GLU  27          1HG       GLU  27  -3.947   3.710  10.006
  182   2HG   GLU  27          2HG       GLU  27  -4.970   2.292   9.769
  183    H    SER  28           H        SER  28  -2.395  -0.543   7.738
  184    HA   SER  28           HA       SER  28   0.530  -0.691   7.756
  185   1HB   SER  28          1HB       SER  28   0.108  -3.166   8.336
  186   2HB   SER  28          2HB       SER  28  -0.086  -2.000   9.639
  187    HG   SER  28           HG       SER  28  -2.075  -2.636   9.797
  188    H    CYS  29           H        CYS  29   0.934  -3.010   6.437
  189    HA   CYS  29           HA       CYS  29   0.119  -2.391   3.810
  190   1HB   CYS  29          1HB       CYS  29   1.290  -4.958   4.864
  191   2HB   CYS  29          2HB       CYS  29   1.146  -4.528   3.175
  192    H    THR  30           H        THR  30  -0.966  -3.935   2.374
  193    HA   THR  30           HA       THR  30  -3.083  -5.514   3.644
  194    HB   THR  30           HB       THR  30  -4.073  -3.248   3.241
  195    HG1  THR  30           1HG      THR  30  -5.544  -4.841   3.006
  196   1HG2  THR  30          1HG2      THR  30  -4.500  -2.899   0.657
  197   2HG2  THR  30          2HG2      THR  30  -3.103  -2.191   1.471
  198   3HG2  THR  30          3HG2      THR  30  -2.926  -3.681   0.542
  199    H    SER  31           H        SER  31  -4.293  -6.743   1.956
  200    HA   SER  31           HA       SER  31  -2.592  -7.366  -0.355
  201   1HB   SER  31          1HB       SER  31  -3.451  -9.737  -0.135
  202   2HB   SER  31          2HB       SER  31  -2.376  -9.219   1.171
  203    HG   SER  31           HG       SER  31  -4.070  -9.070   2.539
  204    H    ALA  32           H        ALA  32  -4.920  -5.623   0.335
  205    HA   ALA  32           HA       ALA  32  -7.282  -6.545  -0.873
  206   1HB   ALA  32          1HB       ALA  32  -6.412  -4.228   0.478
  207   2HB   ALA  32          2HB       ALA  32  -6.985  -3.679  -1.095
  208   3HB   ALA  32          3HB       ALA  32  -8.055  -4.600  -0.040
  209    H    GLY  33           H        GLY  33  -8.083  -6.413  -2.868
  210   1HA   GLY  33          1HA       GLY  33  -8.195  -5.981  -5.123
  211   2HA   GLY  33          2HA       GLY  33  -6.863  -4.853  -4.932
  212    H    ARG  34           H        ARG  34  -5.700  -7.593  -3.570
  213    HA   ARG  34           HA       ARG  34  -4.514  -8.398  -6.135
  214   1HB   ARG  34          1HB       ARG  34  -3.454  -8.909  -3.352
  215   2HB   ARG  34          2HB       ARG  34  -2.650  -9.260  -4.861
  216   1HG   ARG  34          1HG       ARG  34  -3.031  -6.655  -5.223
  217   2HG   ARG  34          2HG       ARG  34  -2.992  -6.690  -3.461
  218   1HD   ARG  34          1HD       ARG  34  -0.764  -6.299  -4.492
  219   2HD   ARG  34          2HD       ARG  34  -0.817  -7.739  -3.468
  220    HE   ARG  34           HE       ARG  34  -0.319  -9.000  -5.301
  221   1HH1  ARG  34          1HH1      ARG  34  -1.632  -5.954  -6.427
  222   2HH1  ARG  34          2HH1      ARG  34  -1.287  -6.278  -8.096
  223   1HH2  ARG  34          1HH2      ARG  34   0.123  -9.416  -7.512
  224   2HH2  ARG  34          2HH2      ARG  34  -0.262  -8.212  -8.704
  225    H    SER  35           H        SER  35  -4.912 -10.317  -6.949
  226    HA   SER  35           HA       SER  35  -6.489 -12.216  -5.376
  227   1HB   SER  35          1HB       SER  35  -5.853 -12.299  -8.337
  228   2HB   SER  35          2HB       SER  35  -7.088 -13.229  -7.483
  229    HG   SER  35           HG       SER  35  -7.120 -10.595  -8.344
  230    H    ASP  36           H        ASP  36  -3.365 -11.659  -5.717
  231    HA   ASP  36           HA       ASP  36  -2.533 -14.421  -6.150
  232   1HB   ASP  36          1HB       ASP  36  -0.196 -13.230  -5.888
  233   2HB   ASP  36          2HB       ASP  36  -1.079 -13.172  -7.404
  234    H    GLY  37           H        GLY  37  -0.946 -12.072  -4.116
  235   1HA   GLY  37          1HA       GLY  37  -1.824 -12.966  -1.648
  236   2HA   GLY  37          2HA       GLY  37  -0.453 -13.965  -2.079
  237    H    LYS  38           H        LYS  38   0.940 -11.712  -3.457
  238    HA   LYS  38           HA       LYS  38   2.500 -10.820  -1.353
  239   1HB   LYS  38          1HB       LYS  38   2.064  -9.447  -4.004
  240   2HB   LYS  38          2HB       LYS  38   3.456  -9.256  -2.945
  241   1HG   LYS  38          1HG       LYS  38   4.282 -10.715  -4.466
  242   2HG   LYS  38          2HG       LYS  38   3.681 -11.841  -3.267
  243   1HD   LYS  38          1HD       LYS  38   1.690 -12.218  -4.579
  244   2HD   LYS  38          2HD       LYS  38   2.180 -10.982  -5.738
  245   1HE   LYS  38          1HE       LYS  38   4.148 -12.331  -6.323
  246   2HE   LYS  38          2HE       LYS  38   3.637 -13.568  -5.174
  247   1HZ   LYS  38          1HZ       LYS  38   1.969 -12.678  -7.462
  248   2HZ   LYS  38          2HZ       LYS  38   3.023 -14.011  -7.536
  249   3HZ   LYS  38          3HZ       LYS  38   1.717 -14.022  -6.447
  250    H    MET  39           H        MET  39   1.982  -9.500   0.270
  251    HA   MET  39           HA       MET  39  -0.221  -7.676   0.049
  252   1HB   MET  39          1HB       MET  39   1.792  -8.080   2.271
  253   2HB   MET  39          2HB       MET  39   0.338  -7.102   2.376
  254   1HG   MET  39          1HG       MET  39  -1.050  -9.053   2.062
  255   2HG   MET  39          2HG       MET  39   0.383 -10.061   1.852
  256   1HE   MET  39          1HE       MET  39   2.261  -9.922   3.388
  257   2HE   MET  39          2HE       MET  39   2.253  -9.159   4.981
  258   3HE   MET  39          3HE       MET  39   1.837 -10.865   4.817
  259    H    TRP  40           H        TRP  40  -0.144  -5.471  -0.040
  260    HA   TRP  40           HA       TRP  40   2.496  -4.250  -0.543
  261   1HB   TRP  40          1HB       TRP  40   1.357  -2.877  -2.282
  262   2HB   TRP  40          2HB       TRP  40   1.375  -4.598  -2.674
  263    HD1  TRP  40           HD1      TRP  40  -1.108  -5.896  -1.940
  264    HE1  TRP  40           1HE      TRP  40  -3.495  -4.983  -2.186
  265    HE3  TRP  40           3HE      TRP  40  -0.036  -0.931  -2.396
  266    HZ2  TRP  40           2HZ      TRP  40  -4.751  -2.501  -2.487
  267    HZ3  TRP  40           3HZ      TRP  40  -1.904   0.648  -2.626
  268    HH2  TRP  40           HH2      TRP  40  -4.206  -0.122  -2.679
  269    H    CYS  41           H        CYS  41   1.728  -1.710  -0.986
  270    HA   CYS  41           HA       CYS  41  -0.003  -0.717   1.105
  271   1HB   CYS  41          1HB       CYS  41   1.794   0.770   2.033
  272   2HB   CYS  41          2HB       CYS  41   2.050  -0.939   2.373
  273    H    ALA  42           H        ALA  42  -0.788   1.360   0.570
  274    HA   ALA  42           HA       ALA  42  -0.379   2.123  -2.165
  275   1HB   ALA  42          1HB       ALA  42  -2.223   2.852  -0.024
  276   2HB   ALA  42          2HB       ALA  42  -1.772   4.201  -1.067
  277   3HB   ALA  42          3HB       ALA  42  -2.486   2.747  -1.764
  278    H    THR  43           H        THR  43   0.466   4.038  -2.965
  279    HA   THR  43           HA       THR  43   2.411   5.294  -1.164
  280    HB   THR  43           HB       THR  43   3.554   6.010  -3.260
  281    HG1  THR  43           1HG      THR  43   2.154   5.997  -4.886
  282   1HG2  THR  43          1HG2      THR  43   3.751   3.406  -4.067
  283   2HG2  THR  43          2HG2      THR  43   4.689   4.160  -2.782
  284   3HG2  THR  43          3HG2      THR  43   3.227   3.254  -2.389
  285    H    THR  44           H        THR  44  -0.562   5.745  -1.808
  286    HA   THR  44           HA       THR  44  -0.413   8.665  -1.799
  287    HB   THR  44           HB       THR  44  -2.488   8.723  -3.219
  288    HG1  THR  44           1HG      THR  44  -3.408   6.837  -3.384
  289   1HG2  THR  44          1HG2      THR  44  -0.948   7.420  -5.199
  290   2HG2  THR  44          2HG2      THR  44  -1.159   9.148  -4.926
  291   3HG2  THR  44          3HG2      THR  44   0.158   8.283  -4.129
  292    H    ALA  45           H        ALA  45  -2.223   9.637  -0.648
  293    HA   ALA  45           HA       ALA  45  -3.038   8.161   1.614
  294   1HB   ALA  45          1HB       ALA  45  -3.196  10.849   0.760
  295   2HB   ALA  45          2HB       ALA  45  -4.829  10.342   1.185
  296   3HB   ALA  45          3HB       ALA  45  -3.526  10.193   2.363
  297    H    ASN  46           H        ASN  46  -4.855   9.179  -1.276
  298    HA   ASN  46           HA       ASN  46  -6.900   7.187  -0.559
  299   1HB   ASN  46          1HB       ASN  46  -7.735   9.523  -0.926
  300   2HB   ASN  46          2HB       ASN  46  -7.142   9.438  -2.580
  301   1HD2  ASN  46          1HD2      ASN  46 -10.711   7.982  -1.605
  302   2HD2  ASN  46          2HD2      ASN  46  -9.723   8.906  -0.536
  303    H    TYR  47           H        TYR  47  -6.238   5.334  -1.377
  304    HA   TYR  47           HA       TYR  47  -4.737   5.155  -3.796
  305   1HB   TYR  47          1HB       TYR  47  -4.445   3.546  -1.931
  306   2HB   TYR  47          2HB       TYR  47  -6.062   2.919  -2.254
  307    HD1  TYR  47           1HD      TYR  47  -2.775   3.487  -3.908
  308    HD2  TYR  47           2HD      TYR  47  -6.347   1.196  -3.778
  309    HE1  TYR  47           1HE      TYR  47  -1.860   1.982  -5.619
  310    HE2  TYR  47           2HE      TYR  47  -5.439  -0.321  -5.480
  311    HH   TYR  47           HH       TYR  47  -2.769  -0.908  -6.215
  312    H    ASP  48           H        ASP  48  -8.124   4.684  -2.963
  313    HA   ASP  48           HA       ASP  48  -9.047   3.275  -5.128
  314   1HB   ASP  48          1HB       ASP  48 -10.340   5.519  -3.598
  315   2HB   ASP  48          2HB       ASP  48 -11.194   4.579  -4.816
  316    H    ASP  49           H        ASP  49  -8.353   6.720  -4.957
  317    HA   ASP  49           HA       ASP  49  -9.323   7.196  -7.629
  318   1HB   ASP  49          1HB       ASP  49  -8.075   8.938  -5.520
  319   2HB   ASP  49          2HB       ASP  49  -8.411   9.536  -7.141
  320    H    ASP  50           H        ASP  50  -6.195   8.100  -6.188
  321    HA   ASP  50           HA       ASP  50  -4.882   8.359  -8.651
  322   1HB   ASP  50          1HB       ASP  50  -3.918   8.170  -5.824
  323   2HB   ASP  50          2HB       ASP  50  -2.762   8.176  -7.153
  324    H    ARG  51           H        ARG  51  -5.357   5.540  -6.682
  325    HA   ARG  51           HA       ARG  51  -4.561   3.444  -6.737
  326   1HB   ARG  51          1HB       ARG  51  -4.957   3.973  -9.655
  327   2HB   ARG  51          2HB       ARG  51  -4.865   2.376  -8.913
  328   1HG   ARG  51          1HG       ARG  51  -6.705   3.573  -7.347
  329   2HG   ARG  51          2HG       ARG  51  -7.041   4.351  -8.894
  330   1HD   ARG  51          1HD       ARG  51  -6.733   1.397  -8.658
  331   2HD   ARG  51          2HD       ARG  51  -8.258   2.194  -8.276
  332    HE   ARG  51           HE       ARG  51  -7.547   3.146 -10.754
  333   1HH1  ARG  51          1HH1      ARG  51  -7.997  -0.040  -9.401
  334   2HH1  ARG  51          2HH1      ARG  51  -8.767  -0.686 -10.818
  335   1HH2  ARG  51          1HH2      ARG  51  -8.525   2.301 -12.642
  336   2HH2  ARG  51          2HH2      ARG  51  -9.090   0.658 -12.658
  337    H    LYS  52           H        LYS  52  -2.430   4.812  -6.194
  338    HA   LYS  52           HA       LYS  52  -0.355   3.634  -7.896
  339   1HB   LYS  52          1HB       LYS  52  -0.303   6.215  -6.317
  340   2HB   LYS  52          2HB       LYS  52   1.142   5.474  -6.999
  341   1HG   LYS  52          1HG       LYS  52   0.604   6.034  -9.118
  342   2HG   LYS  52          2HG       LYS  52  -1.132   5.885  -8.840
  343   1HD   LYS  52          1HD       LYS  52  -1.004   8.012  -7.508
  344   2HD   LYS  52          2HD       LYS  52   0.668   8.178  -8.062
  345   1HE   LYS  52          1HE       LYS  52   0.015   8.390 -10.308
  346   2HE   LYS  52          2HE       LYS  52  -1.613   7.804  -9.978
  347   1HZ   LYS  52          1HZ       LYS  52  -2.047   9.851  -8.741
  348   2HZ   LYS  52          2HZ       LYS  52  -0.483  10.413  -9.088
  349   3HZ   LYS  52          3HZ       LYS  52  -1.608  10.182 -10.343
  350    H    TRP  53           H        TRP  53   0.608   2.019  -6.990
  351    HA   TRP  53           HA       TRP  53   0.728   1.856  -4.063
  352   1HB   TRP  53          1HB       TRP  53   0.066  -0.451  -4.242
  353   2HB   TRP  53          2HB       TRP  53  -1.124   0.579  -4.971
  354    HD1  TRP  53           HD1      TRP  53  -0.637   0.789  -7.892
  355    HE1  TRP  53           1HE      TRP  53  -0.180  -1.232  -9.434
  356    HE3  TRP  53           3HE      TRP  53   0.762  -2.487  -4.357
  357    HZ2  TRP  53           2HZ      TRP  53   0.652  -3.944  -9.129
  358    HZ3  TRP  53           3HZ      TRP  53   1.367  -4.815  -5.004
  359    HH2  TRP  53           HH2      TRP  53   1.311  -5.514  -7.346
  360    H    GLY  54           H        GLY  54   1.947  -0.095  -3.381
  361   1HA   GLY  54          1HA       GLY  54   4.156  -1.013  -4.962
  362   2HA   GLY  54          2HA       GLY  54   4.642   0.099  -3.681
  363    H    PHE  55           H        PHE  55   5.185  -2.812  -3.924
  364    HA   PHE  55           HA       PHE  55   3.518  -4.268  -2.187
  365   1HB   PHE  55          1HB       PHE  55   6.293  -4.639  -3.236
  366   2HB   PHE  55          2HB       PHE  55   5.693  -5.696  -1.972
  367    HD1  PHE  55           1HD      PHE  55   2.814  -5.045  -3.557
  368    HD2  PHE  55           2HD      PHE  55   6.534  -6.953  -4.330
  369    HE1  PHE  55           1HE      PHE  55   1.723  -6.502  -5.216
  370    HE2  PHE  55           2HE      PHE  55   5.454  -8.413  -5.989
  371    HZ   PHE  55           HZ       PHE  55   3.041  -8.182  -6.441
  372    H    CYS  56           H        CYS  56   4.144  -5.218  -0.136
  373    HA   CYS  56           HA       CYS  56   4.790  -3.254   1.815
  374   1HB   CYS  56          1HB       CYS  56   3.351  -5.443   2.012
  375   2HB   CYS  56          2HB       CYS  56   4.896  -6.231   2.304
  376    HA   PRO  57           HA       PRO  57   9.222  -3.384   1.856
  377   1HB   PRO  57          1HB       PRO  57   9.756  -3.227   4.506
  378   2HB   PRO  57          2HB       PRO  57   9.260  -1.849   3.515
  379   1HG   PRO  57          1HG       PRO  57   7.582  -3.672   5.163
  380   2HG   PRO  57          2HG       PRO  57   7.598  -1.897   5.186
  381   1HD   PRO  57          1HD       PRO  57   5.705  -3.143   3.853
  382   2HD   PRO  57          2HD       PRO  57   6.554  -1.794   3.062
  383    H    ASP  58           H        ASP  58  10.315  -4.428   4.479
  384    HA   ASP  58           HA       ASP  58  11.439  -6.779   3.605
  385   1HB   ASP  58          1HB       ASP  58  12.045  -5.394   5.677
  386   2HB   ASP  58          2HB       ASP  58  10.811  -6.323   6.520
  387    H    GLN  59           H        GLN  59  10.414  -8.522   2.894
  388    HA   GLN  59           HA       GLN  59   8.257  -9.648   4.547
  389   1HB   GLN  59          1HB       GLN  59   8.491  -9.673   1.538
  390   2HB   GLN  59          2HB       GLN  59   7.296 -10.588   2.445
  391   1HG   GLN  59          1HG       GLN  59   6.471  -8.410   3.356
  392   2HG   GLN  59          2HG       GLN  59   7.551  -7.601   2.220
  393   1HE2  GLN  59          1HE2      GLN  59   3.949  -8.710   1.040
  394   2HE2  GLN  59          2HE2      GLN  59   4.466  -8.561   2.685
  395    H    GLY  60           H        GLY  60   7.939 -12.058   3.958
  396   1HA   GLY  60          1HA       GLY  60   8.826 -14.179   3.581
  397   2HA   GLY  60          2HA       GLY  60  10.360 -13.430   3.151
  Start of MODEL   12
    1    H    SER   1           1H       SER   1  15.137   7.981   8.853
    2    HA   SER   1           HA       SER   1  16.238   6.505   7.710
    3   1HB   SER   1          1HB       SER   1  13.903   4.636   8.227
    4   2HB   SER   1          2HB       SER   1  15.422   4.158   7.469
    5    HG   SER   1           HG       SER   1  16.139   3.862   9.412
    6    H    TRP   2           H        TRP   2  16.310   5.678   5.527
    7    HA   TRP   2           HA       TRP   2  14.425   7.033   3.780
    8   1HB   TRP   2          1HB       TRP   2  16.955   7.042   3.493
    9   2HB   TRP   2          2HB       TRP   2  16.824   5.359   2.996
   10    HD1  TRP   2           HD1      TRP   2  14.935   5.085   0.795
   11    HE1  TRP   2           1HE      TRP   2  14.909   6.522  -1.342
   12    HE3  TRP   2           3HE      TRP   2  17.499   9.160   2.534
   13    HZ2  TRP   2           2HZ      TRP   2  15.865   9.054  -2.174
   14    HZ3  TRP   2           3HZ      TRP   2  17.905  11.044   1.001
   15    HH2  TRP   2           HH2      TRP   2  17.100  10.988  -1.305
   16    H    MET   3           H        MET   3  12.546   5.791   4.022
   17    HA   MET   3           HA       MET   3  12.692   2.947   3.430
   18   1HB   MET   3          1HB       MET   3  10.390   4.697   4.310
   19   2HB   MET   3          2HB       MET   3  10.258   2.973   4.000
   20   1HG   MET   3          1HG       MET   3  11.923   2.553   5.769
   21   2HG   MET   3          2HG       MET   3  11.964   4.284   6.105
   22   1HE   MET   3          1HE       MET   3   9.288   5.330   5.837
   23   2HE   MET   3          2HE       MET   3   8.236   4.914   7.189
   24   3HE   MET   3          3HE       MET   3   9.840   5.584   7.493
   25    H    SER   4           H        SER   4  12.058   2.012   1.624
   26    HA   SER   4           HA       SER   4  10.637   3.607  -0.404
   27   1HB   SER   4          1HB       SER   4  12.833   1.600  -1.000
   28   2HB   SER   4          2HB       SER   4  12.014   2.654  -2.150
   29    HG   SER   4           HG       SER   4  14.148   3.166  -0.552
   30    H    THR   5           H        THR   5   9.772   1.975  -2.166
   31    HA   THR   5           HA       THR   5   8.614  -0.276  -0.685
   32    HB   THR   5           HB       THR   5   6.852  -0.132  -2.558
   33    HG1  THR   5           1HG      THR   5   7.541   2.572  -2.723
   34   1HG2  THR   5          1HG2      THR   5   6.441   2.344  -1.123
   35   2HG2  THR   5          2HG2      THR   5   5.508   0.847  -1.099
   36   3HG2  THR   5          3HG2      THR   5   6.925   1.019  -0.063
   37    H    VAL   6           H        VAL   6   7.777  -1.993  -2.185
   38    HA   VAL   6           HA       VAL   6   9.652  -2.673  -4.319
   39    HB   VAL   6           HB       VAL   6  10.437  -4.254  -2.887
   40   1HG1  VAL   6          1HG1      VAL   6   9.043  -3.133  -1.022
   41   2HG1  VAL   6          2HG1      VAL   6   7.962  -4.510  -1.237
   42   3HG1  VAL   6          3HG1      VAL   6   9.641  -4.774  -0.772
   43   1HG2  VAL   6          1HG2      VAL   6   9.162  -5.642  -4.422
   44   2HG2  VAL   6          2HG2      VAL   6   9.247  -6.372  -2.818
   45   3HG2  VAL   6          3HG2      VAL   6   7.773  -5.556  -3.336
   46    H    GLY   7           H        GLY   7   8.431  -4.339  -5.818
   47   1HA   GLY   7          1HA       GLY   7   6.452  -4.829  -6.982
   48   2HA   GLY   7          2HA       GLY   7   5.637  -4.619  -5.462
   49    H    GLY   8           H        GLY   8   3.887  -3.589  -6.429
   50   1HA   GLY   8          1HA       GLY   8   2.656  -1.810  -7.187
   51   2HA   GLY   8          2HA       GLY   8   3.790  -0.864  -6.253
   52    H    ASN   9           H        ASN   9   3.835   0.873  -7.582
   53    HA   ASN   9           HA       ASN   9   5.392   0.547 -10.029
   54   1HB   ASN   9          1HB       ASN   9   3.849   2.359 -11.101
   55   2HB   ASN   9          2HB       ASN   9   3.351   0.687 -11.143
   56   1HD2  ASN   9          1HD2      ASN   9   1.355   2.453  -8.162
   57   2HD2  ASN   9          2HD2      ASN   9   3.051   2.143  -8.122
   58    H    SER  10           H        SER  10   5.798   1.505  -7.298
   59    HA   SER  10           HA       SER  10   6.238   4.365  -7.748
   60   1HB   SER  10          1HB       SER  10   6.347   2.866  -5.128
   61   2HB   SER  10          2HB       SER  10   6.182   4.597  -5.386
   62    HG   SER  10           HG       SER  10   4.259   2.664  -5.352
   63    H    GLY  11           H        GLY  11   7.834   1.766  -5.882
   64   1HA   GLY  11          1HA       GLY  11  10.053   1.081  -5.949
   65   2HA   GLY  11          2HA       GLY  11  10.350   2.264  -7.217
   66    H    GLY  12           H        GLY  12  10.217   4.615  -6.411
   67   1HA   GLY  12          1HA       GLY  12  12.000   4.768  -4.106
   68   2HA   GLY  12          2HA       GLY  12  11.668   6.056  -5.253
   69    H    ALA  13           H        ALA  13   8.673   5.208  -4.709
   70    HA   ALA  13           HA       ALA  13   8.318   7.218  -2.659
   71   1HB   ALA  13          1HB       ALA  13   6.299   5.661  -4.263
   72   2HB   ALA  13          2HB       ALA  13   5.904   6.932  -3.105
   73   3HB   ALA  13          3HB       ALA  13   6.837   7.319  -4.548
   74    HA   PRO  14           HA       PRO  14   7.703   4.218   0.557
   75   1HB   PRO  14          1HB       PRO  14   7.320   5.946   2.564
   76   2HB   PRO  14          2HB       PRO  14   8.888   5.817   1.757
   77   1HG   PRO  14          1HG       PRO  14   6.798   7.922   1.514
   78   2HG   PRO  14          2HG       PRO  14   8.561   8.063   1.384
   79   1HD   PRO  14          1HD       PRO  14   6.699   7.881  -0.758
   80   2HD   PRO  14          2HD       PRO  14   8.465   7.799  -0.870
   81    H    CYS  15           H        CYS  15   6.023   3.701   2.282
   82    HA   CYS  15           HA       CYS  15   3.375   3.974   1.147
   83   1HB   CYS  15          1HB       CYS  15   3.818   2.842   3.881
   84   2HB   CYS  15          2HB       CYS  15   2.692   2.329   2.633
   85    H    VAL  16           H        VAL  16   1.651   5.124   2.007
   86    HA   VAL  16           HA       VAL  16   2.325   6.991   4.183
   87    HB   VAL  16           HB       VAL  16   0.360   7.454   1.933
   88   1HG1  VAL  16          1HG1      VAL  16   1.101   9.029   4.351
   89   2HG1  VAL  16          2HG1      VAL  16   0.662   9.875   2.865
   90   3HG1  VAL  16          3HG1      VAL  16  -0.483   8.764   3.619
   91   1HG2  VAL  16          1HG2      VAL  16   3.131   8.523   2.378
   92   2HG2  VAL  16          2HG2      VAL  16   2.548   7.574   1.010
   93   3HG2  VAL  16          3HG2      VAL  16   1.980   9.227   1.242
   94    H    PHE  17           H        PHE  17   1.523   5.601   5.837
   95    HA   PHE  17           HA       PHE  17  -1.279   4.895   5.677
   96   1HB   PHE  17          1HB       PHE  17   0.400   4.367   8.094
   97   2HB   PHE  17          2HB       PHE  17  -1.024   3.529   7.531
   98    HD1  PHE  17           1HD      PHE  17  -0.654   2.488   5.071
   99    HD2  PHE  17           2HD      PHE  17   2.310   3.183   8.017
  100    HE1  PHE  17           1HE      PHE  17   0.709   0.690   4.103
  101    HE2  PHE  17           2HE      PHE  17   3.703   1.388   7.058
  102    HZ   PHE  17           HZ       PHE  17   2.913   0.114   5.087
  103    HA   PRO  18           HA       PRO  18  -2.726   4.305   6.966
  104   1HB   PRO  18          1HB       PRO  18  -5.293   5.450   7.339
  105   2HB   PRO  18          2HB       PRO  18  -4.435   4.372   8.440
  106   1HG   PRO  18          1HG       PRO  18  -5.044   7.063   8.928
  107   2HG   PRO  18          2HG       PRO  18  -3.879   6.077   9.828
  108   1HD   PRO  18          1HD       PRO  18  -3.405   8.089   7.680
  109   2HD   PRO  18          2HD       PRO  18  -2.393   7.669   9.078
  110    H    PHE  19           H        PHE  19  -3.247   3.720   4.880
  111    HA   PHE  19           HA       PHE  19  -4.004   5.930   3.082
  112   1HB   PHE  19          1HB       PHE  19  -3.995   4.111   1.269
  113   2HB   PHE  19          2HB       PHE  19  -2.447   4.640   1.893
  114    HD1  PHE  19           1HD      PHE  19  -1.580   3.097   3.938
  115    HD2  PHE  19           2HD      PHE  19  -4.301   1.917   0.898
  116    HE1  PHE  19           1HE      PHE  19  -0.963   0.737   4.286
  117    HE2  PHE  19           2HE      PHE  19  -3.683  -0.436   1.234
  118    HZ   PHE  19           HZ       PHE  19  -2.015  -1.029   2.943
  119    H    THR  20           H        THR  20  -5.678   4.557   1.285
  120    HA   THR  20           HA       THR  20  -7.675   3.369   3.008
  121    HB   THR  20           HB       THR  20  -8.245   5.950   1.525
  122    HG1  THR  20           1HG      THR  20  -7.258   5.538   3.941
  123   1HG2  THR  20          1HG2      THR  20 -10.153   4.729   3.455
  124   2HG2  THR  20          2HG2      THR  20 -10.440   5.872   2.145
  125   3HG2  THR  20          3HG2      THR  20 -10.136   4.169   1.782
  126    H    PHE  21           H        PHE  21  -8.629   1.869   2.212
  127    HA   PHE  21           HA       PHE  21  -9.097   1.679  -0.576
  128   1HB   PHE  21          1HB       PHE  21  -8.217  -0.331   1.127
  129   2HB   PHE  21          2HB       PHE  21  -9.633  -0.884   0.356
  130    HD1  PHE  21           1HD      PHE  21  -8.020   1.319  -1.830
  131    HD2  PHE  21           2HD      PHE  21  -7.750  -2.553  -0.131
  132    HE1  PHE  21           1HE      PHE  21  -6.886   0.498  -3.845
  133    HE2  PHE  21           2HE      PHE  21  -6.674  -3.405  -2.144
  134    HZ   PHE  21           HZ       PHE  21  -6.191  -1.857  -4.017
  135    H    LEU  22           H        LEU  22 -10.690  -0.244  -0.791
  136    HA   LEU  22           HA       LEU  22 -12.999   0.929  -1.433
  137   1HB   LEU  22          1HB       LEU  22 -12.846  -1.998  -1.018
  138   2HB   LEU  22          2HB       LEU  22 -13.503  -1.121  -2.373
  139    HG   LEU  22           HG       LEU  22 -11.602  -2.075  -3.311
  140   1HD1  LEU  22          1HD1      LEU  22 -11.152   0.654  -2.619
  141   2HD1  LEU  22          2HD1      LEU  22  -9.661  -0.257  -2.859
  142   3HD1  LEU  22          3HD1      LEU  22 -10.882  -0.210  -4.131
  143   1HD2  LEU  22          1HD2      LEU  22 -10.544  -1.944  -0.585
  144   2HD2  LEU  22          2HD2      LEU  22 -10.775  -3.329  -1.655
  145   3HD2  LEU  22          3HD2      LEU  22  -9.460  -2.193  -1.954
  146    H    GLY  23           H        GLY  23 -12.743   1.530   1.174
  147   1HA   GLY  23          1HA       GLY  23 -14.821   1.886   2.487
  148   2HA   GLY  23          2HA       GLY  23 -15.013   0.140   2.453
  149    H    ASN  24           H        ASN  24 -11.719   0.643   2.788
  150    HA   ASN  24           HA       ASN  24 -11.963   0.864   5.695
  151   1HB   ASN  24          1HB       ASN  24 -10.119  -1.131   4.472
  152   2HB   ASN  24          2HB       ASN  24 -10.792  -1.096   6.076
  153   1HD2  ASN  24          1HD2      ASN  24 -12.513  -3.208   3.181
  154   2HD2  ASN  24          2HD2      ASN  24 -10.975  -2.433   3.039
  155    H    LYS  25           H        LYS  25 -10.388   2.015   6.643
  156    HA   LYS  25           HA       LYS  25  -8.338   3.214   5.016
  157   1HB   LYS  25          1HB       LYS  25  -8.526   3.516   7.983
  158   2HB   LYS  25          2HB       LYS  25  -8.128   4.696   6.762
  159   1HG   LYS  25          1HG       LYS  25 -10.438   4.902   6.107
  160   2HG   LYS  25          2HG       LYS  25 -10.888   3.621   7.235
  161   1HD   LYS  25          1HD       LYS  25 -10.263   4.964   9.115
  162   2HD   LYS  25          2HD       LYS  25  -9.570   6.193   8.060
  163   1HE   LYS  25          1HE       LYS  25 -11.722   6.943   8.859
  164   2HE   LYS  25          2HE       LYS  25 -11.815   6.621   7.126
  165   1HZ   LYS  25          1HZ       LYS  25 -12.660   4.314   7.887
  166   2HZ   LYS  25          2HZ       LYS  25 -12.970   5.081   9.373
  167   3HZ   LYS  25          3HZ       LYS  25 -13.716   5.634   7.952
  168    H    TYR  26           H        TYR  26  -6.248   2.390   4.924
  169    HA   TYR  26           HA       TYR  26  -5.675   0.291   6.847
  170   1HB   TYR  26          1HB       TYR  26  -4.328   0.545   4.182
  171   2HB   TYR  26          2HB       TYR  26  -4.297  -0.805   5.297
  172    HD1  TYR  26           1HD      TYR  26  -7.194  -0.996   5.964
  173    HD2  TYR  26           2HD      TYR  26  -5.317  -0.413   2.196
  174    HE1  TYR  26           1HE      TYR  26  -8.977  -2.228   4.917
  175    HE2  TYR  26           2HE      TYR  26  -7.116  -1.633   1.143
  176    HH   TYR  26           HH       TYR  26  -9.101  -3.654   2.539
  177    H    GLU  27           H        GLU  27  -4.559   0.763   8.347
  178    HA   GLU  27           HA       GLU  27  -2.660   2.948   8.400
  179   1HB   GLU  27          1HB       GLU  27  -2.930   1.162  10.736
  180   2HB   GLU  27          2HB       GLU  27  -2.993   2.907  10.644
  181   1HG   GLU  27          1HG       GLU  27  -5.272   2.867   9.915
  182   2HG   GLU  27          2HG       GLU  27  -5.240   1.111   9.795
  183    H    SER  28           H        SER  28  -2.579  -0.357   7.819
  184    HA   SER  28           HA       SER  28   0.329  -0.391   8.050
  185   1HB   SER  28          1HB       SER  28  -0.177  -2.935   8.627
  186   2HB   SER  28          2HB       SER  28  -0.175  -1.716   9.900
  187    HG   SER  28           HG       SER  28  -2.111  -2.492  10.264
  188    H    CYS  29           H        CYS  29   0.930  -2.711   6.795
  189    HA   CYS  29           HA       CYS  29   0.064  -2.232   4.149
  190   1HB   CYS  29          1HB       CYS  29   1.185  -4.884   4.963
  191   2HB   CYS  29          2HB       CYS  29   1.423  -3.996   3.471
  192    H    THR  30           H        THR  30  -1.152  -3.609   2.812
  193    HA   THR  30           HA       THR  30  -3.017  -5.422   4.180
  194    HB   THR  30           HB       THR  30  -4.196  -3.234   3.719
  195    HG1  THR  30           1HG      THR  30  -5.573  -4.890   3.610
  196   1HG2  THR  30          1HG2      THR  30  -4.634  -2.602   1.421
  197   2HG2  THR  30          2HG2      THR  30  -2.908  -2.537   1.774
  198   3HG2  THR  30          3HG2      THR  30  -3.568  -3.884   0.846
  199    H    SER  31           H        SER  31  -4.233  -6.639   2.313
  200    HA   SER  31           HA       SER  31  -2.383  -7.158   0.102
  201   1HB   SER  31          1HB       SER  31  -3.264  -9.640   0.420
  202   2HB   SER  31          2HB       SER  31  -1.870  -9.034   1.335
  203    HG   SER  31           HG       SER  31  -3.264  -8.629   3.086
  204    H    ALA  32           H        ALA  32  -4.896  -5.702   0.777
  205    HA   ALA  32           HA       ALA  32  -7.134  -6.834  -0.505
  206   1HB   ALA  32          1HB       ALA  32  -7.013  -4.818   1.102
  207   2HB   ALA  32          2HB       ALA  32  -6.566  -3.879  -0.325
  208   3HB   ALA  32          3HB       ALA  32  -8.122  -4.699  -0.264
  209    H    GLY  33           H        GLY  33  -8.050  -6.259  -2.568
  210   1HA   GLY  33          1HA       GLY  33  -7.977  -5.734  -4.809
  211   2HA   GLY  33          2HA       GLY  33  -6.578  -4.729  -4.466
  212    H    ARG  34           H        ARG  34  -5.764  -7.636  -3.242
  213    HA   ARG  34           HA       ARG  34  -4.474  -8.490  -5.735
  214   1HB   ARG  34          1HB       ARG  34  -3.533  -8.786  -2.881
  215   2HB   ARG  34          2HB       ARG  34  -2.690  -9.373  -4.295
  216   1HG   ARG  34          1HG       ARG  34  -2.898  -6.798  -4.973
  217   2HG   ARG  34          2HG       ARG  34  -2.905  -6.644  -3.218
  218   1HD   ARG  34          1HD       ARG  34  -0.628  -6.545  -4.248
  219   2HD   ARG  34          2HD       ARG  34  -0.824  -7.814  -3.032
  220    HE   ARG  34           HE       ARG  34  -0.490  -9.389  -4.663
  221   1HH1  ARG  34          1HH1      ARG  34  -1.081  -6.297  -6.181
  222   2HH1  ARG  34          2HH1      ARG  34  -0.864  -6.891  -7.795
  223   1HH2  ARG  34          1HH2      ARG  34  -0.200 -10.181  -6.784
  224   2HH2  ARG  34          2HH2      ARG  34  -0.343  -9.106  -8.138
  225    H    SER  35           H        SER  35  -5.323  -9.785  -2.557
  226    HA   SER  35           HA       SER  35  -6.351 -11.672  -1.865
  227   1HB   SER  35          1HB       SER  35  -7.188 -11.880  -4.758
  228   2HB   SER  35          2HB       SER  35  -7.721 -12.997  -3.501
  229    HG   SER  35           HG       SER  35  -8.757 -11.321  -2.464
  230    H    ASP  36           H        ASP  36  -3.541 -11.660  -3.300
  231    HA   ASP  36           HA       ASP  36  -3.387 -14.554  -3.675
  232   1HB   ASP  36          1HB       ASP  36  -0.944 -13.901  -4.367
  233   2HB   ASP  36          2HB       ASP  36  -2.269 -13.736  -5.498
  234    H    GLY  37           H        GLY  37  -0.834 -12.466  -2.614
  235   1HA   GLY  37          1HA       GLY  37  -0.927 -13.277   0.100
  236   2HA   GLY  37          2HA       GLY  37   0.322 -14.136  -0.781
  237    H    LYS  38           H        LYS  38   0.892 -11.867  -2.543
  238    HA   LYS  38           HA       LYS  38   2.877 -10.598  -1.000
  239   1HB   LYS  38          1HB       LYS  38   1.719  -9.762  -3.661
  240   2HB   LYS  38          2HB       LYS  38   3.293  -9.316  -3.020
  241   1HG   LYS  38          1HG       LYS  38   3.761 -10.973  -4.557
  242   2HG   LYS  38          2HG       LYS  38   3.805 -11.834  -3.031
  243   1HD   LYS  38          1HD       LYS  38   1.563 -12.697  -3.459
  244   2HD   LYS  38          2HD       LYS  38   1.478 -11.777  -4.964
  245   1HE   LYS  38          1HE       LYS  38   3.391 -13.048  -5.833
  246   2HE   LYS  38          2HE       LYS  38   3.458 -13.968  -4.332
  247   1HZ   LYS  38          1HZ       LYS  38   1.138 -13.928  -6.192
  248   2HZ   LYS  38          2HZ       LYS  38   2.311 -15.156  -6.120
  249   3HZ   LYS  38          3HZ       LYS  38   1.288 -14.876  -4.788
  250    H    MET  39           H        MET  39   2.437  -9.145   0.544
  251    HA   MET  39           HA       MET  39   0.049  -7.526   0.403
  252   1HB   MET  39          1HB       MET  39   2.254  -7.588   2.475
  253   2HB   MET  39          2HB       MET  39   0.726  -6.743   2.621
  254   1HG   MET  39          1HG       MET  39  -0.469  -8.855   2.576
  255   2HG   MET  39          2HG       MET  39   1.055  -9.725   2.379
  256   1HE   MET  39          1HE       MET  39  -0.092  -6.727   4.259
  257   2HE   MET  39          2HE       MET  39  -1.087  -7.659   5.377
  258   3HE   MET  39          3HE       MET  39   0.441  -6.965   5.924
  259    H    TRP  40           H        TRP  40   0.004  -5.276   0.434
  260    HA   TRP  40           HA       TRP  40   2.477  -3.939  -0.438
  261   1HB   TRP  40          1HB       TRP  40   1.073  -2.586  -2.012
  262   2HB   TRP  40          2HB       TRP  40   1.150  -4.295  -2.443
  263    HD1  TRP  40           HD1      TRP  40  -1.116  -5.777  -1.657
  264    HE1  TRP  40           1HE      TRP  40  -3.562  -5.050  -1.486
  265    HE3  TRP  40           3HE      TRP  40  -0.475  -0.709  -1.679
  266    HZ2  TRP  40           2HZ      TRP  40  -5.022  -2.684  -1.326
  267    HZ3  TRP  40           3HZ      TRP  40  -2.480   0.728  -1.473
  268    HH2  TRP  40           HH2      TRP  40  -4.739  -0.260  -1.287
  269    H    CYS  41           H        CYS  41   1.671  -1.455  -0.704
  270    HA   CYS  41           HA       CYS  41   0.070  -0.507   1.501
  271   1HB   CYS  41          1HB       CYS  41   1.911   0.855   2.459
  272   2HB   CYS  41          2HB       CYS  41   2.219  -0.871   2.631
  273    H    ALA  42           H        ALA  42  -0.763   1.526   0.963
  274    HA   ALA  42           HA       ALA  42  -0.217   2.411  -1.720
  275   1HB   ALA  42          1HB       ALA  42  -2.482   2.569  -0.751
  276   2HB   ALA  42          2HB       ALA  42  -1.885   3.783   0.380
  277   3HB   ALA  42          3HB       ALA  42  -1.882   4.115  -1.352
  278    H    THR  43           H        THR  43   0.775   4.284  -2.357
  279    HA   THR  43           HA       THR  43   2.629   5.385  -0.383
  280    HB   THR  43           HB       THR  43   3.943   6.103  -2.293
  281    HG1  THR  43           1HG      THR  43   2.011   6.510  -3.631
  282   1HG2  THR  43          1HG2      THR  43   3.242   3.470  -3.345
  283   2HG2  THR  43          2HG2      THR  43   4.775   4.071  -2.712
  284   3HG2  THR  43          3HG2      THR  43   3.528   3.495  -1.606
  285    H    THR  44           H        THR  44  -0.278   6.017  -0.900
  286    HA   THR  44           HA       THR  44  -0.010   8.910  -0.727
  287    HB   THR  44           HB       THR  44  -2.101   9.125  -2.151
  288    HG1  THR  44           1HG      THR  44  -2.996   7.336  -2.739
  289   1HG2  THR  44          1HG2      THR  44  -0.455   8.087  -4.210
  290   2HG2  THR  44          2HG2      THR  44  -0.742   9.769  -3.762
  291   3HG2  THR  44          3HG2      THR  44   0.575   8.868  -3.011
  292    H    ALA  45           H        ALA  45  -1.587   9.852   0.589
  293    HA   ALA  45           HA       ALA  45  -2.532   8.347   2.724
  294   1HB   ALA  45          1HB       ALA  45  -3.156  11.069   1.692
  295   2HB   ALA  45          2HB       ALA  45  -4.161  10.389   2.971
  296   3HB   ALA  45          3HB       ALA  45  -2.428  10.573   3.224
  297    H    ASN  46           H        ASN  46  -4.099   9.029  -0.326
  298    HA   ASN  46           HA       ASN  46  -6.292   7.258   0.475
  299   1HB   ASN  46          1HB       ASN  46  -7.042   9.659   0.251
  300   2HB   ASN  46          2HB       ASN  46  -6.579   9.580  -1.451
  301   1HD2  ASN  46          1HD2      ASN  46 -10.147   8.345  -0.307
  302   2HD2  ASN  46          2HD2      ASN  46  -9.070   9.290   0.652
  303    H    TYR  47           H        TYR  47  -6.273   5.479  -0.715
  304    HA   TYR  47           HA       TYR  47  -4.613   5.405  -3.087
  305   1HB   TYR  47          1HB       TYR  47  -4.492   3.613  -1.361
  306   2HB   TYR  47          2HB       TYR  47  -6.117   3.115  -1.825
  307    HD1  TYR  47           1HD      TYR  47  -6.507   2.297  -4.190
  308    HD2  TYR  47           2HD      TYR  47  -2.627   2.955  -2.603
  309    HE1  TYR  47           1HE      TYR  47  -5.537   0.906  -5.968
  310    HE2  TYR  47           2HE      TYR  47  -1.655   1.568  -4.366
  311    HH   TYR  47           HH       TYR  47  -2.520  -0.346  -5.889
  312    H    ASP  48           H        ASP  48  -8.035   4.827  -2.287
  313    HA   ASP  48           HA       ASP  48  -9.021   3.886  -4.640
  314   1HB   ASP  48          1HB       ASP  48 -10.149   5.709  -2.571
  315   2HB   ASP  48          2HB       ASP  48 -11.049   5.501  -4.072
  316    H    ASP  49           H        ASP  49  -7.946   7.174  -4.060
  317    HA   ASP  49           HA       ASP  49  -8.963   8.054  -6.632
  318   1HB   ASP  49          1HB       ASP  49  -7.612   9.493  -4.360
  319   2HB   ASP  49          2HB       ASP  49  -7.982  10.266  -5.891
  320    H    ASP  50           H        ASP  50  -5.783   8.380  -5.017
  321    HA   ASP  50           HA       ASP  50  -4.469   8.937  -7.475
  322   1HB   ASP  50          1HB       ASP  50  -3.484   8.454  -4.684
  323   2HB   ASP  50          2HB       ASP  50  -2.359   8.643  -6.027
  324    H    ARG  51           H        ARG  51  -5.162   5.941  -5.925
  325    HA   ARG  51           HA       ARG  51  -4.417   3.826  -6.191
  326   1HB   ARG  51          1HB       ARG  51  -4.621   4.794  -9.018
  327   2HB   ARG  51          2HB       ARG  51  -4.540   3.100  -8.542
  328   1HG   ARG  51          1HG       ARG  51  -6.489   4.228  -6.928
  329   2HG   ARG  51          2HG       ARG  51  -6.800   4.869  -8.545
  330   1HD   ARG  51          1HD       ARG  51  -6.404   1.978  -7.846
  331   2HD   ARG  51          2HD       ARG  51  -7.969   2.755  -8.083
  332    HE   ARG  51           HE       ARG  51  -6.123   1.887 -10.116
  333   1HH1  ARG  51          1HH1      ARG  51  -8.796   3.997  -9.350
  334   2HH1  ARG  51          2HH1      ARG  51  -9.195   4.320 -11.006
  335   1HH2  ARG  51          1HH2      ARG  51  -6.701   2.215 -12.294
  336   2HH2  ARG  51          2HH2      ARG  51  -8.035   3.252 -12.688
  337    H    LYS  52           H        LYS  52  -2.233   5.013  -5.346
  338    HA   LYS  52           HA       LYS  52  -0.138   3.935  -7.097
  339   1HB   LYS  52          1HB       LYS  52  -0.105   6.388  -5.342
  340   2HB   LYS  52          2HB       LYS  52   1.389   5.601  -5.844
  341   1HG   LYS  52          1HG       LYS  52   1.131   6.191  -8.041
  342   2HG   LYS  52          2HG       LYS  52  -0.627   6.285  -7.919
  343   1HD   LYS  52          1HD       LYS  52  -0.388   8.354  -6.582
  344   2HD   LYS  52          2HD       LYS  52   1.364   8.260  -6.798
  345   1HE   LYS  52          1HE       LYS  52   0.205   9.812  -8.371
  346   2HE   LYS  52          2HE       LYS  52   1.160   8.555  -9.158
  347   1HZ   LYS  52          1HZ       LYS  52  -1.685   8.018  -8.674
  348   2HZ   LYS  52          2HZ       LYS  52  -1.279   9.097  -9.925
  349   3HZ   LYS  52          3HZ       LYS  52  -0.689   7.502  -9.946
  350    H    TRP  53           H        TRP  53   0.693   2.158  -6.329
  351    HA   TRP  53           HA       TRP  53   0.743   1.754  -3.416
  352   1HB   TRP  53          1HB       TRP  53   0.024  -0.523  -3.791
  353   2HB   TRP  53          2HB       TRP  53  -1.118   0.589  -4.456
  354    HD1  TRP  53           HD1      TRP  53  -0.641   1.015  -7.332
  355    HE1  TRP  53           1HE      TRP  53  -0.232  -0.879  -9.045
  356    HE3  TRP  53           3HE      TRP  53   0.824  -2.528  -4.096
  357    HZ2  TRP  53           2HZ      TRP  53   0.637  -3.590  -8.974
  358    HZ3  TRP  53           3HZ      TRP  53   1.453  -4.783  -4.950
  359    HH2  TRP  53           HH2      TRP  53   1.360  -5.290  -7.343
  360    H    GLY  54           H        GLY  54   1.936  -0.243  -2.848
  361   1HA   GLY  54          1HA       GLY  54   4.145  -1.132  -4.409
  362   2HA   GLY  54          2HA       GLY  54   4.650   0.034  -3.192
  363    H    PHE  55           H        PHE  55   4.888  -2.999  -3.593
  364    HA   PHE  55           HA       PHE  55   3.534  -4.357  -1.571
  365   1HB   PHE  55          1HB       PHE  55   6.138  -4.819  -3.006
  366   2HB   PHE  55          2HB       PHE  55   5.547  -5.931  -1.787
  367    HD1  PHE  55           1HD      PHE  55   2.557  -5.374  -2.704
  368    HD2  PHE  55           2HD      PHE  55   6.128  -6.578  -4.672
  369    HE1  PHE  55           1HE      PHE  55   1.223  -6.605  -4.370
  370    HE2  PHE  55           2HE      PHE  55   4.807  -7.810  -6.336
  371    HZ   PHE  55           HZ       PHE  55   2.347  -7.818  -6.189
  372    H    CYS  56           H        CYS  56   4.399  -5.255   0.397
  373    HA   CYS  56           HA       CYS  56   6.121  -3.338   1.808
  374   1HB   CYS  56          1HB       CYS  56   3.876  -5.119   2.660
  375   2HB   CYS  56          2HB       CYS  56   5.194  -4.880   3.815
  376    HA   PRO  57           HA       PRO  57   9.435  -6.208   2.156
  377   1HB   PRO  57          1HB       PRO  57  10.406  -5.888   4.611
  378   2HB   PRO  57          2HB       PRO  57  10.457  -4.574   3.422
  379   1HG   PRO  57          1HG       PRO  57   8.393  -5.130   5.495
  380   2HG   PRO  57          2HG       PRO  57   9.327  -3.631   5.288
  381   1HD   PRO  57          1HD       PRO  57   6.877  -3.816   4.278
  382   2HD   PRO  57          2HD       PRO  57   8.173  -3.092   3.298
  383    H    ASP  58           H        ASP  58  10.346  -7.449   4.520
  384    HA   ASP  58           HA       ASP  58   9.399  -9.995   4.371
  385   1HB   ASP  58          1HB       ASP  58  11.408  -9.133   5.682
  386   2HB   ASP  58          2HB       ASP  58  10.287  -8.792   6.996
  387    H    GLN  59           H        GLN  59   7.390 -10.685   4.480
  388    HA   GLN  59           HA       GLN  59   5.417  -9.397   6.142
  389   1HB   GLN  59          1HB       GLN  59   5.197 -11.863   4.402
  390   2HB   GLN  59          2HB       GLN  59   3.849 -10.976   5.103
  391   1HG   GLN  59          1HG       GLN  59   4.400  -9.044   3.774
  392   2HG   GLN  59          2HG       GLN  59   5.820  -9.860   3.122
  393   1HE2  GLN  59          1HE2      GLN  59   2.723 -12.041   1.897
  394   2HE2  GLN  59          2HE2      GLN  59   3.351 -12.064   3.507
  395    H    GLY  60           H        GLY  60   7.428 -12.247   6.324
  396   1HA   GLY  60          1HA       GLY  60   7.358 -12.693   8.970
  397   2HA   GLY  60          2HA       GLY  60   5.842 -13.417   8.459
  Start of MODEL   13
    1    H    SER   1           1H       SER   1  17.844   6.092  -1.065
    2    HA   SER   1           HA       SER   1  15.430   6.262  -1.410
    3   1HB   SER   1          1HB       SER   1  15.894   3.562  -2.704
    4   2HB   SER   1          2HB       SER   1  14.330   4.328  -2.419
    5    HG   SER   1           HG       SER   1  15.176   4.578  -4.594
    6    H    TRP   2           H        TRP   2  15.413   6.219   0.806
    7    HA   TRP   2           HA       TRP   2  16.299   3.860   2.236
    8   1HB   TRP   2          1HB       TRP   2  16.720   6.119   3.160
    9   2HB   TRP   2          2HB       TRP   2  14.981   6.370   3.302
   10    HD1  TRP   2           HD1      TRP   2  17.420   3.579   4.528
   11    HE1  TRP   2           1HE      TRP   2  16.823   3.042   6.974
   12    HE3  TRP   2           3HE      TRP   2  13.534   6.847   5.145
   13    HZ2  TRP   2           2HZ      TRP   2  14.935   3.880   8.901
   14    HZ3  TRP   2           3HZ      TRP   2  12.374   6.909   7.316
   15    HH2  TRP   2           HH2      TRP   2  13.064   5.451   9.155
   16    H    MET   3           H        MET   3  13.264   5.719   2.442
   17    HA   MET   3           HA       MET   3  11.865   3.229   3.031
   18   1HB   MET   3          1HB       MET   3   9.919   4.826   3.452
   19   2HB   MET   3          2HB       MET   3  11.244   4.863   4.598
   20   1HG   MET   3          1HG       MET   3  12.043   6.920   3.745
   21   2HG   MET   3          2HG       MET   3  11.017   6.805   2.313
   22   1HE   MET   3          1HE       MET   3  10.919   6.447   6.020
   23   2HE   MET   3          2HE       MET   3   9.825   7.702   6.599
   24   3HE   MET   3          3HE       MET   3   9.181   6.152   6.060
   25    H    SER   4           H        SER   4  11.787   2.273   1.042
   26    HA   SER   4           HA       SER   4  10.104   3.655  -0.939
   27   1HB   SER   4          1HB       SER   4  12.455   1.815  -1.452
   28   2HB   SER   4          2HB       SER   4  11.373   2.440  -2.700
   29    HG   SER   4           HG       SER   4  12.003   4.590  -1.801
   30    H    THR   5           H        THR   5   9.591   1.675  -2.681
   31    HA   THR   5           HA       THR   5   8.364  -0.418  -1.038
   32    HB   THR   5           HB       THR   5   6.573  -0.318  -2.909
   33    HG1  THR   5           1HG      THR   5   7.512   2.346  -3.081
   34   1HG2  THR   5          1HG2      THR   5   6.163   2.157  -1.483
   35   2HG2  THR   5          2HG2      THR   5   5.250   0.649  -1.425
   36   3HG2  THR   5          3HG2      THR   5   6.684   0.852  -0.418
   37    H    VAL   6           H        VAL   6   7.569  -2.220  -2.440
   38    HA   VAL   6           HA       VAL   6   9.411  -2.909  -4.601
   39    HB   VAL   6           HB       VAL   6  10.254  -4.456  -3.175
   40   1HG1  VAL   6          1HG1      VAL   6   8.619  -3.294  -1.353
   41   2HG1  VAL   6          2HG1      VAL   6   8.031  -4.961  -1.338
   42   3HG1  VAL   6          3HG1      VAL   6   9.726  -4.618  -1.002
   43   1HG2  VAL   6          1HG2      VAL   6   7.844  -5.598  -4.268
   44   2HG2  VAL   6          2HG2      VAL   6   9.452  -6.305  -4.089
   45   3HG2  VAL   6          3HG2      VAL   6   8.307  -6.363  -2.747
   46    H    GLY   7           H        GLY   7   8.200  -4.582  -6.072
   47   1HA   GLY   7          1HA       GLY   7   6.186  -5.198  -7.122
   48   2HA   GLY   7          2HA       GLY   7   5.393  -4.841  -5.615
   49    H    GLY   8           H        GLY   8   3.675  -3.777  -6.455
   50   1HA   GLY   8          1HA       GLY   8   2.475  -2.086  -7.459
   51   2HA   GLY   8          2HA       GLY   8   3.561  -1.112  -6.500
   52    H    ASN   9           H        ASN   9   3.868   0.595  -7.751
   53    HA   ASN   9           HA       ASN   9   5.350   0.199 -10.225
   54   1HB   ASN   9          1HB       ASN   9   3.798   2.225 -11.091
   55   2HB   ASN   9          2HB       ASN   9   3.454   0.544 -11.427
   56   1HD2  ASN   9          1HD2      ASN   9   0.946   2.763  -9.281
   57   2HD2  ASN   9          2HD2      ASN   9   2.415   3.366  -9.968
   58    H    SER  10           H        SER  10   4.442   2.214  -7.530
   59    HA   SER  10           HA       SER  10   5.702   4.602  -8.217
   60   1HB   SER  10          1HB       SER  10   5.734   3.504  -5.408
   61   2HB   SER  10          2HB       SER  10   5.583   5.174  -5.936
   62    HG   SER  10           HG       SER  10   3.547   4.524  -5.376
   63    H    GLY  11           H        GLY  11   7.064   2.031  -6.124
   64   1HA   GLY  11          1HA       GLY  11   9.214   1.115  -6.274
   65   2HA   GLY  11          2HA       GLY  11   9.639   2.359  -7.437
   66    H    GLY  12           H        GLY  12  10.376   4.382  -6.694
   67   1HA   GLY  12          1HA       GLY  12  11.842   4.244  -4.250
   68   2HA   GLY  12          2HA       GLY  12  11.744   5.627  -5.327
   69    H    ALA  13           H        ALA  13   8.626   5.170  -4.848
   70    HA   ALA  13           HA       ALA  13   8.497   7.179  -2.774
   71   1HB   ALA  13          1HB       ALA  13   6.718   6.145  -4.838
   72   2HB   ALA  13          2HB       ALA  13   5.898   6.462  -3.310
   73   3HB   ALA  13          3HB       ALA  13   6.801   7.749  -4.111
   74    HA   PRO  14           HA       PRO  14   7.582   4.281   0.461
   75   1HB   PRO  14          1HB       PRO  14   7.088   6.043   2.424
   76   2HB   PRO  14          2HB       PRO  14   8.707   5.826   1.752
   77   1HG   PRO  14          1HG       PRO  14   6.785   8.042   1.366
   78   2HG   PRO  14          2HG       PRO  14   8.552   8.061   1.292
   79   1HD   PRO  14          1HD       PRO  14   6.732   7.965  -0.887
   80   2HD   PRO  14          2HD       PRO  14   8.499   7.831  -0.955
   81    H    CYS  15           H        CYS  15   5.874   3.616   1.905
   82    HA   CYS  15           HA       CYS  15   3.260   4.077   0.774
   83   1HB   CYS  15          1HB       CYS  15   4.166   2.384   3.116
   84   2HB   CYS  15          2HB       CYS  15   2.513   2.433   2.511
   85    H    VAL  16           H        VAL  16   1.658   5.330   1.593
   86    HA   VAL  16           HA       VAL  16   2.303   6.901   3.996
   87    HB   VAL  16           HB       VAL  16   0.273   7.498   1.833
   88   1HG1  VAL  16          1HG1      VAL  16   1.231   9.170   4.152
   89   2HG1  VAL  16          2HG1      VAL  16   0.194   9.744   2.847
   90   3HG1  VAL  16          3HG1      VAL  16  -0.382   8.486   3.945
   91   1HG2  VAL  16          1HG2      VAL  16   2.681   7.612   1.134
   92   2HG2  VAL  16          2HG2      VAL  16   1.782   9.123   0.984
   93   3HG2  VAL  16          3HG2      VAL  16   2.891   8.889   2.333
   94    H    PHE  17           H        PHE  17   1.342   6.205   5.817
   95    HA   PHE  17           HA       PHE  17  -1.302   4.963   5.597
   96   1HB   PHE  17          1HB       PHE  17   0.740   4.787   7.810
   97   2HB   PHE  17          2HB       PHE  17  -0.827   4.008   7.813
   98    HD1  PHE  17           1HD      PHE  17   2.524   3.995   6.433
   99    HD2  PHE  17           2HD      PHE  17  -1.253   2.050   6.459
  100    HE1  PHE  17           1HE      PHE  17   3.544   2.036   5.356
  101    HE2  PHE  17           2HE      PHE  17  -0.254   0.079   5.391
  102    HZ   PHE  17           HZ       PHE  17   2.161   0.045   4.823
  103    HA   PRO  18           HA       PRO  18  -2.824   4.396   6.909
  104   1HB   PRO  18          1HB       PRO  18  -5.442   5.429   7.270
  105   2HB   PRO  18          2HB       PRO  18  -4.523   4.437   8.401
  106   1HG   PRO  18          1HG       PRO  18  -5.261   7.100   8.801
  107   2HG   PRO  18          2HG       PRO  18  -4.006   6.228   9.700
  108   1HD   PRO  18          1HD       PRO  18  -3.732   8.152   7.426
  109   2HD   PRO  18          2HD       PRO  18  -2.670   7.897   8.828
  110    H    PHE  19           H        PHE  19  -3.303   3.725   4.880
  111    HA   PHE  19           HA       PHE  19  -4.319   5.769   3.033
  112   1HB   PHE  19          1HB       PHE  19  -3.549   4.401   1.195
  113   2HB   PHE  19          2HB       PHE  19  -2.223   4.694   2.309
  114    HD1  PHE  19           1HD      PHE  19  -1.669   2.814   3.974
  115    HD2  PHE  19           2HD      PHE  19  -4.059   2.260   0.504
  116    HE1  PHE  19           1HE      PHE  19  -1.223   0.397   4.058
  117    HE2  PHE  19           2HE      PHE  19  -3.622  -0.160   0.573
  118    HZ   PHE  19           HZ       PHE  19  -2.205  -1.096   2.354
  119    H    THR  20           H        THR  20  -6.309   5.650   2.311
  120    HA   THR  20           HA       THR  20  -7.909   3.395   3.198
  121    HB   THR  20           HB       THR  20  -8.700   6.015   1.890
  122    HG1  THR  20           1HG      THR  20  -7.905   6.369   3.949
  123   1HG2  THR  20          1HG2      THR  20 -10.569   4.284   3.448
  124   2HG2  THR  20          2HG2      THR  20 -10.926   5.579   2.302
  125   3HG2  THR  20          3HG2      THR  20 -10.336   4.024   1.719
  126    H    PHE  21           H        PHE  21  -8.499   1.798   2.021
  127    HA   PHE  21           HA       PHE  21  -8.535   2.029  -0.921
  128   1HB   PHE  21          1HB       PHE  21  -6.642   0.594   0.132
  129   2HB   PHE  21          2HB       PHE  21  -7.921  -0.506   0.587
  130    HD1  PHE  21           1HD      PHE  21  -8.339   1.196  -2.608
  131    HD2  PHE  21           2HD      PHE  21  -6.758  -2.226  -0.649
  132    HE1  PHE  21           1HE      PHE  21  -8.111   0.042  -4.766
  133    HE2  PHE  21           2HE      PHE  21  -6.545  -3.385  -2.787
  134    HZ   PHE  21           HZ       PHE  21  -7.212  -2.242  -4.874
  135    H    LEU  22           H        LEU  22 -10.314   1.069  -1.873
  136    HA   LEU  22           HA       LEU  22 -12.515   0.694  -2.062
  137   1HB   LEU  22          1HB       LEU  22 -11.398  -1.487  -0.408
  138   2HB   LEU  22          2HB       LEU  22 -12.945  -1.622  -1.227
  139    HG   LEU  22           HG       LEU  22 -11.807  -2.395  -2.985
  140   1HD1  LEU  22          1HD1      LEU  22 -11.398   0.295  -3.245
  141   2HD1  LEU  22          2HD1      LEU  22  -9.856  -0.485  -3.604
  142   3HD1  LEU  22          3HD1      LEU  22 -11.305  -0.944  -4.497
  143   1HD2  LEU  22          1HD2      LEU  22 -10.172  -2.948  -1.134
  144   2HD2  LEU  22          2HD2      LEU  22  -9.725  -3.173  -2.826
  145   3HD2  LEU  22          3HD2      LEU  22  -9.171  -1.747  -1.949
  146    H    GLY  23           H        GLY  23 -11.963   2.469   0.188
  147   1HA   GLY  23          1HA       GLY  23 -13.579   3.523   1.539
  148   2HA   GLY  23          2HA       GLY  23 -14.458   2.012   1.630
  149    H    ASN  24           H        ASN  24 -11.504   0.903   2.367
  150    HA   ASN  24           HA       ASN  24 -11.966   1.398   5.228
  151   1HB   ASN  24          1HB       ASN  24 -10.482  -0.803   3.798
  152   2HB   ASN  24          2HB       ASN  24 -10.646  -0.673   5.545
  153   1HD2  ASN  24          1HD2      ASN  24 -13.489  -2.377   3.341
  154   2HD2  ASN  24          2HD2      ASN  24 -11.935  -1.915   2.743
  155    H    LYS  25           H        LYS  25 -10.423   2.284   6.520
  156    HA   LYS  25           HA       LYS  25  -8.158   3.533   5.306
  157   1HB   LYS  25          1HB       LYS  25  -8.951   3.286   8.211
  158   2HB   LYS  25          2HB       LYS  25  -7.861   4.452   7.513
  159   1HG   LYS  25          1HG       LYS  25  -9.621   5.566   6.370
  160   2HG   LYS  25          2HG       LYS  25 -10.762   4.289   6.802
  161   1HD   LYS  25          1HD       LYS  25 -10.502   4.853   9.165
  162   2HD   LYS  25          2HD       LYS  25  -9.368   6.138   8.736
  163   1HE   LYS  25          1HE       LYS  25 -11.152   7.236   7.435
  164   2HE   LYS  25          2HE       LYS  25 -12.274   5.968   7.936
  165   1HZ   LYS  25          1HZ       LYS  25 -10.830   7.758   9.819
  166   2HZ   LYS  25          2HZ       LYS  25 -12.421   8.019   9.283
  167   3HZ   LYS  25          3HZ       LYS  25 -12.053   6.638  10.204
  168    H    TYR  26           H        TYR  26  -6.219   2.503   5.049
  169    HA   TYR  26           HA       TYR  26  -5.736   0.133   6.694
  170   1HB   TYR  26          1HB       TYR  26  -4.500   1.008   4.084
  171   2HB   TYR  26          2HB       TYR  26  -4.062  -0.450   4.964
  172    HD1  TYR  26           1HD      TYR  26  -7.339  -0.451   5.678
  173    HD2  TYR  26           2HD      TYR  26  -4.860  -0.741   2.242
  174    HE1  TYR  26           1HE      TYR  26  -9.107  -1.675   4.511
  175    HE2  TYR  26           2HE      TYR  26  -6.621  -1.974   1.069
  176    HH   TYR  26           HH       TYR  26  -8.817  -3.558   2.197
  177    H    GLU  27           H        GLU  27  -4.642   0.475   8.377
  178    HA   GLU  27           HA       GLU  27  -2.683   2.606   8.601
  179   1HB   GLU  27          1HB       GLU  27  -3.746   0.608  10.595
  180   2HB   GLU  27          2HB       GLU  27  -2.675   1.933  10.973
  181   1HG   GLU  27          1HG       GLU  27  -4.323   3.547  10.505
  182   2HG   GLU  27          2HG       GLU  27  -5.360   2.358   9.720
  183    H    SER  28           H        SER  28  -2.804  -0.722   7.987
  184    HA   SER  28           HA       SER  28   0.108  -0.886   8.174
  185   1HB   SER  28          1HB       SER  28  -0.287  -3.366   8.625
  186   2HB   SER  28          2HB       SER  28  -0.642  -2.282   9.961
  187    HG   SER  28           HG       SER  28  -2.830  -2.484   9.525
  188    H    CYS  29           H        CYS  29   0.717  -2.988   6.735
  189    HA   CYS  29           HA       CYS  29  -0.129  -2.310   4.129
  190   1HB   CYS  29          1HB       CYS  29   1.248  -4.838   5.036
  191   2HB   CYS  29          2HB       CYS  29   1.096  -4.289   3.384
  192    H    THR  30           H        THR  30  -1.141  -3.788   2.628
  193    HA   THR  30           HA       THR  30  -3.160  -5.543   3.857
  194    HB   THR  30           HB       THR  30  -4.202  -3.305   3.419
  195    HG1  THR  30           1HG      THR  30  -5.656  -4.873   3.242
  196   1HG2  THR  30          1HG2      THR  30  -4.459  -3.450   0.606
  197   2HG2  THR  30          2HG2      THR  30  -3.749  -2.166   1.581
  198   3HG2  THR  30          3HG2      THR  30  -2.737  -3.484   0.992
  199    H    SER  31           H        SER  31  -4.339  -6.754   2.044
  200    HA   SER  31           HA       SER  31  -2.494  -7.335  -0.170
  201   1HB   SER  31          1HB       SER  31  -3.273  -9.734  -0.008
  202   2HB   SER  31          2HB       SER  31  -2.280  -9.184   1.354
  203    HG   SER  31           HG       SER  31  -3.889  -9.674   2.602
  204    H    ALA  32           H        ALA  32  -4.935  -5.708   0.456
  205    HA   ALA  32           HA       ALA  32  -7.199  -6.669  -0.879
  206   1HB   ALA  32          1HB       ALA  32  -6.271  -4.103   0.213
  207   2HB   ALA  32          2HB       ALA  32  -7.339  -3.931  -1.180
  208   3HB   ALA  32          3HB       ALA  32  -7.882  -4.820   0.241
  209    H    GLY  33           H        GLY  33  -8.002  -6.370  -2.915
  210   1HA   GLY  33          1HA       GLY  33  -7.979  -5.757  -5.153
  211   2HA   GLY  33          2HA       GLY  33  -6.439  -4.952  -4.891
  212    H    ARG  34           H        ARG  34  -5.583  -7.688  -3.573
  213    HA   ARG  34           HA       ARG  34  -4.798  -8.827  -6.159
  214   1HB   ARG  34          1HB       ARG  34  -3.578  -9.776  -3.613
  215   2HB   ARG  34          2HB       ARG  34  -2.914  -9.664  -5.210
  216   1HG   ARG  34          1HG       ARG  34  -2.658  -7.279  -4.978
  217   2HG   ARG  34          2HG       ARG  34  -3.392  -7.362  -3.366
  218   1HD   ARG  34          1HD       ARG  34  -0.914  -7.358  -3.280
  219   2HD   ARG  34          2HD       ARG  34  -1.589  -8.818  -2.600
  220    HE   ARG  34           HE       ARG  34  -0.047  -8.539  -4.991
  221   1HH1  ARG  34          1HH1      ARG  34  -1.851 -10.606  -2.938
  222   2HH1  ARG  34          2HH1      ARG  34  -1.367 -12.032  -3.797
  223   1HH2  ARG  34          1HH2      ARG  34   0.584 -10.247  -6.121
  224   2HH2  ARG  34          2HH2      ARG  34   0.033 -11.834  -5.657
  225    H    SER  35           H        SER  35  -4.124 -11.408  -5.376
  226    HA   SER  35           HA       SER  35  -6.575 -12.536  -4.271
  227   1HB   SER  35          1HB       SER  35  -6.660 -14.141  -6.230
  228   2HB   SER  35          2HB       SER  35  -7.138 -12.477  -6.564
  229    HG   SER  35           HG       SER  35  -5.490 -13.708  -7.981
  230    H    ASP  36           H        ASP  36  -3.132 -12.988  -5.006
  231    HA   ASP  36           HA       ASP  36  -3.351 -15.674  -3.985
  232   1HB   ASP  36          1HB       ASP  36  -0.846 -15.750  -4.484
  233   2HB   ASP  36          2HB       ASP  36  -1.972 -15.755  -5.820
  234    H    GLY  37           H        GLY  37  -0.581 -13.659  -3.321
  235   1HA   GLY  37          1HA       GLY  37  -1.303 -13.762  -0.522
  236   2HA   GLY  37          2HA       GLY  37   0.125 -14.629  -0.989
  237    H    LYS  38           H        LYS  38   0.662 -11.927  -2.863
  238    HA   LYS  38           HA       LYS  38   2.399 -10.915  -0.882
  239   1HB   LYS  38          1HB       LYS  38   1.511  -9.803  -3.539
  240   2HB   LYS  38          2HB       LYS  38   2.817  -9.136  -2.567
  241   1HG   LYS  38          1HG       LYS  38   3.885 -10.458  -4.119
  242   2HG   LYS  38          2HG       LYS  38   3.855 -11.453  -2.679
  243   1HD   LYS  38          1HD       LYS  38   2.023 -12.737  -3.578
  244   2HD   LYS  38          2HD       LYS  38   1.930 -11.677  -4.986
  245   1HE   LYS  38          1HE       LYS  38   4.288 -12.337  -5.527
  246   2HE   LYS  38          2HE       LYS  38   4.181 -13.535  -4.239
  247   1HZ   LYS  38          1HZ       LYS  38   2.435 -13.426  -6.644
  248   2HZ   LYS  38          2HZ       LYS  38   3.721 -14.515  -6.392
  249   3HZ   LYS  38          3HZ       LYS  38   2.341 -14.587  -5.400
  250    H    MET  39           H        MET  39   2.416  -8.857   0.074
  251    HA   MET  39           HA       MET  39  -0.217  -7.595   0.272
  252   1HB   MET  39          1HB       MET  39   1.897  -7.838   2.425
  253   2HB   MET  39          2HB       MET  39   0.387  -6.961   2.556
  254   1HG   MET  39          1HG       MET  39  -0.845  -9.066   2.240
  255   2HG   MET  39          2HG       MET  39   0.696  -9.924   2.233
  256   1HE   MET  39          1HE       MET  39  -0.765 -11.300   3.940
  257   2HE   MET  39          2HE       MET  39  -0.848 -10.918   5.661
  258   3HE   MET  39          3HE       MET  39  -2.001 -10.192   4.541
  259    H    TRP  40           H        TRP  40  -0.211  -5.326   0.324
  260    HA   TRP  40           HA       TRP  40   2.350  -4.005  -0.267
  261   1HB   TRP  40          1HB       TRP  40   1.219  -2.729  -2.062
  262   2HB   TRP  40          2HB       TRP  40   1.257  -4.454  -2.410
  263    HD1  TRP  40           HD1      TRP  40  -1.165  -5.788  -1.790
  264    HE1  TRP  40           1HE      TRP  40  -3.572  -4.927  -2.080
  265    HE3  TRP  40           3HE      TRP  40  -0.197  -0.805  -2.139
  266    HZ2  TRP  40           2HZ      TRP  40  -4.876  -2.457  -2.387
  267    HZ3  TRP  40           3HZ      TRP  40  -2.082   0.751  -2.405
  268    HH2  TRP  40           HH2      TRP  40  -4.375  -0.065  -2.534
  269    H    CYS  41           H        CYS  41   1.488  -1.532  -0.759
  270    HA   CYS  41           HA       CYS  41  -0.466  -0.557   1.061
  271   1HB   CYS  41          1HB       CYS  41   1.304   0.937   2.262
  272   2HB   CYS  41          2HB       CYS  41   1.038  -0.707   2.828
  273    H    ALA  42           H        ALA  42  -1.106   1.498   0.493
  274    HA   ALA  42           HA       ALA  42  -0.276   2.380  -2.078
  275   1HB   ALA  42          1HB       ALA  42  -2.247   3.278  -0.076
  276   2HB   ALA  42          2HB       ALA  42  -1.655   4.501  -1.200
  277   3HB   ALA  42          3HB       ALA  42  -2.423   3.035  -1.815
  278    H    THR  43           H        THR  43   0.791   4.285  -2.657
  279    HA   THR  43           HA       THR  43   2.699   5.176  -0.638
  280    HB   THR  43           HB       THR  43   3.947   6.072  -2.564
  281    HG1  THR  43           1HG      THR  43   2.523   6.595  -4.105
  282   1HG2  THR  43          1HG2      THR  43   3.722   3.635  -3.859
  283   2HG2  THR  43          2HG2      THR  43   4.813   4.013  -2.523
  284   3HG2  THR  43          3HG2      THR  43   3.240   3.285  -2.201
  285    H    THR  44           H        THR  44  -0.221   5.956  -1.117
  286    HA   THR  44           HA       THR  44   0.180   8.823  -0.725
  287    HB   THR  44           HB       THR  44  -1.920   9.228  -2.053
  288    HG1  THR  44           1HG      THR  44  -2.969   7.556  -2.726
  289   1HG2  THR  44          1HG2      THR  44  -0.218   7.985  -4.078
  290   2HG2  THR  44          2HG2      THR  44  -0.761   9.655  -3.911
  291   3HG2  THR  44          3HG2      THR  44   0.628   9.083  -2.985
  292    H    ALA  45           H        ALA  45  -1.703   9.810   0.414
  293    HA   ALA  45           HA       ALA  45  -2.484   8.257   2.636
  294   1HB   ALA  45          1HB       ALA  45  -2.391  10.901   2.177
  295   2HB   ALA  45          2HB       ALA  45  -4.124  10.628   1.994
  296   3HB   ALA  45          3HB       ALA  45  -3.313  10.176   3.493
  297    H    ASN  46           H        ASN  46  -4.067   8.937  -0.416
  298    HA   ASN  46           HA       ASN  46  -6.187   7.059   0.363
  299   1HB   ASN  46          1HB       ASN  46  -7.039   9.430   0.250
  300   2HB   ASN  46          2HB       ASN  46  -6.617   9.442  -1.460
  301   1HD2  ASN  46          1HD2      ASN  46 -10.110   8.019  -0.275
  302   2HD2  ASN  46          2HD2      ASN  46  -9.038   8.940   0.713
  303    H    TYR  47           H        TYR  47  -5.959   5.296  -0.806
  304    HA   TYR  47           HA       TYR  47  -4.385   5.315  -3.209
  305   1HB   TYR  47          1HB       TYR  47  -4.238   3.471  -1.571
  306   2HB   TYR  47          2HB       TYR  47  -5.901   3.031  -1.947
  307    HD1  TYR  47           1HD      TYR  47  -2.637   3.605  -3.673
  308    HD2  TYR  47           2HD      TYR  47  -6.275   1.418  -3.541
  309    HE1  TYR  47           1HE      TYR  47  -1.866   2.218  -5.545
  310    HE2  TYR  47           2HE      TYR  47  -5.512   0.028  -5.408
  311    HH   TYR  47           HH       TYR  47  -2.473  -0.253  -6.370
  312    H    ASP  48           H        ASP  48  -7.813   5.097  -2.462
  313    HA   ASP  48           HA       ASP  48  -8.746   4.029  -4.840
  314   1HB   ASP  48          1HB       ASP  48  -9.956   5.876  -2.824
  315   2HB   ASP  48          2HB       ASP  48 -10.830   5.492  -4.303
  316    H    ASP  49           H        ASP  49  -7.776   7.313  -4.119
  317    HA   ASP  49           HA       ASP  49  -8.715   8.271  -6.688
  318   1HB   ASP  49          1HB       ASP  49  -7.541   9.572  -4.263
  319   2HB   ASP  49          2HB       ASP  49  -7.520  10.429  -5.796
  320    H    ASP  50           H        ASP  50  -5.581   8.455  -5.007
  321    HA   ASP  50           HA       ASP  50  -4.144   9.127  -7.342
  322   1HB   ASP  50          1HB       ASP  50  -3.422   8.395  -4.550
  323   2HB   ASP  50          2HB       ASP  50  -2.160   8.342  -5.776
  324    H    ARG  51           H        ARG  51  -5.020   6.036  -6.043
  325    HA   ARG  51           HA       ARG  51  -4.377   3.922  -6.489
  326   1HB   ARG  51          1HB       ARG  51  -4.729   5.069  -9.233
  327   2HB   ARG  51          2HB       ARG  51  -4.721   3.346  -8.859
  328   1HG   ARG  51          1HG       ARG  51  -6.454   4.439  -7.024
  329   2HG   ARG  51          2HG       ARG  51  -6.828   5.287  -8.533
  330   1HD   ARG  51          1HD       ARG  51  -6.694   2.310  -8.144
  331   2HD   ARG  51          2HD       ARG  51  -8.171   3.273  -8.203
  332    HE   ARG  51           HE       ARG  51  -6.661   3.712 -10.547
  333   1HH1  ARG  51          1HH1      ARG  51  -8.555   1.232  -8.988
  334   2HH1  ARG  51          2HH1      ARG  51  -9.049   0.484 -10.473
  335   1HH2  ARG  51          1HH2      ARG  51  -7.233   2.697 -12.504
  336   2HH2  ARG  51          2HH2      ARG  51  -8.286   1.310 -12.478
  337    H    LYS  52           H        LYS  52  -2.117   5.041  -5.741
  338    HA   LYS  52           HA       LYS  52  -0.158   3.842  -7.563
  339   1HB   LYS  52          1HB       LYS  52   0.083   6.349  -5.895
  340   2HB   LYS  52          2HB       LYS  52   1.509   5.453  -6.395
  341   1HG   LYS  52          1HG       LYS  52   0.952   5.779  -8.727
  342   2HG   LYS  52          2HG       LYS  52  -0.552   6.584  -8.277
  343   1HD   LYS  52          1HD       LYS  52   2.129   7.595  -7.381
  344   2HD   LYS  52          2HD       LYS  52   1.423   8.066  -8.929
  345   1HE   LYS  52          1HE       LYS  52   0.181   8.467  -6.205
  346   2HE   LYS  52          2HE       LYS  52   0.939   9.717  -7.194
  347   1HZ   LYS  52          1HZ       LYS  52  -1.484   8.154  -7.939
  348   2HZ   LYS  52          2HZ       LYS  52  -1.477   9.764  -7.400
  349   3HZ   LYS  52          3HZ       LYS  52  -0.759   9.359  -8.883
  350    H    TRP  53           H        TRP  53   0.727   2.095  -6.721
  351    HA   TRP  53           HA       TRP  53   0.775   1.840  -3.801
  352   1HB   TRP  53          1HB       TRP  53  -0.082  -0.406  -3.997
  353   2HB   TRP  53          2HB       TRP  53  -1.183   0.725  -4.714
  354    HD1  TRP  53           HD1      TRP  53  -0.731   0.917  -7.619
  355    HE1  TRP  53           1HE      TRP  53  -0.463  -1.106  -9.193
  356    HE3  TRP  53           3HE      TRP  53   0.529  -2.471  -4.158
  357    HZ2  TRP  53           2HZ      TRP  53   0.206  -3.877  -8.940
  358    HZ3  TRP  53           3HZ      TRP  53   0.977  -4.825  -4.842
  359    HH2  TRP  53           HH2      TRP  53   0.817  -5.501  -7.187
  360    H    GLY  54           H        GLY  54   1.851  -0.185  -3.130
  361   1HA   GLY  54          1HA       GLY  54   3.931  -1.326  -4.707
  362   2HA   GLY  54          2HA       GLY  54   4.563  -0.148  -3.560
  363    H    PHE  55           H        PHE  55   4.688  -3.170  -3.748
  364    HA   PHE  55           HA       PHE  55   3.210  -4.383  -1.748
  365   1HB   PHE  55          1HB       PHE  55   5.924  -4.984  -2.908
  366   2HB   PHE  55          2HB       PHE  55   5.196  -6.001  -1.683
  367    HD1  PHE  55           1HD      PHE  55   2.337  -5.649  -2.720
  368    HD2  PHE  55           2HD      PHE  55   5.991  -6.636  -4.663
  369    HE1  PHE  55           1HE      PHE  55   1.077  -6.923  -4.402
  370    HE2  PHE  55           2HE      PHE  55   4.735  -7.912  -6.360
  371    HZ   PHE  55           HZ       PHE  55   2.280  -8.047  -6.236
  372    H    CYS  56           H        CYS  56   3.793  -5.063   0.340
  373    HA   CYS  56           HA       CYS  56   4.679  -3.046   2.060
  374   1HB   CYS  56          1HB       CYS  56   3.246  -5.188   2.500
  375   2HB   CYS  56          2HB       CYS  56   4.798  -5.959   2.800
  376    HA   PRO  57           HA       PRO  57   9.067  -3.485   1.633
  377   1HB   PRO  57          1HB       PRO  57   9.894  -1.919   3.601
  378   2HB   PRO  57          2HB       PRO  57   9.096  -1.250   2.168
  379   1HG   PRO  57          1HG       PRO  57   7.900  -2.006   4.792
  380   2HG   PRO  57          2HG       PRO  57   7.765  -0.449   3.955
  381   1HD   PRO  57          1HD       PRO  57   5.828  -2.280   3.784
  382   2HD   PRO  57          2HD       PRO  57   6.294  -1.331   2.354
  383    H    ASP  58           H        ASP  58   7.308  -4.896   3.788
  384    HA   ASP  58           HA       ASP  58   9.557  -6.349   4.974
  385   1HB   ASP  58          1HB       ASP  58   8.530  -4.720   6.630
  386   2HB   ASP  58          2HB       ASP  58   7.064  -5.697   6.545
  387    H    GLN  59           H        GLN  59   9.406  -8.240   3.963
  388    HA   GLN  59           HA       GLN  59   6.800  -9.616   4.012
  389   1HB   GLN  59          1HB       GLN  59   8.888  -9.762   1.827
  390   2HB   GLN  59          2HB       GLN  59   7.408 -10.708   1.881
  391   1HG   GLN  59          1HG       GLN  59   6.113  -8.616   1.770
  392   2HG   GLN  59          2HG       GLN  59   7.623  -7.717   1.634
  393   1HE2  GLN  59          1HE2      GLN  59   5.886  -9.099  -1.633
  394   2HE2  GLN  59          2HE2      GLN  59   5.125  -8.930  -0.090
  395    H    GLY  60           H        GLY  60   8.462  -9.888   6.115
  396   1HA   GLY  60          1HA       GLY  60   9.682 -12.545   5.681
  397   2HA   GLY  60          2HA       GLY  60  10.353 -11.353   6.784
  Start of MODEL   14
    1    H    SER   1           1H       SER   1  14.061   9.829   1.205
    2    HA   SER   1           HA       SER   1  12.939  10.234   3.892
    3   1HB   SER   1          1HB       SER   1  11.431  10.098   1.871
    4   2HB   SER   1          2HB       SER   1  12.064   8.479   1.577
    5    HG   SER   1           HG       SER   1  10.419   9.408   3.669
    6    H    TRP   2           H        TRP   2  12.430   7.978   4.832
    7    HA   TRP   2           HA       TRP   2  14.858   6.663   5.404
    8   1HB   TRP   2          1HB       TRP   2  13.027   6.784   7.008
    9   2HB   TRP   2          2HB       TRP   2  11.989   5.848   5.940
   10    HD1  TRP   2           HD1      TRP   2  15.553   5.147   7.321
   11    HE1  TRP   2           1HE      TRP   2  15.532   2.795   8.363
   12    HE3  TRP   2           3HE      TRP   2  10.643   3.964   6.537
   13    HZ2  TRP   2           2HZ      TRP   2  13.678   0.711   8.787
   14    HZ3  TRP   2           3HZ      TRP   2   9.822   1.769   7.288
   15    HH2  TRP   2           HH2      TRP   2  11.315   0.177   8.392
   16    H    MET   3           H        MET   3  11.985   4.972   4.148
   17    HA   MET   3           HA       MET   3  13.746   3.608   2.243
   18   1HB   MET   3          1HB       MET   3  11.638   2.416   4.038
   19   2HB   MET   3          2HB       MET   3  12.300   1.576   2.650
   20   1HG   MET   3          1HG       MET   3  14.566   1.862   3.671
   21   2HG   MET   3          2HG       MET   3  13.754   2.459   5.120
   22   1HE   MET   3          1HE       MET   3  13.399  -0.040   2.444
   23   2HE   MET   3          2HE       MET   3  14.063  -1.489   3.193
   24   3HE   MET   3          3HE       MET   3  12.320  -1.226   3.187
   25    H    SER   4           H        SER   4  12.165   2.166   0.798
   26    HA   SER   4           HA       SER   4   9.937   3.866  -0.081
   27   1HB   SER   4          1HB       SER   4  11.956   4.113  -1.576
   28   2HB   SER   4          2HB       SER   4  11.826   2.395  -1.947
   29    HG   SER   4           HG       SER   4   9.732   4.274  -2.370
   30    H    THR   5           H        THR   5   8.880   2.260  -2.022
   31    HA   THR   5           HA       THR   5   8.103  -0.115  -0.488
   32    HB   THR   5           HB       THR   5   6.096  -0.082  -1.950
   33    HG1  THR   5           1HG      THR   5   7.457   1.379  -3.508
   34   1HG2  THR   5          1HG2      THR   5   5.917   2.646  -1.086
   35   2HG2  THR   5          2HG2      THR   5   5.034   1.223  -0.533
   36   3HG2  THR   5          3HG2      THR   5   6.607   1.615   0.165
   37    H    VAL   6           H        VAL   6   7.503  -2.019  -1.705
   38    HA   VAL   6           HA       VAL   6   9.376  -2.599  -3.905
   39    HB   VAL   6           HB       VAL   6   7.677  -4.803  -3.062
   40   1HG1  VAL   6          1HG1      VAL   6   9.925  -4.724  -4.346
   41   2HG1  VAL   6          2HG1      VAL   6  10.637  -4.749  -2.730
   42   3HG1  VAL   6          3HG1      VAL   6   9.585  -6.066  -3.249
   43   1HG2  VAL   6          1HG2      VAL   6   7.769  -3.586  -0.900
   44   2HG2  VAL   6          2HG2      VAL   6   8.493  -5.195  -0.857
   45   3HG2  VAL   6          3HG2      VAL   6   9.523  -3.767  -0.928
   46    H    GLY   7           H        GLY   7   7.984  -4.559  -5.174
   47   1HA   GLY   7          1HA       GLY   7   6.464  -4.705  -6.942
   48   2HA   GLY   7          2HA       GLY   7   5.344  -4.429  -5.650
   49    H    GLY   8           H        GLY   8   3.919  -3.101  -6.147
   50   1HA   GLY   8          1HA       GLY   8   2.766  -1.405  -7.154
   51   2HA   GLY   8          2HA       GLY   8   3.946  -0.476  -6.266
   52    H    ASN   9           H        ASN   9   4.026   1.213  -7.576
   53    HA   ASN   9           HA       ASN   9   5.677   1.039  -9.904
   54   1HB   ASN   9          1HB       ASN   9   4.080   2.064 -11.476
   55   2HB   ASN   9          2HB       ASN   9   3.579   0.464 -10.975
   56   1HD2  ASN   9          1HD2      ASN   9   1.307   2.816  -8.780
   57   2HD2  ASN   9          2HD2      ASN   9   2.941   2.374  -8.434
   58    H    SER  10           H        SER  10   5.751   2.300  -7.345
   59    HA   SER  10           HA       SER  10   5.166   5.078  -7.651
   60   1HB   SER  10          1HB       SER  10   6.648   5.095  -5.495
   61   2HB   SER  10          2HB       SER  10   5.038   4.386  -5.436
   62    HG   SER  10           HG       SER  10   6.307   2.856  -4.550
   63    H    GLY  11           H        GLY  11   8.173   3.206  -7.354
   64   1HA   GLY  11          1HA       GLY  11  10.029   3.606  -8.850
   65   2HA   GLY  11          2HA       GLY  11   9.527   5.289  -8.936
   66    H    GLY  12           H        GLY  12   9.107   5.828  -6.268
   67   1HA   GLY  12          1HA       GLY  12  11.312   5.073  -4.622
   68   2HA   GLY  12          2HA       GLY  12  11.583   6.645  -5.362
   69    H    ALA  13           H        ALA  13   8.525   5.246  -4.282
   70    HA   ALA  13           HA       ALA  13   8.288   7.445  -2.332
   71   1HB   ALA  13          1HB       ALA  13   6.751   7.291  -4.452
   72   2HB   ALA  13          2HB       ALA  13   5.903   6.076  -3.496
   73   3HB   ALA  13          3HB       ALA  13   6.063   7.724  -2.886
   74    HA   PRO  14           HA       PRO  14   7.631   4.156   0.616
   75   1HB   PRO  14          1HB       PRO  14   7.200   5.650   2.777
   76   2HB   PRO  14          2HB       PRO  14   8.766   5.675   1.965
   77   1HG   PRO  14          1HG       PRO  14   6.584   7.696   1.929
   78   2HG   PRO  14          2HG       PRO  14   8.338   7.934   1.833
   79   1HD   PRO  14          1HD       PRO  14   6.495   7.890  -0.321
   80   2HD   PRO  14          2HD       PRO  14   8.266   7.909  -0.430
   81    H    CYS  15           H        CYS  15   5.970   3.582   2.396
   82    HA   CYS  15           HA       CYS  15   3.342   3.707   1.200
   83   1HB   CYS  15          1HB       CYS  15   3.890   2.651   3.973
   84   2HB   CYS  15          2HB       CYS  15   2.674   2.130   2.818
   85    H    VAL  16           H        VAL  16   1.823   5.221   1.647
   86    HA   VAL  16           HA       VAL  16   2.307   7.047   3.887
   87    HB   VAL  16           HB       VAL  16   0.312   7.268   1.615
   88   1HG1  VAL  16          1HG1      VAL  16   0.358   8.578   4.116
   89   2HG1  VAL  16          2HG1      VAL  16   0.888   9.748   2.907
   90   3HG1  VAL  16          3HG1      VAL  16  -0.663   8.930   2.721
   91   1HG2  VAL  16          1HG2      VAL  16   3.091   7.796   1.711
   92   2HG2  VAL  16          2HG2      VAL  16   1.956   8.131   0.401
   93   3HG2  VAL  16          3HG2      VAL  16   2.255   9.344   1.650
   94    H    PHE  17           H        PHE  17   1.489   6.304   5.751
   95    HA   PHE  17           HA       PHE  17  -1.128   4.987   5.715
   96   1HB   PHE  17          1HB       PHE  17   1.086   5.029   7.769
   97   2HB   PHE  17          2HB       PHE  17  -0.487   4.317   8.059
   98    HD1  PHE  17           1HD      PHE  17  -0.191   3.568   4.813
   99    HD2  PHE  17           2HD      PHE  17   1.741   2.653   8.480
  100    HE1  PHE  17           1HE      PHE  17   0.617   1.461   3.856
  101    HE2  PHE  17           2HE      PHE  17   2.573   0.543   7.533
  102    HZ   PHE  17           HZ       PHE  17   2.023  -0.078   5.197
  103    HA   PRO  18           HA       PRO  18  -2.689   4.552   6.839
  104   1HB   PRO  18          1HB       PRO  18  -5.309   5.538   7.179
  105   2HB   PRO  18          2HB       PRO  18  -4.362   4.631   8.358
  106   1HG   PRO  18          1HG       PRO  18  -5.171   7.306   8.599
  107   2HG   PRO  18          2HG       PRO  18  -3.943   6.492   9.583
  108   1HD   PRO  18          1HD       PRO  18  -3.595   8.301   7.231
  109   2HD   PRO  18          2HD       PRO  18  -2.580   8.116   8.676
  110    H    PHE  19           H        PHE  19  -3.154   3.856   4.838
  111    HA   PHE  19           HA       PHE  19  -4.135   5.862   2.921
  112   1HB   PHE  19          1HB       PHE  19  -3.397   4.405   1.140
  113   2HB   PHE  19          2HB       PHE  19  -2.070   4.708   2.251
  114    HD1  PHE  19           1HD      PHE  19  -1.669   2.860   4.051
  115    HD2  PHE  19           2HD      PHE  19  -3.869   2.261   0.460
  116    HE1  PHE  19           1HE      PHE  19  -1.239   0.436   4.181
  117    HE2  PHE  19           2HE      PHE  19  -3.440  -0.146   0.585
  118    HZ   PHE  19           HZ       PHE  19  -2.116  -1.067   2.449
  119    H    THR  20           H        THR  20  -6.117   5.713   2.082
  120    HA   THR  20           HA       THR  20  -7.755   3.505   3.068
  121    HB   THR  20           HB       THR  20  -8.603   6.091   1.723
  122    HG1  THR  20           1HG      THR  20  -7.810   6.765   3.594
  123   1HG2  THR  20          1HG2      THR  20 -10.701   5.522   3.186
  124   2HG2  THR  20          2HG2      THR  20 -10.516   4.875   1.557
  125   3HG2  THR  20          3HG2      THR  20 -10.137   3.866   2.957
  126    H    PHE  21           H        PHE  21  -8.333   1.915   1.894
  127    HA   PHE  21           HA       PHE  21  -8.447   2.159  -1.051
  128   1HB   PHE  21          1HB       PHE  21  -6.471   0.814  -0.097
  129   2HB   PHE  21          2HB       PHE  21  -7.673  -0.306   0.481
  130    HD1  PHE  21           1HD      PHE  21  -7.486   1.405  -2.839
  131    HD2  PHE  21           2HD      PHE  21  -7.409  -2.240  -0.662
  132    HE1  PHE  21           1HE      PHE  21  -7.301   0.156  -4.931
  133    HE2  PHE  21           2HE      PHE  21  -7.219  -3.495  -2.747
  134    HZ   PHE  21           HZ       PHE  21  -7.153  -2.302  -4.907
  135    H    LEU  22           H        LEU  22 -10.184   1.145  -1.981
  136    HA   LEU  22           HA       LEU  22 -12.289   0.404  -2.160
  137   1HB   LEU  22          1HB       LEU  22 -10.693  -1.448  -0.529
  138   2HB   LEU  22          2HB       LEU  22 -12.365  -1.862  -0.853
  139    HG   LEU  22           HG       LEU  22 -11.908  -2.032  -3.150
  140   1HD1  LEU  22          1HD1      LEU  22 -10.713  -0.054  -3.484
  141   2HD1  LEU  22          2HD1      LEU  22  -9.292  -0.833  -2.783
  142   3HD1  LEU  22          3HD1      LEU  22  -9.977  -1.443  -4.287
  143   1HD2  LEU  22          1HD2      LEU  22 -10.905  -3.785  -1.538
  144   2HD2  LEU  22          2HD2      LEU  22 -10.561  -3.856  -3.267
  145   3HD2  LEU  22          3HD2      LEU  22  -9.386  -3.140  -2.164
  146    H    GLY  23           H        GLY  23 -11.929   2.403  -0.070
  147   1HA   GLY  23          1HA       GLY  23 -13.505   3.443   1.290
  148   2HA   GLY  23          2HA       GLY  23 -14.420   1.948   1.340
  149    H    ASN  24           H        ASN  24 -11.312   1.068   2.148
  150    HA   ASN  24           HA       ASN  24 -11.930   1.410   5.008
  151   1HB   ASN  24          1HB       ASN  24 -10.349  -0.767   3.642
  152   2HB   ASN  24          2HB       ASN  24 -10.730  -0.685   5.353
  153   1HD2  ASN  24          1HD2      ASN  24 -13.271  -2.351   2.814
  154   2HD2  ASN  24          2HD2      ASN  24 -11.634  -1.952   2.453
  155    H    LYS  25           H        LYS  25 -10.433   2.210   6.378
  156    HA   LYS  25           HA       LYS  25  -8.149   3.573   5.348
  157   1HB   LYS  25          1HB       LYS  25  -9.111   3.055   8.168
  158   2HB   LYS  25          2HB       LYS  25  -7.889   4.204   7.698
  159   1HG   LYS  25          1HG       LYS  25  -9.457   5.609   6.634
  160   2HG   LYS  25          2HG       LYS  25 -10.704   4.361   6.697
  161   1HD   LYS  25          1HD       LYS  25 -11.030   6.142   8.394
  162   2HD   LYS  25          2HD       LYS  25 -10.844   4.531   9.091
  163   1HE   LYS  25          1HE       LYS  25  -9.571   6.080  10.405
  164   2HE   LYS  25          2HE       LYS  25  -8.448   5.049   9.522
  165   1HZ   LYS  25          1HZ       LYS  25  -8.512   6.994   7.815
  166   2HZ   LYS  25          2HZ       LYS  25  -9.055   7.905   9.140
  167   3HZ   LYS  25          3HZ       LYS  25  -7.551   7.126   9.209
  168    H    TYR  26           H        TYR  26  -6.086   2.687   5.191
  169    HA   TYR  26           HA       TYR  26  -5.633   0.274   6.796
  170   1HB   TYR  26          1HB       TYR  26  -4.292   1.055   4.212
  171   2HB   TYR  26          2HB       TYR  26  -4.019  -0.419   5.126
  172    HD1  TYR  26           1HD      TYR  26  -7.086  -0.723   5.803
  173    HD2  TYR  26           2HD      TYR  26  -4.886  -0.135   2.227
  174    HE1  TYR  26           1HE      TYR  26  -8.846  -1.857   4.532
  175    HE2  TYR  26           2HE      TYR  26  -6.634  -1.258   0.955
  176    HH   TYR  26           HH       TYR  26  -9.337  -1.588   1.457
  177    H    GLU  27           H        GLU  27  -4.523   0.665   8.456
  178    HA   GLU  27           HA       GLU  27  -2.578   2.823   8.572
  179   1HB   GLU  27          1HB       GLU  27  -3.763   0.999  10.651
  180   2HB   GLU  27          2HB       GLU  27  -2.596   2.250  10.995
  181   1HG   GLU  27          1HG       GLU  27  -4.095   3.962  10.541
  182   2HG   GLU  27          2HG       GLU  27  -5.136   2.908   9.580
  183    H    SER  28           H        SER  28  -2.633  -0.370   7.820
  184    HA   SER  28           HA       SER  28   0.232  -0.660   8.239
  185   1HB   SER  28          1HB       SER  28  -0.306  -3.114   8.732
  186   2HB   SER  28          2HB       SER  28  -0.658  -1.970  10.022
  187    HG   SER  28           HG       SER  28  -2.416  -3.370   8.323
  188    H    CYS  29           H        CYS  29   0.611  -3.053   6.934
  189    HA   CYS  29           HA       CYS  29  -0.019  -2.363   4.240
  190   1HB   CYS  29          1HB       CYS  29   1.080  -4.932   5.381
  191   2HB   CYS  29          2HB       CYS  29   0.924  -4.593   3.674
  192    H    THR  30           H        THR  30  -1.127  -3.879   2.811
  193    HA   THR  30           HA       THR  30  -3.288  -5.393   4.073
  194    HB   THR  30           HB       THR  30  -4.177  -3.094   3.609
  195    HG1  THR  30           1HG      THR  30  -5.732  -4.602   3.469
  196   1HG2  THR  30          1HG2      THR  30  -4.622  -2.599   1.164
  197   2HG2  THR  30          2HG2      THR  30  -2.983  -2.321   1.751
  198   3HG2  THR  30          3HG2      THR  30  -3.344  -3.763   0.805
  199    H    SER  31           H        SER  31  -4.517  -6.599   2.354
  200    HA   SER  31           HA       SER  31  -2.733  -7.364   0.142
  201   1HB   SER  31          1HB       SER  31  -3.754  -9.697   0.437
  202   2HB   SER  31          2HB       SER  31  -2.617  -9.173   1.694
  203    HG   SER  31           HG       SER  31  -4.928 -10.095   2.206
  204    H    ALA  32           H        ALA  32  -5.111  -5.577   0.712
  205    HA   ALA  32           HA       ALA  32  -7.421  -6.469  -0.589
  206   1HB   ALA  32          1HB       ALA  32  -7.355  -4.459   0.836
  207   2HB   ALA  32          2HB       ALA  32  -6.331  -3.654  -0.356
  208   3HB   ALA  32          3HB       ALA  32  -7.992  -4.079  -0.765
  209    H    GLY  33           H        GLY  33  -8.112  -6.458  -2.652
  210   1HA   GLY  33          1HA       GLY  33  -8.080  -6.152  -4.942
  211   2HA   GLY  33          2HA       GLY  33  -6.718  -5.054  -4.740
  212    H    ARG  34           H        ARG  34  -5.667  -7.598  -3.098
  213    HA   ARG  34           HA       ARG  34  -4.449  -8.821  -5.477
  214   1HB   ARG  34          1HB       ARG  34  -3.384  -8.743  -2.649
  215   2HB   ARG  34          2HB       ARG  34  -2.577  -9.407  -4.048
  216   1HG   ARG  34          1HG       ARG  34  -2.893  -6.929  -4.945
  217   2HG   ARG  34          2HG       ARG  34  -2.910  -6.596  -3.211
  218   1HD   ARG  34          1HD       ARG  34  -0.644  -6.455  -4.143
  219   2HD   ARG  34          2HD       ARG  34  -0.782  -7.747  -2.950
  220    HE   ARG  34           HE       ARG  34  -0.348  -9.287  -4.579
  221   1HH1  ARG  34          1HH1      ARG  34  -1.108  -6.204  -6.071
  222   2HH1  ARG  34          2HH1      ARG  34  -0.732  -6.750  -7.676
  223   1HH2  ARG  34          1HH2      ARG  34   0.169  -9.990  -6.673
  224   2HH2  ARG  34          2HH2      ARG  34   0.058  -8.893  -8.013
  225    H    SER  35           H        SER  35  -4.781  -9.796  -2.100
  226    HA   SER  35           HA       SER  35  -5.488 -11.688  -1.088
  227   1HB   SER  35          1HB       SER  35  -7.282 -11.975  -3.509
  228   2HB   SER  35          2HB       SER  35  -7.492 -12.779  -1.950
  229    HG   SER  35           HG       SER  35  -7.741 -10.690  -1.003
  230    H    ASP  36           H        ASP  36  -3.353 -11.727  -3.276
  231    HA   ASP  36           HA       ASP  36  -3.440 -14.514  -4.063
  232   1HB   ASP  36          1HB       ASP  36  -1.396 -13.957  -5.365
  233   2HB   ASP  36          2HB       ASP  36  -2.797 -13.022  -5.799
  234    H    GLY  37           H        GLY  37  -1.250 -12.318  -2.501
  235   1HA   GLY  37          1HA       GLY  37  -0.661 -13.914  -0.315
  236   2HA   GLY  37          2HA       GLY  37   0.544 -14.279  -1.537
  237    H    LYS  38           H        LYS  38   1.151 -11.894  -2.639
  238    HA   LYS  38           HA       LYS  38   2.776 -10.712  -0.647
  239   1HB   LYS  38          1HB       LYS  38   2.163  -9.390  -3.270
  240   2HB   LYS  38          2HB       LYS  38   3.678  -9.419  -2.375
  241   1HG   LYS  38          1HG       LYS  38   4.205 -10.877  -4.031
  242   2HG   LYS  38          2HG       LYS  38   3.502 -12.013  -2.889
  243   1HD   LYS  38          1HD       LYS  38   1.349 -11.824  -4.069
  244   2HD   LYS  38          2HD       LYS  38   2.097 -10.728  -5.228
  245   1HE   LYS  38          1HE       LYS  38   3.630 -12.488  -5.927
  246   2HE   LYS  38          2HE       LYS  38   2.925 -13.583  -4.736
  247   1HZ   LYS  38          1HZ       LYS  38   0.879 -12.508  -6.359
  248   2HZ   LYS  38          2HZ       LYS  38   2.091 -13.160  -7.354
  249   3HZ   LYS  38          3HZ       LYS  38   1.347 -14.134  -6.172
  250    H    MET  39           H        MET  39   2.123  -9.297   0.865
  251    HA   MET  39           HA       MET  39  -0.279  -7.741   0.431
  252   1HB   MET  39          1HB       MET  39   1.633  -7.813   2.773
  253   2HB   MET  39          2HB       MET  39   0.114  -6.936   2.722
  254   1HG   MET  39          1HG       MET  39  -1.071  -9.086   2.409
  255   2HG   MET  39          2HG       MET  39   0.471  -9.914   2.609
  256   1HE   MET  39          1HE       MET  39  -1.469 -10.988   3.945
  257   2HE   MET  39          2HE       MET  39  -0.871 -11.150   5.596
  258   3HE   MET  39          3HE       MET  39  -2.318 -10.195   5.275
  259    H    TRP  40           H        TRP  40  -0.290  -5.432   0.436
  260    HA   TRP  40           HA       TRP  40   2.314  -4.215  -0.192
  261   1HB   TRP  40          1HB       TRP  40   1.177  -2.883  -1.953
  262   2HB   TRP  40          2HB       TRP  40   1.174  -4.611  -2.299
  263    HD1  TRP  40           HD1      TRP  40  -1.324  -5.854  -1.535
  264    HE1  TRP  40           1HE      TRP  40  -3.692  -4.913  -1.855
  265    HE3  TRP  40           3HE      TRP  40  -0.172  -0.910  -2.190
  266    HZ2  TRP  40           2HZ      TRP  40  -4.914  -2.434  -2.288
  267    HZ3  TRP  40           3HZ      TRP  40  -2.017   0.681  -2.530
  268    HH2  TRP  40           HH2      TRP  40  -4.339  -0.070  -2.586
  269    H    CYS  41           H        CYS  41   1.654  -1.703  -0.646
  270    HA   CYS  41           HA       CYS  41  -0.049  -0.585   1.415
  271   1HB   CYS  41          1HB       CYS  41   1.791   0.777   2.381
  272   2HB   CYS  41          2HB       CYS  41   2.055  -0.945   2.654
  273    H    ALA  42           H        ALA  42  -0.724   1.517   0.780
  274    HA   ALA  42           HA       ALA  42  -0.027   2.229  -1.933
  275   1HB   ALA  42          1HB       ALA  42  -1.952   3.364   0.056
  276   2HB   ALA  42          2HB       ALA  42  -1.551   4.238  -1.424
  277   3HB   ALA  42          3HB       ALA  42  -2.273   2.631  -1.516
  278    H    THR  43           H        THR  43   0.747   4.312  -2.553
  279    HA   THR  43           HA       THR  43   2.617   5.387  -0.567
  280    HB   THR  43           HB       THR  43   3.996   6.075  -2.472
  281    HG1  THR  43           1HG      THR  43   1.770   5.779  -3.852
  282   1HG2  THR  43          1HG2      THR  43   3.689   3.437  -3.473
  283   2HG2  THR  43          2HG2      THR  43   4.930   4.074  -2.390
  284   3HG2  THR  43          3HG2      THR  43   3.436   3.410  -1.728
  285    H    THR  44           H        THR  44  -0.260   5.991  -1.196
  286    HA   THR  44           HA       THR  44   0.001   8.898  -1.169
  287    HB   THR  44           HB       THR  44  -2.140   8.999  -2.556
  288    HG1  THR  44           1HG      THR  44  -2.967   7.204  -3.216
  289   1HG2  THR  44          1HG2      THR  44  -0.145   7.779  -4.357
  290   2HG2  THR  44          2HG2      THR  44  -1.043   9.290  -4.507
  291   3HG2  THR  44          3HG2      THR  44   0.363   9.199  -3.444
  292    H    ALA  45           H        ALA  45  -1.589   9.903   0.139
  293    HA   ALA  45           HA       ALA  45  -2.490   8.506   2.361
  294   1HB   ALA  45          1HB       ALA  45  -2.292  11.020   2.081
  295   2HB   ALA  45          2HB       ALA  45  -3.881  10.963   1.312
  296   3HB   ALA  45          3HB       ALA  45  -3.689  10.442   2.986
  297    H    ASN  46           H        ASN  46  -4.289   9.360  -0.569
  298    HA   ASN  46           HA       ASN  46  -6.273   7.342   0.219
  299   1HB   ASN  46          1HB       ASN  46  -7.178   9.699   0.077
  300   2HB   ASN  46          2HB       ASN  46  -6.782   9.674  -1.640
  301   1HD2  ASN  46          1HD2      ASN  46 -10.184   8.127  -0.319
  302   2HD2  ASN  46          2HD2      ASN  46  -9.102   9.052   0.654
  303    H    TYR  47           H        TYR  47  -5.723   5.572  -0.837
  304    HA   TYR  47           HA       TYR  47  -4.265   5.579  -3.272
  305   1HB   TYR  47          1HB       TYR  47  -4.124   3.753  -1.606
  306   2HB   TYR  47          2HB       TYR  47  -5.782   3.299  -1.995
  307    HD1  TYR  47           1HD      TYR  47  -2.394   3.641  -3.489
  308    HD2  TYR  47           2HD      TYR  47  -6.228   1.855  -3.762
  309    HE1  TYR  47           1HE      TYR  47  -1.593   2.188  -5.301
  310    HE2  TYR  47           2HE      TYR  47  -5.434   0.396  -5.566
  311    HH   TYR  47           HH       TYR  47  -3.072  -0.516  -6.274
  312    H    ASP  48           H        ASP  48  -7.659   4.844  -2.522
  313    HA   ASP  48           HA       ASP  48  -8.594   3.921  -4.888
  314   1HB   ASP  48          1HB       ASP  48  -9.863   5.732  -2.868
  315   2HB   ASP  48          2HB       ASP  48 -10.746   5.234  -4.303
  316    H    ASP  49           H        ASP  49  -7.803   7.284  -4.240
  317    HA   ASP  49           HA       ASP  49  -8.919   8.138  -6.758
  318   1HB   ASP  49          1HB       ASP  49  -7.465   9.595  -4.568
  319   2HB   ASP  49          2HB       ASP  49  -7.920  10.365  -6.078
  320    H    ASP  50           H        ASP  50  -5.658   8.490  -5.356
  321    HA   ASP  50           HA       ASP  50  -4.498   9.055  -7.919
  322   1HB   ASP  50          1HB       ASP  50  -3.224   8.656  -5.211
  323   2HB   ASP  50          2HB       ASP  50  -2.367   9.203  -6.644
  324    H    ARG  51           H        ARG  51  -4.987   6.167  -6.172
  325    HA   ARG  51           HA       ARG  51  -4.011   4.147  -6.147
  326   1HB   ARG  51          1HB       ARG  51  -5.027   4.737  -8.846
  327   2HB   ARG  51          2HB       ARG  51  -4.289   3.165  -8.523
  328   1HG   ARG  51          1HG       ARG  51  -5.825   2.661  -6.866
  329   2HG   ARG  51          2HG       ARG  51  -6.334   4.332  -6.691
  330   1HD   ARG  51          1HD       ARG  51  -6.799   2.703  -9.140
  331   2HD   ARG  51          2HD       ARG  51  -7.936   2.818  -7.801
  332    HE   ARG  51           HE       ARG  51  -8.353   5.065  -8.355
  333   1HH1  ARG  51          1HH1      ARG  51  -6.110   3.546 -10.549
  334   2HH1  ARG  51          2HH1      ARG  51  -6.234   4.783 -11.760
  335   1HH2  ARG  51          1HH2      ARG  51  -8.566   6.700  -9.945
  336   2HH2  ARG  51          2HH2      ARG  51  -7.629   6.596 -11.410
  337    H    LYS  52           H        LYS  52  -1.897   5.101  -5.620
  338    HA   LYS  52           HA       LYS  52   0.026   3.935  -7.481
  339   1HB   LYS  52          1HB       LYS  52   0.366   6.505  -5.914
  340   2HB   LYS  52          2HB       LYS  52   1.725   5.612  -6.591
  341   1HG   LYS  52          1HG       LYS  52   0.851   5.893  -8.821
  342   2HG   LYS  52          2HG       LYS  52  -0.588   6.696  -8.197
  343   1HD   LYS  52          1HD       LYS  52   0.895   8.466  -7.250
  344   2HD   LYS  52          2HD       LYS  52   2.258   7.684  -8.054
  345   1HE   LYS  52          1HE       LYS  52  -0.179   8.882  -9.369
  346   2HE   LYS  52          2HE       LYS  52   1.465   9.522  -9.407
  347   1HZ   LYS  52          1HZ       LYS  52   2.128   7.432 -10.572
  348   2HZ   LYS  52          2HZ       LYS  52   0.485   7.006 -10.669
  349   3HZ   LYS  52          3HZ       LYS  52   1.042   8.403 -11.451
  350    H    TRP  53           H        TRP  53   0.680   2.162  -6.584
  351    HA   TRP  53           HA       TRP  53   0.799   1.995  -3.650
  352   1HB   TRP  53          1HB       TRP  53   0.099  -0.306  -3.906
  353   2HB   TRP  53          2HB       TRP  53  -1.022   0.749  -4.693
  354    HD1  TRP  53           HD1      TRP  53  -0.539   0.934  -7.552
  355    HE1  TRP  53           1HE      TRP  53   0.064  -1.040  -9.110
  356    HE3  TRP  53           3HE      TRP  53   1.044  -2.257  -4.034
  357    HZ2  TRP  53           2HZ      TRP  53   1.109  -3.679  -8.816
  358    HZ3  TRP  53           3HZ      TRP  53   1.851  -4.513  -4.688
  359    HH2  TRP  53           HH2      TRP  53   1.882  -5.196  -7.040
  360    H    GLY  54           H        GLY  54   1.965  -0.012  -2.973
  361   1HA   GLY  54          1HA       GLY  54   4.340  -0.788  -4.411
  362   2HA   GLY  54          2HA       GLY  54   4.647   0.200  -2.976
  363    H    PHE  55           H        PHE  55   5.516  -2.487  -3.091
  364    HA   PHE  55           HA       PHE  55   3.541  -4.081  -1.697
  365   1HB   PHE  55          1HB       PHE  55   6.243  -4.576  -2.852
  366   2HB   PHE  55          2HB       PHE  55   5.667  -5.659  -1.600
  367    HD1  PHE  55           1HD      PHE  55   2.732  -5.472  -2.437
  368    HD2  PHE  55           2HD      PHE  55   6.313  -6.193  -4.609
  369    HE1  PHE  55           1HE      PHE  55   1.465  -6.826  -4.059
  370    HE2  PHE  55           2HE      PHE  55   5.057  -7.544  -6.237
  371    HZ   PHE  55           HZ       PHE  55   2.634  -7.861  -5.965
  372    H    CYS  56           H        CYS  56   4.152  -5.310   0.213
  373    HA   CYS  56           HA       CYS  56   5.249  -3.607   2.308
  374   1HB   CYS  56          1HB       CYS  56   3.130  -5.239   2.349
  375   2HB   CYS  56          2HB       CYS  56   4.344  -6.453   2.709
  376    HA   PRO  57           HA       PRO  57   9.238  -5.601   2.239
  377   1HB   PRO  57          1HB       PRO  57   9.953  -5.988   4.775
  378   2HB   PRO  57          2HB       PRO  57   9.780  -4.360   4.104
  379   1HG   PRO  57          1HG       PRO  57   7.775  -5.995   5.562
  380   2HG   PRO  57          2HG       PRO  57   8.343  -4.364   5.988
  381   1HD   PRO  57          1HD       PRO  57   6.077  -4.644   4.642
  382   2HD   PRO  57          2HD       PRO  57   7.243  -3.409   4.122
  383    H    ASP  58           H        ASP  58  10.312  -7.437   4.075
  384    HA   ASP  58           HA       ASP  58   9.301  -9.861   2.932
  385   1HB   ASP  58          1HB       ASP  58  11.741  -9.333   3.494
  386   2HB   ASP  58          2HB       ASP  58  11.315  -9.697   5.164
  387    H    GLN  59           H        GLN  59   7.643 -10.981   3.669
  388    HA   GLN  59           HA       GLN  59   6.946 -10.772   6.526
  389   1HB   GLN  59          1HB       GLN  59   5.158 -11.397   4.174
  390   2HB   GLN  59          2HB       GLN  59   4.642 -11.282   5.850
  391   1HG   GLN  59          1HG       GLN  59   5.145  -8.943   5.886
  392   2HG   GLN  59          2HG       GLN  59   5.869  -9.031   4.278
  393   1HE2  GLN  59          1HE2      GLN  59   1.993  -8.274   4.656
  394   2HE2  GLN  59          2HE2      GLN  59   3.137  -8.213   5.957
  395    H    GLY  60           H        GLY  60   8.886 -12.636   5.545
  396   1HA   GLY  60          1HA       GLY  60   7.535 -15.098   6.385
  397   2HA   GLY  60          2HA       GLY  60   8.386 -15.117   4.847
  Start of MODEL   15
    1    H    SER   1           1H       SER   1  14.276   5.825   5.001
    2    HA   SER   1           HA       SER   1  11.696   6.658   5.557
    3   1HB   SER   1          1HB       SER   1  12.056   5.368   2.837
    4   2HB   SER   1          2HB       SER   1  10.520   5.732   3.625
    5    HG   SER   1           HG       SER   1  10.694   7.759   3.034
    6    H    TRP   2           H        TRP   2  10.882   5.052   6.782
    7    HA   TRP   2           HA       TRP   2  12.475   2.708   7.160
    8   1HB   TRP   2          1HB       TRP   2  10.911   2.120   8.932
    9   2HB   TRP   2          2HB       TRP   2  11.402   3.800   9.063
   10    HD1  TRP   2           HD1      TRP   2   9.379   5.421   7.506
   11    HE1  TRP   2           1HE      TRP   2   6.854   5.393   8.019
   12    HE3  TRP   2           3HE      TRP   2   9.111   0.959   9.984
   13    HZ2  TRP   2           2HZ      TRP   2   4.999   3.704   9.308
   14    HZ3  TRP   2           3HZ      TRP   2   6.916   0.211  10.837
   15    HH2  TRP   2           HH2      TRP   2   4.910   1.557  10.505
   16    H    MET   3           H        MET   3   9.294   3.293   5.679
   17    HA   MET   3           HA       MET   3   9.411   0.510   4.760
   18   1HB   MET   3          1HB       MET   3   7.061   2.193   5.549
   19   2HB   MET   3          2HB       MET   3   6.870   0.818   4.475
   20   1HG   MET   3          1HG       MET   3   8.055  -0.524   6.302
   21   2HG   MET   3          2HG       MET   3   7.739   0.866   7.336
   22   1HE   MET   3          1HE       MET   3   7.077  -1.424   8.367
   23   2HE   MET   3          2HE       MET   3   5.391  -1.320   8.879
   24   3HE   MET   3          3HE       MET   3   5.866  -2.492   7.651
   25    H    SER   4           H        SER   4  10.081   0.460   2.760
   26    HA   SER   4           HA       SER   4   9.096   2.483   0.870
   27   1HB   SER   4          1HB       SER   4  11.499   0.647   0.616
   28   2HB   SER   4          2HB       SER   4  11.021   1.890  -0.541
   29    HG   SER   4           HG       SER   4  12.400   2.122   1.812
   30    H    THR   5           H        THR   5   8.792   1.538  -1.426
   31    HA   THR   5           HA       THR   5   7.094  -0.785  -1.122
   32    HB   THR   5           HB       THR   5   6.374  -0.142  -3.436
   33    HG1  THR   5           1HG      THR   5   8.087   0.951  -4.253
   34   1HG2  THR   5          1HG2      THR   5   6.219   2.348  -1.859
   35   2HG2  THR   5          2HG2      THR   5   4.949   1.456  -2.699
   36   3HG2  THR   5          3HG2      THR   5   5.551   0.884  -1.140
   37    H    VAL   6           H        VAL   6   7.089  -2.544  -2.616
   38    HA   VAL   6           HA       VAL   6   9.688  -3.119  -3.870
   39    HB   VAL   6           HB       VAL   6   8.069  -5.375  -2.879
   40   1HG1  VAL   6          1HG1      VAL   6  11.016  -4.815  -3.023
   41   2HG1  VAL   6          2HG1      VAL   6  10.327  -6.281  -2.325
   42   3HG1  VAL   6          3HG1      VAL   6  10.067  -5.909  -4.029
   43   1HG2  VAL   6          1HG2      VAL   6   8.639  -3.313  -1.110
   44   2HG2  VAL   6          2HG2      VAL   6   8.131  -4.956  -0.714
   45   3HG2  VAL   6          3HG2      VAL   6   9.846  -4.556  -0.774
   46    H    GLY   7           H        GLY   7   6.790  -2.442  -4.399
   47   1HA   GLY   7          1HA       GLY   7   6.592  -3.785  -6.915
   48   2HA   GLY   7          2HA       GLY   7   5.336  -4.198  -5.780
   49    H    GLY   8           H        GLY   8   3.791  -3.290  -7.247
   50   1HA   GLY   8          1HA       GLY   8   2.281  -1.595  -7.627
   51   2HA   GLY   8          2HA       GLY   8   3.244  -0.563  -6.589
   52    H    ASN   9           H        ASN   9   3.187   1.209  -7.808
   53    HA   ASN   9           HA       ASN   9   4.866   1.156 -10.188
   54   1HB   ASN   9          1HB       ASN   9   3.338   2.701 -11.396
   55   2HB   ASN   9          2HB       ASN   9   2.675   1.098 -11.183
   56   1HD2  ASN   9          1HD2      ASN   9   0.810   3.116  -8.390
   57   2HD2  ASN   9          2HD2      ASN   9   2.397   2.438  -8.271
   58    H    SER  10           H        SER  10   5.196   1.943  -7.443
   59    HA   SER  10           HA       SER  10   5.254   4.828  -7.423
   60   1HB   SER  10          1HB       SER  10   6.446   4.202  -5.155
   61   2HB   SER  10          2HB       SER  10   4.702   4.015  -5.328
   62    HG   SER  10           HG       SER  10   6.291   2.163  -4.568
   63    H    GLY  11           H        GLY  11   7.529   2.119  -7.514
   64   1HA   GLY  11          1HA       GLY  11   9.661   2.101  -8.456
   65   2HA   GLY  11          2HA       GLY  11   9.532   3.836  -8.708
   66    H    GLY  12           H        GLY  12   9.171   1.956  -5.728
   67   1HA   GLY  12          1HA       GLY  12  10.586   1.841  -3.883
   68   2HA   GLY  12          2HA       GLY  12  11.732   2.862  -4.737
   69    H    ALA  13           H        ALA  13   8.333   3.623  -4.183
   70    HA   ALA  13           HA       ALA  13   9.178   6.048  -2.791
   71   1HB   ALA  13          1HB       ALA  13   7.383   5.851  -4.707
   72   2HB   ALA  13          2HB       ALA  13   6.313   5.469  -3.357
   73   3HB   ALA  13          3HB       ALA  13   7.185   7.004  -3.388
   74    HA   PRO  14           HA       PRO  14   8.111   4.478   1.185
   75   1HB   PRO  14          1HB       PRO  14   7.395   7.148   2.091
   76   2HB   PRO  14          2HB       PRO  14   8.814   6.183   2.498
   77   1HG   PRO  14          1HG       PRO  14   8.927   8.444   0.977
   78   2HG   PRO  14          2HG       PRO  14  10.083   7.109   0.831
   79   1HD   PRO  14          1HD       PRO  14   7.738   7.775  -0.901
   80   2HD   PRO  14          2HD       PRO  14   9.340   7.163  -1.357
   81    H    CYS  15           H        CYS  15   6.311   3.497   1.837
   82    HA   CYS  15           HA       CYS  15   3.744   4.164   0.852
   83   1HB   CYS  15          1HB       CYS  15   4.574   2.379   3.152
   84   2HB   CYS  15          2HB       CYS  15   2.935   2.474   2.520
   85    H    VAL  16           H        VAL  16   2.018   5.225   1.809
   86    HA   VAL  16           HA       VAL  16   2.687   6.832   4.183
   87    HB   VAL  16           HB       VAL  16   0.571   7.368   2.084
   88   1HG1  VAL  16          1HG1      VAL  16   1.175   8.585   4.668
   89   2HG1  VAL  16          2HG1      VAL  16   1.116   9.741   3.338
   90   3HG1  VAL  16          3HG1      VAL  16  -0.273   8.704   3.670
   91   1HG2  VAL  16          1HG2      VAL  16   3.312   7.659   1.820
   92   2HG2  VAL  16          2HG2      VAL  16   2.072   8.440   0.837
   93   3HG2  VAL  16          3HG2      VAL  16   2.744   9.276   2.238
   94    H    PHE  17           H        PHE  17   1.512   6.639   6.010
   95    HA   PHE  17           HA       PHE  17  -0.974   5.077   5.908
   96   1HB   PHE  17          1HB       PHE  17   1.203   5.032   8.008
   97   2HB   PHE  17          2HB       PHE  17  -0.346   4.227   8.151
   98    HD1  PHE  17           1HD      PHE  17  -0.904   2.678   6.004
   99    HD2  PHE  17           2HD      PHE  17   2.951   3.770   7.410
  100    HE1  PHE  17           1HE      PHE  17   0.057   0.717   4.886
  101    HE2  PHE  17           2HE      PHE  17   3.933   1.812   6.307
  102    HZ   PHE  17           HZ       PHE  17   2.495   0.256   5.018
  103    HA   PRO  18           HA       PRO  18  -2.496   4.572   7.132
  104   1HB   PRO  18          1HB       PRO  18  -5.120   5.513   7.493
  105   2HB   PRO  18          2HB       PRO  18  -4.149   4.628   8.665
  106   1HG   PRO  18          1HG       PRO  18  -5.000   7.311   8.867
  107   2HG   PRO  18          2HG       PRO  18  -3.833   6.490   9.911
  108   1HD   PRO  18          1HD       PRO  18  -3.359   8.351   7.649
  109   2HD   PRO  18          2HD       PRO  18  -2.369   8.043   9.093
  110    H    PHE  19           H        PHE  19  -2.942   3.903   5.106
  111    HA   PHE  19           HA       PHE  19  -3.985   5.936   3.252
  112   1HB   PHE  19          1HB       PHE  19  -3.037   4.747   1.443
  113   2HB   PHE  19          2HB       PHE  19  -1.795   4.833   2.683
  114    HD1  PHE  19           1HD      PHE  19  -4.096   2.635   0.867
  115    HD2  PHE  19           2HD      PHE  19  -1.014   2.844   3.793
  116    HE1  PHE  19           1HE      PHE  19  -3.782   0.215   0.690
  117    HE2  PHE  19           2HE      PHE  19  -0.705   0.403   3.621
  118    HZ   PHE  19           HZ       PHE  19  -2.084  -0.910   2.063
  119    H    THR  20           H        THR  20  -5.926   5.715   2.393
  120    HA   THR  20           HA       THR  20  -7.468   3.394   3.254
  121    HB   THR  20           HB       THR  20  -8.345   5.986   1.928
  122    HG1  THR  20           1HG      THR  20  -7.446   6.140   4.095
  123   1HG2  THR  20          1HG2      THR  20 -10.576   5.445   2.830
  124   2HG2  THR  20          2HG2      THR  20 -10.045   4.350   1.554
  125   3HG2  THR  20          3HG2      THR  20  -9.985   3.833   3.241
  126    H    PHE  21           H        PHE  21  -7.834   1.756   2.004
  127    HA   PHE  21           HA       PHE  21  -7.610   2.070  -0.925
  128   1HB   PHE  21          1HB       PHE  21  -6.018   0.449   0.224
  129   2HB   PHE  21          2HB       PHE  21  -7.430  -0.468   0.684
  130    HD1  PHE  21           1HD      PHE  21  -6.001   0.963  -2.478
  131    HD2  PHE  21           2HD      PHE  21  -8.007  -2.274  -0.583
  132    HE1  PHE  21           1HE      PHE  21  -5.817  -0.349  -4.534
  133    HE2  PHE  21           2HE      PHE  21  -7.821  -3.585  -2.630
  134    HZ   PHE  21           HZ       PHE  21  -6.710  -2.646  -4.618
  135    H    LEU  22           H        LEU  22  -9.366   1.674  -2.058
  136    HA   LEU  22           HA       LEU  22 -11.545   1.333  -2.552
  137   1HB   LEU  22          1HB       LEU  22 -10.272  -1.070  -1.429
  138   2HB   LEU  22          2HB       LEU  22 -11.935  -1.196  -1.962
  139    HG   LEU  22           HG       LEU  22 -11.226  -0.586  -4.184
  140   1HD1  LEU  22          1HD1      LEU  22  -8.715   0.014  -2.924
  141   2HD1  LEU  22          2HD1      LEU  22  -8.708  -0.603  -4.577
  142   3HD1  LEU  22          3HD1      LEU  22  -9.600   0.869  -4.187
  143   1HD2  LEU  22          1HD2      LEU  22 -10.854  -2.967  -3.065
  144   2HD2  LEU  22          2HD2      LEU  22 -10.586  -2.639  -4.777
  145   3HD2  LEU  22          3HD2      LEU  22  -9.230  -2.614  -3.652
  146    H    GLY  23           H        GLY  23 -11.329   2.681  -0.019
  147   1HA   GLY  23          1HA       GLY  23 -13.203   3.373   1.279
  148   2HA   GLY  23          2HA       GLY  23 -13.847   1.750   1.171
  149    H    ASN  24           H        ASN  24 -10.849   0.884   2.025
  150    HA   ASN  24           HA       ASN  24 -11.494   1.262   4.870
  151   1HB   ASN  24          1HB       ASN  24  -9.788  -0.882   3.616
  152   2HB   ASN  24          2HB       ASN  24 -10.292  -0.774   5.296
  153   1HD2  ASN  24          1HD2      ASN  24 -12.589  -2.582   2.612
  154   2HD2  ASN  24          2HD2      ASN  24 -10.975  -2.048   2.307
  155    H    LYS  25           H        LYS  25 -10.143   2.295   6.180
  156    HA   LYS  25           HA       LYS  25  -7.790   3.533   5.163
  157   1HB   LYS  25          1HB       LYS  25  -8.772   3.388   8.002
  158   2HB   LYS  25          2HB       LYS  25  -7.821   4.641   7.244
  159   1HG   LYS  25          1HG       LYS  25  -9.639   5.396   5.940
  160   2HG   LYS  25          2HG       LYS  25 -10.616   4.004   6.403
  161   1HD   LYS  25          1HD       LYS  25  -9.643   6.141   8.284
  162   2HD   LYS  25          2HD       LYS  25 -11.254   6.079   7.566
  163   1HE   LYS  25          1HE       LYS  25 -11.599   3.873   8.645
  164   2HE   LYS  25          2HE       LYS  25 -10.031   4.050   9.440
  165   1HZ   LYS  25          1HZ       LYS  25 -11.502   6.380   9.933
  166   2HZ   LYS  25          2HZ       LYS  25 -12.532   5.063  10.253
  167   3HZ   LYS  25          3HZ       LYS  25 -11.036   5.189  11.048
  168    H    TYR  26           H        TYR  26  -5.828   2.555   5.111
  169    HA   TYR  26           HA       TYR  26  -5.386   0.328   6.965
  170   1HB   TYR  26          1HB       TYR  26  -4.007   0.941   4.354
  171   2HB   TYR  26          2HB       TYR  26  -3.702  -0.452   5.379
  172    HD1  TYR  26           1HD      TYR  26  -6.686  -0.926   6.064
  173    HD2  TYR  26           2HD      TYR  26  -4.632  -0.273   2.407
  174    HE1  TYR  26           1HE      TYR  26  -8.397  -2.208   4.870
  175    HE2  TYR  26           2HE      TYR  26  -6.337  -1.555   1.203
  176    HH   TYR  26           HH       TYR  26  -8.399  -3.620   2.622
  177    H    GLU  27           H        GLU  27  -4.258   0.781   8.596
  178    HA   GLU  27           HA       GLU  27  -2.374   2.988   8.639
  179   1HB   GLU  27          1HB       GLU  27  -3.160   1.117  10.855
  180   2HB   GLU  27          2HB       GLU  27  -2.402   2.683  11.002
  181   1HG   GLU  27          1HG       GLU  27  -4.387   3.782  10.187
  182   2HG   GLU  27          2HG       GLU  27  -5.151   2.220   9.910
  183    H    SER  28           H        SER  28  -2.333  -0.239   7.980
  184    HA   SER  28           HA       SER  28   0.552  -0.410   8.321
  185   1HB   SER  28          1HB       SER  28   0.083  -2.888   8.851
  186   2HB   SER  28          2HB       SER  28  -0.207  -1.727  10.140
  187    HG   SER  28           HG       SER  28  -1.910  -3.471   9.147
  188    H    CYS  29           H        CYS  29   1.108  -2.699   7.038
  189    HA   CYS  29           HA       CYS  29   0.393  -2.121   4.357
  190   1HB   CYS  29          1HB       CYS  29   1.671  -4.603   5.496
  191   2HB   CYS  29          2HB       CYS  29   1.537  -4.226   3.793
  192    H    THR  30           H        THR  30  -0.559  -3.771   2.905
  193    HA   THR  30           HA       THR  30  -2.612  -5.437   4.151
  194    HB   THR  30           HB       THR  30  -3.713  -3.231   3.739
  195    HG1  THR  30           1HG      THR  30  -5.140  -4.838   3.510
  196   1HG2  THR  30          1HG2      THR  30  -3.930  -3.361   0.904
  197   2HG2  THR  30          2HG2      THR  30  -3.328  -2.046   1.912
  198   3HG2  THR  30          3HG2      THR  30  -2.220  -3.292   1.338
  199    H    SER  31           H        SER  31  -3.787  -6.677   2.421
  200    HA   SER  31           HA       SER  31  -2.004  -7.290   0.161
  201   1HB   SER  31          1HB       SER  31  -2.813  -9.677   0.425
  202   2HB   SER  31          2HB       SER  31  -1.755  -9.098   1.718
  203    HG   SER  31           HG       SER  31  -4.119 -10.163   2.008
  204    H    ALA  32           H        ALA  32  -4.415  -5.621   0.771
  205    HA   ALA  32           HA       ALA  32  -6.730  -6.628  -0.426
  206   1HB   ALA  32          1HB       ALA  32  -5.935  -4.256   0.818
  207   2HB   ALA  32          2HB       ALA  32  -6.439  -3.771  -0.806
  208   3HB   ALA  32          3HB       ALA  32  -7.551  -4.653   0.240
  209    H    GLY  33           H        GLY  33  -7.493  -6.703  -2.438
  210   1HA   GLY  33          1HA       GLY  33  -7.577  -6.501  -4.728
  211   2HA   GLY  33          2HA       GLY  33  -6.429  -5.179  -4.590
  212    H    ARG  34           H        ARG  34  -4.922  -7.603  -3.013
  213    HA   ARG  34           HA       ARG  34  -3.516  -8.398  -5.471
  214   1HB   ARG  34          1HB       ARG  34  -2.570  -8.268  -2.617
  215   2HB   ARG  34          2HB       ARG  34  -1.657  -9.010  -3.902
  216   1HG   ARG  34          1HG       ARG  34  -2.190  -6.568  -4.960
  217   2HG   ARG  34          2HG       ARG  34  -2.028  -6.197  -3.246
  218   1HD   ARG  34          1HD       ARG  34   0.109  -6.071  -4.503
  219   2HD   ARG  34          2HD       ARG  34   0.137  -7.206  -3.146
  220    HE   ARG  34           HE       ARG  34   0.509  -8.897  -4.631
  221   1HH1  ARG  34          1HH1      ARG  34  -0.776  -6.160  -6.367
  222   2HH1  ARG  34          2HH1      ARG  34  -0.646  -6.895  -7.936
  223   1HH2  ARG  34          1HH2      ARG  34   0.704  -9.903  -6.726
  224   2HH2  ARG  34          2HH2      ARG  34   0.203  -9.016  -8.133
  225    H    SER  35           H        SER  35  -2.165 -10.521  -4.881
  226    HA   SER  35           HA       SER  35  -4.142 -12.608  -4.705
  227   1HB   SER  35          1HB       SER  35  -1.173 -13.050  -4.917
  228   2HB   SER  35          2HB       SER  35  -2.491 -14.017  -5.584
  229    HG   SER  35           HG       SER  35  -1.596 -12.836  -7.255
  230    H    ASP  36           H        ASP  36  -3.406 -11.007  -2.347
  231    HA   ASP  36           HA       ASP  36  -3.241 -11.101  -0.155
  232   1HB   ASP  36          1HB       ASP  36  -4.263 -12.799   0.876
  233   2HB   ASP  36          2HB       ASP  36  -4.668 -13.236  -0.762
  234    H    GLY  37           H        GLY  37  -1.155 -13.089  -1.924
  235   1HA   GLY  37          1HA       GLY  37   0.672 -13.793   0.083
  236   2HA   GLY  37          2HA       GLY  37   1.013 -13.780  -1.631
  237    H    LYS  38           H        LYS  38   1.557 -11.666  -2.604
  238    HA   LYS  38           HA       LYS  38   3.532 -10.361  -1.037
  239   1HB   LYS  38          1HB       LYS  38   2.387  -9.528  -3.709
  240   2HB   LYS  38          2HB       LYS  38   3.907  -9.010  -3.007
  241   1HG   LYS  38          1HG       LYS  38   4.415 -10.606  -4.647
  242   2HG   LYS  38          2HG       LYS  38   4.672 -11.388  -3.102
  243   1HD   LYS  38          1HD       LYS  38   2.497 -12.504  -3.352
  244   2HD   LYS  38          2HD       LYS  38   2.291 -11.725  -4.926
  245   1HE   LYS  38          1HE       LYS  38   4.192 -12.874  -5.817
  246   2HE   LYS  38          2HE       LYS  38   4.608 -13.523  -4.231
  247   1HZ   LYS  38          1HZ       LYS  38   1.997 -14.298  -4.704
  248   2HZ   LYS  38          2HZ       LYS  38   2.815 -14.561  -6.173
  249   3HZ   LYS  38          3HZ       LYS  38   3.385 -15.279  -4.737
  250    H    MET  39           H        MET  39   2.773  -9.156   0.638
  251    HA   MET  39           HA       MET  39   0.421  -7.555   0.393
  252   1HB   MET  39          1HB       MET  39   2.541  -7.489   2.548
  253   2HB   MET  39          2HB       MET  39   0.925  -6.807   2.643
  254   1HG   MET  39          1HG       MET  39  -0.011  -9.079   2.422
  255   2HG   MET  39          2HG       MET  39   1.632  -9.721   2.453
  256   1HE   MET  39          1HE       MET  39  -0.571 -10.718   4.180
  257   2HE   MET  39          2HE       MET  39   0.989 -11.303   4.745
  258   3HE   MET  39          3HE       MET  39  -0.151 -10.598   5.893
  259    H    TRP  40           H        TRP  40   0.352  -5.260   0.522
  260    HA   TRP  40           HA       TRP  40   2.816  -3.884  -0.289
  261   1HB   TRP  40          1HB       TRP  40   1.534  -2.656  -2.022
  262   2HB   TRP  40          2HB       TRP  40   1.595  -4.386  -2.362
  263    HD1  TRP  40           HD1      TRP  40  -0.768  -5.748  -1.446
  264    HE1  TRP  40           1HE      TRP  40  -3.205  -4.940  -1.606
  265    HE3  TRP  40           3HE      TRP  40   0.065  -0.759  -2.143
  266    HZ2  TRP  40           2HZ      TRP  40  -4.580  -2.518  -1.929
  267    HZ3  TRP  40           3HZ      TRP  40  -1.872   0.737  -2.332
  268    HH2  TRP  40           HH2      TRP  40  -4.143  -0.124  -2.238
  269    H    CYS  41           H        CYS  41   1.735  -1.422  -0.750
  270    HA   CYS  41           HA       CYS  41  -0.059  -0.499   1.230
  271   1HB   CYS  41          1HB       CYS  41   1.791   1.002   2.325
  272   2HB   CYS  41          2HB       CYS  41   1.532  -0.635   2.916
  273    H    ALA  42           H        ALA  42  -0.731   1.600   0.734
  274    HA   ALA  42           HA       ALA  42  -0.021   2.503  -1.878
  275   1HB   ALA  42          1HB       ALA  42  -2.268   2.766  -0.596
  276   2HB   ALA  42          2HB       ALA  42  -1.520   4.232   0.034
  277   3HB   ALA  42          3HB       ALA  42  -1.730   4.028  -1.707
  278    H    THR  43           H        THR  43   0.770   4.568  -2.441
  279    HA   THR  43           HA       THR  43   2.781   5.526  -0.534
  280    HB   THR  43           HB       THR  43   4.002   6.316  -2.493
  281    HG1  THR  43           1HG      THR  43   2.658   6.890  -4.048
  282   1HG2  THR  43          1HG2      THR  43   3.531   3.877  -3.789
  283   2HG2  THR  43          2HG2      THR  43   4.817   4.257  -2.643
  284   3HG2  THR  43          3HG2      THR  43   3.294   3.580  -2.067
  285    H    THR  44           H        THR  44  -0.170   6.128  -1.012
  286    HA   THR  44           HA       THR  44   0.026   9.036  -0.750
  287    HB   THR  44           HB       THR  44  -2.126   9.216  -2.051
  288    HG1  THR  44           1HG      THR  44  -2.437   6.804  -1.816
  289   1HG2  THR  44          1HG2      THR  44  -0.508   8.029  -4.127
  290   2HG2  THR  44          2HG2      THR  44  -1.004   9.705  -3.893
  291   3HG2  THR  44          3HG2      THR  44   0.436   9.088  -3.079
  292    H    ALA  45           H        ALA  45  -1.406   9.875   0.781
  293    HA   ALA  45           HA       ALA  45  -2.249   8.223   2.856
  294   1HB   ALA  45          1HB       ALA  45  -2.213  10.967   2.371
  295   2HB   ALA  45          2HB       ALA  45  -3.902  10.579   2.704
  296   3HB   ALA  45          3HB       ALA  45  -2.655  10.153   3.874
  297    H    ASN  46           H        ASN  46  -4.059   9.388   0.043
  298    HA   ASN  46           HA       ASN  46  -6.197   7.506   0.783
  299   1HB   ASN  46          1HB       ASN  46  -6.949   9.880   0.888
  300   2HB   ASN  46          2HB       ASN  46  -6.558  10.047  -0.826
  301   1HD2  ASN  46          1HD2      ASN  46 -10.032   8.509   0.362
  302   2HD2  ASN  46          2HD2      ASN  46  -8.870   9.183   1.440
  303    H    TYR  47           H        TYR  47  -5.737   5.763  -0.381
  304    HA   TYR  47           HA       TYR  47  -4.510   5.869  -2.949
  305   1HB   TYR  47          1HB       TYR  47  -4.231   3.986  -1.348
  306   2HB   TYR  47          2HB       TYR  47  -5.909   3.541  -1.615
  307    HD1  TYR  47           1HD      TYR  47  -6.599   2.773  -3.949
  308    HD2  TYR  47           2HD      TYR  47  -2.538   3.272  -2.801
  309    HE1  TYR  47           1HE      TYR  47  -5.885   1.368  -5.835
  310    HE2  TYR  47           2HE      TYR  47  -1.825   1.878  -4.680
  311    HH   TYR  47           HH       TYR  47  -3.893  -0.070  -6.417
  312    H    ASP  48           H        ASP  48  -7.810   5.596  -1.818
  313    HA   ASP  48           HA       ASP  48  -9.115   4.658  -4.041
  314   1HB   ASP  48          1HB       ASP  48  -9.857   6.533  -1.852
  315   2HB   ASP  48          2HB       ASP  48 -10.955   6.368  -3.214
  316    H    ASP  49           H        ASP  49  -7.688   7.800  -3.590
  317    HA   ASP  49           HA       ASP  49  -8.961   8.863  -5.987
  318   1HB   ASP  49          1HB       ASP  49  -7.388  10.047  -3.743
  319   2HB   ASP  49          2HB       ASP  49  -7.452  10.902  -5.274
  320    H    ASP  50           H        ASP  50  -5.591   8.762  -4.777
  321    HA   ASP  50           HA       ASP  50  -4.591   9.257  -7.421
  322   1HB   ASP  50          1HB       ASP  50  -3.171   8.785  -4.810
  323   2HB   ASP  50          2HB       ASP  50  -2.342   9.106  -6.328
  324    H    ARG  51           H        ARG  51  -5.187   6.364  -5.659
  325    HA   ARG  51           HA       ARG  51  -4.561   4.208  -5.928
  326   1HB   ARG  51          1HB       ARG  51  -4.777   4.969  -8.817
  327   2HB   ARG  51          2HB       ARG  51  -4.995   3.364  -8.126
  328   1HG   ARG  51          1HG       ARG  51  -6.697   4.898  -6.648
  329   2HG   ARG  51          2HG       ARG  51  -6.847   5.604  -8.261
  330   1HD   ARG  51          1HD       ARG  51  -7.212   2.725  -7.486
  331   2HD   ARG  51          2HD       ARG  51  -8.471   3.869  -7.963
  332    HE   ARG  51           HE       ARG  51  -6.433   3.519  -9.963
  333   1HH1  ARG  51          1HH1      ARG  51  -9.476   2.358  -8.732
  334   2HH1  ARG  51          2HH1      ARG  51  -9.879   1.471 -10.166
  335   1HH2  ARG  51          1HH2      ARG  51  -6.987   2.386 -11.896
  336   2HH2  ARG  51          2HH2      ARG  51  -8.489   1.507 -11.969
  337    H    LYS  52           H        LYS  52  -2.253   5.571  -5.416
  338    HA   LYS  52           HA       LYS  52  -0.349   4.303  -7.250
  339   1HB   LYS  52          1HB       LYS  52   0.018   6.672  -5.404
  340   2HB   LYS  52          2HB       LYS  52   1.339   5.889  -6.269
  341   1HG   LYS  52          1HG       LYS  52   0.450   6.512  -8.376
  342   2HG   LYS  52          2HG       LYS  52  -1.072   7.027  -7.658
  343   1HD   LYS  52          1HD       LYS  52   0.080   9.027  -8.111
  344   2HD   LYS  52          2HD       LYS  52   0.327   8.758  -6.385
  345   1HE   LYS  52          1HE       LYS  52   2.403   9.444  -7.440
  346   2HE   LYS  52          2HE       LYS  52   2.533   7.786  -6.857
  347   1HZ   LYS  52          1HZ       LYS  52   1.703   7.388  -9.373
  348   2HZ   LYS  52          2HZ       LYS  52   2.615   8.811  -9.572
  349   3HZ   LYS  52          3HZ       LYS  52   3.329   7.420  -8.903
  350    H    TRP  53           H        TRP  53   0.376   2.472  -6.525
  351    HA   TRP  53           HA       TRP  53   0.667   2.079  -3.631
  352   1HB   TRP  53          1HB       TRP  53  -0.130  -0.164  -3.926
  353   2HB   TRP  53          2HB       TRP  53  -1.273   0.936  -4.579
  354    HD1  TRP  53           HD1      TRP  53  -0.928   1.246  -7.474
  355    HE1  TRP  53           1HE      TRP  53  -0.557  -0.697  -9.134
  356    HE3  TRP  53           3HE      TRP  53   0.615  -2.184  -4.162
  357    HZ2  TRP  53           2HZ      TRP  53   0.296  -3.426  -8.996
  358    HZ3  TRP  53           3HZ      TRP  53   1.200  -4.474  -4.945
  359    HH2  TRP  53           HH2      TRP  53   1.047  -5.074  -7.314
  360    H    GLY  54           H        GLY  54   1.851   0.011  -3.181
  361   1HA   GLY  54          1HA       GLY  54   3.895  -0.939  -4.896
  362   2HA   GLY  54          2HA       GLY  54   4.549   0.241  -3.764
  363    H    PHE  55           H        PHE  55   5.139  -2.627  -3.814
  364    HA   PHE  55           HA       PHE  55   3.657  -4.035  -1.912
  365   1HB   PHE  55          1HB       PHE  55   6.477  -4.372  -2.879
  366   2HB   PHE  55          2HB       PHE  55   5.703  -5.486  -1.771
  367    HD1  PHE  55           1HD      PHE  55   3.099  -4.439  -3.671
  368    HD2  PHE  55           2HD      PHE  55   6.661  -6.735  -4.017
  369    HE1  PHE  55           1HE      PHE  55   2.114  -5.665  -5.568
  370    HE2  PHE  55           2HE      PHE  55   5.681  -7.971  -5.923
  371    HZ   PHE  55           HZ       PHE  55   3.403  -7.428  -6.698
  372    H    CYS  56           H        CYS  56   4.463  -4.948   0.066
  373    HA   CYS  56           HA       CYS  56   5.407  -2.885   1.889
  374   1HB   CYS  56          1HB       CYS  56   3.377  -4.354   2.374
  375   2HB   CYS  56          2HB       CYS  56   4.486  -5.708   2.503
  376    HA   PRO  57           HA       PRO  57   9.536  -4.512   1.926
  377   1HB   PRO  57          1HB       PRO  57  10.400  -3.782   4.341
  378   2HB   PRO  57          2HB       PRO  57  10.109  -2.607   3.047
  379   1HG   PRO  57          1HG       PRO  57   8.269  -3.485   5.227
  380   2HG   PRO  57          2HG       PRO  57   8.743  -1.819   4.828
  381   1HD   PRO  57          1HD       PRO  57   6.432  -2.786   3.945
  382   2HD   PRO  57          2HD       PRO  57   7.465  -1.852   2.837
  383    H    ASP  58           H        ASP  58  10.798  -5.218   4.392
  384    HA   ASP  58           HA       ASP  58  10.728  -7.935   4.346
  385   1HB   ASP  58          1HB       ASP  58  11.304  -6.274   6.797
  386   2HB   ASP  58          2HB       ASP  58  11.908  -7.876   6.436
  387    H    GLN  59           H        GLN  59   8.995  -9.197   4.607
  388    HA   GLN  59           HA       GLN  59   6.985  -8.562   6.618
  389   1HB   GLN  59          1HB       GLN  59   7.097 -10.934   4.741
  390   2HB   GLN  59          2HB       GLN  59   5.711 -10.411   5.684
  391   1HG   GLN  59          1HG       GLN  59   5.655  -8.333   4.356
  392   2HG   GLN  59          2HG       GLN  59   6.981  -8.960   3.377
  393   1HE2  GLN  59          1HE2      GLN  59   4.899 -10.717   1.280
  394   2HE2  GLN  59          2HE2      GLN  59   6.413  -9.945   1.586
  395    H    GLY  60           H        GLY  60   9.543 -10.841   5.946
  396   1HA   GLY  60          1HA       GLY  60  10.483 -11.512   8.304
  397   2HA   GLY  60          2HA       GLY  60   8.949 -12.372   8.364
  Start of MODEL   16
    1    H    SER   1           1H       SER   1  13.113   5.971   7.845
    2    HA   SER   1           HA       SER   1  15.638   4.870   6.834
    3   1HB   SER   1          1HB       SER   1  13.116   3.343   7.544
    4   2HB   SER   1          2HB       SER   1  14.647   2.673   6.972
    5    HG   SER   1           HG       SER   1  13.900   3.078   9.465
    6    H    TRP   2           H        TRP   2  14.972   3.536   4.819
    7    HA   TRP   2           HA       TRP   2  13.052   5.158   3.272
    8   1HB   TRP   2          1HB       TRP   2  15.423   3.533   2.302
    9   2HB   TRP   2          2HB       TRP   2  14.281   4.374   1.259
   10    HD1  TRP   2           HD1      TRP   2  14.096   7.184   2.072
   11    HE1  TRP   2           1HE      TRP   2  16.106   8.770   2.351
   12    HE3  TRP   2           3HE      TRP   2  17.785   3.697   2.715
   13    HZ2  TRP   2           2HZ      TRP   2  18.883   8.564   2.792
   14    HZ3  TRP   2           3HZ      TRP   2  20.095   4.477   3.066
   15    HH2  TRP   2           HH2      TRP   2  20.628   6.867   3.103
   16    H    MET   3           H        MET   3  11.303   3.898   4.056
   17    HA   MET   3           HA       MET   3  11.254   1.078   3.407
   18   1HB   MET   3          1HB       MET   3   9.069   1.097   4.543
   19   2HB   MET   3          2HB       MET   3  10.360   1.721   5.550
   20   1HG   MET   3          1HG       MET   3   8.435   3.461   4.027
   21   2HG   MET   3          2HG       MET   3   8.183   2.939   5.690
   22   1HE   MET   3          1HE       MET   3   7.713   5.408   5.843
   23   2HE   MET   3          2HE       MET   3   8.941   6.577   6.330
   24   3HE   MET   3          3HE       MET   3   8.594   6.320   4.619
   25    H    SER   4           H        SER   4  11.506   2.141   1.066
   26    HA   SER   4           HA       SER   4   9.080   2.967  -0.178
   27   1HB   SER   4          1HB       SER   4  11.586   1.891  -1.482
   28   2HB   SER   4          2HB       SER   4  10.295   2.778  -2.286
   29    HG   SER   4           HG       SER   4  11.617   4.395  -1.834
   30    H    THR   5           H        THR   5   7.936   1.786  -1.845
   31    HA   THR   5           HA       THR   5   7.213  -0.811  -0.989
   32    HB   THR   5           HB       THR   5   5.695  -0.752  -2.935
   33    HG1  THR   5           1HG      THR   5   7.488   1.129  -3.759
   34   1HG2  THR   5          1HG2      THR   5   5.484   2.019  -1.963
   35   2HG2  THR   5          2HG2      THR   5   4.268   0.745  -2.042
   36   3HG2  THR   5          3HG2      THR   5   5.454   0.751  -0.738
   37    H    VAL   6           H        VAL   6   6.905  -2.589  -2.691
   38    HA   VAL   6           HA       VAL   6   9.473  -3.094  -3.978
   39    HB   VAL   6           HB       VAL   6   7.520  -5.277  -3.620
   40   1HG1  VAL   6          1HG1      VAL   6  10.294  -4.994  -4.215
   41   2HG1  VAL   6          2HG1      VAL   6  10.081  -6.036  -2.811
   42   3HG1  VAL   6          3HG1      VAL   6   9.257  -6.417  -4.325
   43   1HG2  VAL   6          1HG2      VAL   6   7.873  -3.795  -1.424
   44   2HG2  VAL   6          2HG2      VAL   6   7.693  -5.548  -1.385
   45   3HG2  VAL   6          3HG2      VAL   6   9.300  -4.830  -1.302
   46    H    GLY   7           H        GLY   7   6.341  -4.161  -4.279
   47   1HA   GLY   7          1HA       GLY   7   6.351  -4.549  -7.082
   48   2HA   GLY   7          2HA       GLY   7   4.994  -4.762  -6.022
   49    H    GLY   8           H        GLY   8   3.687  -3.804  -7.629
   50   1HA   GLY   8          1HA       GLY   8   2.370  -2.027  -8.217
   51   2HA   GLY   8          2HA       GLY   8   3.301  -1.030  -7.121
   52    H    ASN   9           H        ASN   9   3.636   0.709  -8.306
   53    HA   ASN   9           HA       ASN   9   5.601   0.586 -10.378
   54   1HB   ASN   9          1HB       ASN   9   4.227   1.767 -12.105
   55   2HB   ASN   9          2HB       ASN   9   3.754   0.104 -11.825
   56   1HD2  ASN   9          1HD2      ASN   9   1.084   2.206  -9.807
   57   2HD2  ASN   9          2HD2      ASN   9   2.698   1.880  -9.286
   58    H    SER  10           H        SER  10   5.695   1.716  -7.930
   59    HA   SER  10           HA       SER  10   5.033   4.499  -7.975
   60   1HB   SER  10          1HB       SER  10   6.539   4.373  -5.860
   61   2HB   SER  10          2HB       SER  10   4.986   3.554  -5.833
   62    HG   SER  10           HG       SER  10   6.351   2.006  -5.161
   63    H    GLY  11           H        GLY  11   7.921   2.543  -8.489
   64   1HA   GLY  11          1HA       GLY  11   9.869   3.144  -9.616
   65   2HA   GLY  11          2HA       GLY  11   9.208   4.765  -9.814
   66    H    GLY  12           H        GLY  12   9.573   2.990  -6.790
   67   1HA   GLY  12          1HA       GLY  12  11.221   3.293  -5.137
   68   2HA   GLY  12          2HA       GLY  12  11.837   4.672  -6.036
   69    H    ALA  13           H        ALA  13   8.654   3.815  -4.677
   70    HA   ALA  13           HA       ALA  13   8.769   6.315  -3.126
   71   1HB   ALA  13          1HB       ALA  13   7.235   6.185  -5.294
   72   2HB   ALA  13          2HB       ALA  13   6.127   5.429  -4.149
   73   3HB   ALA  13          3HB       ALA  13   6.736   7.056  -3.844
   74    HA   PRO  14           HA       PRO  14   7.512   3.618   0.147
   75   1HB   PRO  14          1HB       PRO  14   6.998   5.438   2.053
   76   2HB   PRO  14          2HB       PRO  14   8.642   5.128   1.484
   77   1HG   PRO  14          1HG       PRO  14   6.814   7.400   0.872
   78   2HG   PRO  14          2HG       PRO  14   8.579   7.386   1.037
   79   1HD   PRO  14          1HD       PRO  14   7.151   7.358  -1.370
   80   2HD   PRO  14          2HD       PRO  14   8.870   6.962  -1.181
   81    H    CYS  15           H        CYS  15   5.676   3.297   1.720
   82    HA   CYS  15           HA       CYS  15   3.163   3.671   0.308
   83   1HB   CYS  15          1HB       CYS  15   3.299   2.438   3.038
   84   2HB   CYS  15          2HB       CYS  15   2.323   1.968   1.651
   85    H    VAL  16           H        VAL  16   1.543   5.079   0.950
   86    HA   VAL  16           HA       VAL  16   2.189   6.876   3.176
   87    HB   VAL  16           HB       VAL  16   0.067   7.152   1.036
   88   1HG1  VAL  16          1HG1      VAL  16   0.200   8.411   3.511
   89   2HG1  VAL  16          2HG1      VAL  16   0.836   9.591   2.366
   90   3HG1  VAL  16          3HG1      VAL  16  -0.766   8.899   2.119
   91   1HG2  VAL  16          1HG2      VAL  16   2.722   7.406   0.626
   92   2HG2  VAL  16          2HG2      VAL  16   1.498   8.334  -0.241
   93   3HG2  VAL  16          3HG2      VAL  16   2.319   9.045   1.144
   94    H    PHE  17           H        PHE  17   1.329   6.397   5.090
   95    HA   PHE  17           HA       PHE  17  -1.265   5.034   5.167
   96   1HB   PHE  17          1HB       PHE  17   1.025   4.982   7.129
   97   2HB   PHE  17          2HB       PHE  17  -0.548   4.272   7.429
   98    HD1  PHE  17           1HD      PHE  17  -1.353   2.620   5.453
   99    HD2  PHE  17           2HD      PHE  17   2.663   3.607   6.429
  100    HE1  PHE  17           1HE      PHE  17  -0.585   0.543   4.386
  101    HE2  PHE  17           2HE      PHE  17   3.449   1.545   5.371
  102    HZ   PHE  17           HZ       PHE  17   1.837  -0.017   4.324
  103    HA   PRO  18           HA       PRO  18  -2.718   4.576   6.306
  104   1HB   PRO  18          1HB       PRO  18  -5.302   5.232   6.680
  105   2HB   PRO  18          2HB       PRO  18  -4.222   4.846   8.016
  106   1HG   PRO  18          1HG       PRO  18  -5.279   7.471   7.147
  107   2HG   PRO  18          2HG       PRO  18  -4.768   6.940   8.760
  108   1HD   PRO  18          1HD       PRO  18  -3.292   8.517   6.914
  109   2HD   PRO  18          2HD       PRO  18  -2.705   7.832   8.440
  110    H    PHE  19           H        PHE  19  -3.315   3.856   4.346
  111    HA   PHE  19           HA       PHE  19  -4.217   5.887   2.417
  112   1HB   PHE  19          1HB       PHE  19  -3.413   4.507   0.636
  113   2HB   PHE  19          2HB       PHE  19  -2.138   4.621   1.837
  114    HD1  PHE  19           1HD      PHE  19  -4.737   2.391   0.433
  115    HD2  PHE  19           2HD      PHE  19  -1.272   2.691   2.887
  116    HE1  PHE  19           1HE      PHE  19  -4.542  -0.061   0.456
  117    HE2  PHE  19           2HE      PHE  19  -1.080   0.241   2.914
  118    HZ   PHE  19           HZ       PHE  19  -2.718  -1.137   1.697
  119    H    THR  20           H        THR  20  -6.179   5.691   1.415
  120    HA   THR  20           HA       THR  20  -7.858   3.589   2.576
  121    HB   THR  20           HB       THR  20  -8.613   6.131   1.094
  122    HG1  THR  20           1HG      THR  20  -7.629   6.291   3.244
  123   1HG2  THR  20          1HG2      THR  20 -10.766   5.465   2.613
  124   2HG2  THR  20          2HG2      THR  20 -10.614   5.178   0.879
  125   3HG2  THR  20          3HG2      THR  20 -10.239   3.888   2.025
  126    H    PHE  21           H        PHE  21  -8.443   1.915   1.541
  127    HA   PHE  21           HA       PHE  21  -8.627   1.949  -1.405
  128   1HB   PHE  21          1HB       PHE  21  -6.705   0.543  -0.315
  129   2HB   PHE  21          2HB       PHE  21  -7.999  -0.522   0.198
  130    HD1  PHE  21           1HD      PHE  21  -8.800   0.976  -2.937
  131    HD2  PHE  21           2HD      PHE  21  -6.573  -2.158  -1.121
  132    HE1  PHE  21           1HE      PHE  21  -8.735  -0.220  -5.066
  133    HE2  PHE  21           2HE      PHE  21  -6.502  -3.357  -3.248
  134    HZ   PHE  21           HZ       PHE  21  -7.574  -2.387  -5.247
  135    H    LEU  22           H        LEU  22 -10.438   0.746  -2.196
  136    HA   LEU  22           HA       LEU  22 -12.656   0.387  -2.213
  137   1HB   LEU  22          1HB       LEU  22 -11.439  -1.608  -0.408
  138   2HB   LEU  22          2HB       LEU  22 -13.023  -1.828  -1.132
  139    HG   LEU  22           HG       LEU  22 -11.920  -2.822  -2.800
  140   1HD1  LEU  22          1HD1      LEU  22 -11.336  -0.056  -3.324
  141   2HD1  LEU  22          2HD1      LEU  22 -10.367  -1.235  -4.197
  142   3HD1  LEU  22          3HD1      LEU  22 -12.127  -1.270  -4.331
  143   1HD2  LEU  22          1HD2      LEU  22  -9.936  -2.579  -1.003
  144   2HD2  LEU  22          2HD2      LEU  22  -9.937  -3.588  -2.446
  145   3HD2  LEU  22          3HD2      LEU  22  -9.243  -1.969  -2.508
  146    H    GLY  23           H        GLY  23 -12.148   2.449  -0.305
  147   1HA   GLY  23          1HA       GLY  23 -13.617   3.618   1.069
  148   2HA   GLY  23          2HA       GLY  23 -14.562   2.157   1.272
  149    H    ASN  24           H        ASN  24 -11.437   1.248   2.022
  150    HA   ASN  24           HA       ASN  24 -11.958   1.787   4.876
  151   1HB   ASN  24          1HB       ASN  24 -10.382  -0.428   3.549
  152   2HB   ASN  24          2HB       ASN  24 -10.622  -0.246   5.284
  153   1HD2  ASN  24          1HD2      ASN  24 -13.297  -2.130   3.052
  154   2HD2  ASN  24          2HD2      ASN  24 -11.731  -1.656   2.511
  155    H    LYS  25           H        LYS  25 -10.281   2.553   6.209
  156    HA   LYS  25           HA       LYS  25  -8.060   3.781   4.859
  157   1HB   LYS  25          1HB       LYS  25  -8.644   3.734   7.807
  158   2HB   LYS  25          2HB       LYS  25  -7.831   4.963   6.864
  159   1HG   LYS  25          1HG       LYS  25  -9.904   5.585   5.782
  160   2HG   LYS  25          2HG       LYS  25 -10.748   4.301   6.651
  161   1HD   LYS  25          1HD       LYS  25  -9.361   6.643   7.915
  162   2HD   LYS  25          2HD       LYS  25 -11.097   6.505   7.639
  163   1HE   LYS  25          1HE       LYS  25  -9.449   4.655   9.353
  164   2HE   LYS  25          2HE       LYS  25 -10.473   5.957   9.954
  165   1HZ   LYS  25          1HZ       LYS  25 -11.954   4.275   8.219
  166   2HZ   LYS  25          2HZ       LYS  25 -11.224   3.340   9.442
  167   3HZ   LYS  25          3HZ       LYS  25 -12.235   4.647   9.844
  168    H    TYR  26           H        TYR  26  -6.156   2.684   4.646
  169    HA   TYR  26           HA       TYR  26  -5.703   0.357   6.367
  170   1HB   TYR  26          1HB       TYR  26  -4.449   1.129   3.729
  171   2HB   TYR  26          2HB       TYR  26  -4.066  -0.320   4.649
  172    HD1  TYR  26           1HD      TYR  26  -7.013   1.427   3.118
  173    HD2  TYR  26           2HD      TYR  26  -5.206  -2.270   4.151
  174    HE1  TYR  26           1HE      TYR  26  -8.843   0.232   2.028
  175    HE2  TYR  26           2HE      TYR  26  -7.027  -3.475   3.053
  176    HH   TYR  26           HH       TYR  26  -9.386  -3.091   2.447
  177    H    GLU  27           H        GLU  27  -4.478   0.561   7.971
  178    HA   GLU  27           HA       GLU  27  -2.538   2.718   8.207
  179   1HB   GLU  27          1HB       GLU  27  -3.627   0.654  10.107
  180   2HB   GLU  27          2HB       GLU  27  -2.326   1.731  10.536
  181   1HG   GLU  27          1HG       GLU  27  -3.769   3.648  10.249
  182   2HG   GLU  27          2HG       GLU  27  -5.075   2.599   9.695
  183    H    SER  28           H        SER  28  -2.682  -0.656   7.617
  184    HA   SER  28           HA       SER  28   0.244  -0.757   7.609
  185   1HB   SER  28          1HB       SER  28  -0.046  -3.212   8.150
  186   2HB   SER  28          2HB       SER  28  -0.426  -2.113   9.467
  187    HG   SER  28           HG       SER  28  -2.594  -2.457   9.128
  188    H    CYS  29           H        CYS  29   0.718  -3.016   6.263
  189    HA   CYS  29           HA       CYS  29  -0.105  -2.362   3.643
  190   1HB   CYS  29          1HB       CYS  29   1.148  -4.900   4.678
  191   2HB   CYS  29          2HB       CYS  29   0.981  -4.478   2.986
  192    H    THR  30           H        THR  30  -1.153  -3.926   2.197
  193    HA   THR  30           HA       THR  30  -3.251  -5.499   3.501
  194    HB   THR  30           HB       THR  30  -4.228  -3.247   3.020
  195    HG1  THR  30           1HG      THR  30  -5.732  -4.774   2.896
  196   1HG2  THR  30          1HG2      THR  30  -4.067  -3.810   0.100
  197   2HG2  THR  30          2HG2      THR  30  -4.332  -2.285   0.944
  198   3HG2  THR  30          3HG2      THR  30  -2.718  -3.000   0.895
  199    H    SER  31           H        SER  31  -4.512  -6.683   1.796
  200    HA   SER  31           HA       SER  31  -2.797  -7.496  -0.435
  201   1HB   SER  31          1HB       SER  31  -3.785  -9.837  -0.024
  202   2HB   SER  31          2HB       SER  31  -2.563  -9.267   1.127
  203    HG   SER  31           HG       SER  31  -4.927 -10.143   1.717
  204    H    ALA  32           H        ALA  32  -5.065  -5.669   0.113
  205    HA   ALA  32           HA       ALA  32  -7.452  -6.622  -1.059
  206   1HB   ALA  32          1HB       ALA  32  -6.460  -4.147   0.074
  207   2HB   ALA  32          2HB       ALA  32  -7.330  -3.819  -1.423
  208   3HB   ALA  32          3HB       ALA  32  -8.132  -4.683  -0.115
  209    H    GLY  33           H        GLY  33  -8.233  -6.574  -3.069
  210   1HA   GLY  33          1HA       GLY  33  -8.337  -6.205  -5.344
  211   2HA   GLY  33          2HA       GLY  33  -7.017  -5.061  -5.179
  212    H    ARG  34           H        ARG  34  -5.927  -7.807  -3.746
  213    HA   ARG  34           HA       ARG  34  -4.648  -8.633  -6.252
  214   1HB   ARG  34          1HB       ARG  34  -3.669  -9.216  -3.467
  215   2HB   ARG  34          2HB       ARG  34  -2.809  -9.400  -4.977
  216   1HG   ARG  34          1HG       ARG  34  -3.313  -6.803  -5.134
  217   2HG   ARG  34          2HG       ARG  34  -3.302  -6.984  -3.374
  218   1HD   ARG  34          1HD       ARG  34  -1.083  -6.424  -4.305
  219   2HD   ARG  34          2HD       ARG  34  -1.105  -7.966  -3.442
  220    HE   ARG  34           HE       ARG  34  -0.501  -8.987  -5.382
  221   1HH1  ARG  34          1HH1      ARG  34  -2.022  -5.945  -6.196
  222   2HH1  ARG  34          2HH1      ARG  34  -1.715  -6.096  -7.898
  223   1HH2  ARG  34          1HH2      ARG  34  -0.057  -9.170  -7.608
  224   2HH2  ARG  34          2HH2      ARG  34  -0.599  -7.930  -8.703
  225    H    SER  35           H        SER  35  -4.952 -10.585  -7.045
  226    HA   SER  35           HA       SER  35  -6.444 -12.514  -5.412
  227   1HB   SER  35          1HB       SER  35  -6.144 -12.307  -8.420
  228   2HB   SER  35          2HB       SER  35  -7.046 -13.572  -7.581
  229    HG   SER  35           HG       SER  35  -8.658 -12.237  -7.461
  230    H    ASP  36           H        ASP  36  -3.398 -11.829  -5.940
  231    HA   ASP  36           HA       ASP  36  -2.466 -14.494  -6.618
  232   1HB   ASP  36          1HB       ASP  36  -0.183 -13.324  -6.373
  233   2HB   ASP  36          2HB       ASP  36  -1.181 -12.908  -7.753
  234    H    GLY  37           H        GLY  37  -0.963 -12.314  -4.353
  235   1HA   GLY  37          1HA       GLY  37  -1.746 -13.509  -1.977
  236   2HA   GLY  37          2HA       GLY  37  -0.329 -14.377  -2.531
  237    H    LYS  38           H        LYS  38   0.779 -11.801  -3.733
  238    HA   LYS  38           HA       LYS  38   2.360 -11.058  -1.519
  239   1HB   LYS  38          1HB       LYS  38   1.932  -9.279  -3.903
  240   2HB   LYS  38          2HB       LYS  38   3.393  -9.523  -2.956
  241   1HG   LYS  38          1HG       LYS  38   2.161 -11.543  -4.804
  242   2HG   LYS  38          2HG       LYS  38   3.525 -10.517  -5.179
  243   1HD   LYS  38          1HD       LYS  38   4.752 -11.517  -3.262
  244   2HD   LYS  38          2HD       LYS  38   3.403 -12.632  -3.044
  245   1HE   LYS  38          1HE       LYS  38   3.753 -13.464  -5.345
  246   2HE   LYS  38          2HE       LYS  38   5.149 -12.394  -5.497
  247   1HZ   LYS  38          1HZ       LYS  38   6.102 -13.579  -3.536
  248   2HZ   LYS  38          2HZ       LYS  38   4.829 -14.695  -3.649
  249   3HZ   LYS  38          3HZ       LYS  38   5.938 -14.536  -4.927
  250    H    MET  39           H        MET  39   2.210  -9.398  -0.052
  251    HA   MET  39           HA       MET  39  -0.266  -7.869  -0.067
  252   1HB   MET  39          1HB       MET  39   1.877  -7.998   2.063
  253   2HB   MET  39          2HB       MET  39   0.293  -7.257   2.209
  254   1HG   MET  39          1HG       MET  39  -0.738  -9.483   1.882
  255   2HG   MET  39          2HG       MET  39   0.878 -10.187   1.884
  256   1HE   MET  39          1HE       MET  39   0.063 -11.819   3.650
  257   2HE   MET  39          2HE       MET  39  -0.348 -11.420   5.317
  258   3HE   MET  39          3HE       MET  39  -1.511 -11.118   4.023
  259    H    TRP  40           H        TRP  40  -0.270  -5.609  -0.115
  260    HA   TRP  40           HA       TRP  40   2.302  -4.347  -0.794
  261   1HB   TRP  40          1HB       TRP  40   1.131  -3.080  -2.572
  262   2HB   TRP  40          2HB       TRP  40   1.109  -4.818  -2.878
  263    HD1  TRP  40           HD1      TRP  40  -1.328  -6.038  -1.999
  264    HE1  TRP  40           1HE      TRP  40  -3.717  -5.118  -2.239
  265    HE3  TRP  40           3HE      TRP  40  -0.230  -1.122  -2.776
  266    HZ2  TRP  40           2HZ      TRP  40  -4.955  -2.644  -2.673
  267    HZ3  TRP  40           3HZ      TRP  40  -2.082   0.467  -3.082
  268    HH2  TRP  40           HH2      TRP  40  -4.398  -0.287  -3.038
  269    H    CYS  41           H        CYS  41   1.446  -1.841  -1.299
  270    HA   CYS  41           HA       CYS  41  -0.302  -0.801   0.741
  271   1HB   CYS  41          1HB       CYS  41   1.583   0.710   1.626
  272   2HB   CYS  41          2HB       CYS  41   1.581  -0.963   2.182
  273    H    ALA  42           H        ALA  42  -1.085   1.206   0.083
  274    HA   ALA  42           HA       ALA  42  -0.490   1.981  -2.599
  275   1HB   ALA  42          1HB       ALA  42  -2.360   2.872  -0.504
  276   2HB   ALA  42          2HB       ALA  42  -1.897   4.083  -1.701
  277   3HB   ALA  42          3HB       ALA  42  -2.633   2.565  -2.217
  278    H    THR  43           H        THR  43   0.423   3.941  -3.307
  279    HA   THR  43           HA       THR  43   2.412   4.986  -1.429
  280    HB   THR  43           HB       THR  43   3.589   5.716  -3.500
  281    HG1  THR  43           1HG      THR  43   2.606   5.612  -5.365
  282   1HG2  THR  43          1HG2      THR  43   3.564   3.156  -4.432
  283   2HG2  THR  43          2HG2      THR  43   4.539   3.734  -3.079
  284   3HG2  THR  43          3HG2      THR  43   2.986   2.952  -2.778
  285    H    THR  44           H        THR  44  -0.511   5.711  -1.903
  286    HA   THR  44           HA       THR  44  -0.094   8.596  -1.820
  287    HB   THR  44           HB       THR  44  -2.207   8.897  -3.158
  288    HG1  THR  44           1HG      THR  44  -3.298   7.181  -3.621
  289   1HG2  THR  44          1HG2      THR  44  -1.228   8.320  -5.380
  290   2HG2  THR  44          2HG2      THR  44  -0.196   9.301  -4.337
  291   3HG2  THR  44          3HG2      THR  44   0.118   7.575  -4.517
  292    H    ALA  45           H        ALA  45  -1.832   9.714  -0.660
  293    HA   ALA  45           HA       ALA  45  -2.625   8.369   1.677
  294   1HB   ALA  45          1HB       ALA  45  -2.906  11.032   0.587
  295   2HB   ALA  45          2HB       ALA  45  -4.352  10.528   1.469
  296   3HB   ALA  45          3HB       ALA  45  -2.778  10.508   2.265
  297    H    ASN  46           H        ASN  46  -4.283   8.942  -1.349
  298    HA   ASN  46           HA       ASN  46  -6.454   7.202  -0.417
  299   1HB   ASN  46          1HB       ASN  46  -7.209   9.581  -0.695
  300   2HB   ASN  46          2HB       ASN  46  -6.769   9.470  -2.397
  301   1HD2  ASN  46          1HD2      ASN  46 -10.305   8.226  -1.132
  302   2HD2  ASN  46          2HD2      ASN  46  -9.194   9.139  -0.180
  303    H    TYR  47           H        TYR  47  -6.228   5.334  -1.427
  304    HA   TYR  47           HA       TYR  47  -4.728   5.144  -3.873
  305   1HB   TYR  47          1HB       TYR  47  -4.589   3.418  -2.076
  306   2HB   TYR  47          2HB       TYR  47  -6.247   2.947  -2.450
  307    HD1  TYR  47           1HD      TYR  47  -2.938   3.411  -4.139
  308    HD2  TYR  47           2HD      TYR  47  -6.594   1.252  -3.992
  309    HE1  TYR  47           1HE      TYR  47  -2.129   1.927  -5.920
  310    HE2  TYR  47           2HE      TYR  47  -5.787  -0.246  -5.764
  311    HH   TYR  47           HH       TYR  47  -3.490  -0.995  -6.648
  312    H    ASP  48           H        ASP  48  -8.140   4.978  -2.994
  313    HA   ASP  48           HA       ASP  48  -9.138   3.800  -5.296
  314   1HB   ASP  48          1HB       ASP  48 -10.296   5.773  -3.366
  315   2HB   ASP  48          2HB       ASP  48 -11.198   5.317  -4.805
  316    H    ASP  49           H        ASP  49  -8.130   7.113  -4.756
  317    HA   ASP  49           HA       ASP  49  -9.155   8.038  -7.290
  318   1HB   ASP  49          1HB       ASP  49  -7.465   9.315  -5.146
  319   2HB   ASP  49          2HB       ASP  49  -7.871  10.131  -6.647
  320    H    ASP  50           H        ASP  50  -5.874   8.014  -5.905
  321    HA   ASP  50           HA       ASP  50  -4.626   8.477  -8.417
  322   1HB   ASP  50          1HB       ASP  50  -3.681   7.946  -5.645
  323   2HB   ASP  50          2HB       ASP  50  -2.534   7.819  -6.974
  324    H    ARG  51           H        ARG  51  -5.293   5.545  -6.635
  325    HA   ARG  51           HA       ARG  51  -4.723   3.389  -6.934
  326   1HB   ARG  51          1HB       ARG  51  -5.227   4.177  -9.787
  327   2HB   ARG  51          2HB       ARG  51  -5.271   2.537  -9.144
  328   1HG   ARG  51          1HG       ARG  51  -6.864   4.051  -7.448
  329   2HG   ARG  51          2HG       ARG  51  -7.315   4.548  -9.086
  330   1HD   ARG  51          1HD       ARG  51  -7.200   1.732  -8.035
  331   2HD   ARG  51          2HD       ARG  51  -8.663   2.699  -8.214
  332    HE   ARG  51           HE       ARG  51  -7.229   2.482 -10.668
  333   1HH1  ARG  51          1HH1      ARG  51  -9.460   0.855  -8.536
  334   2HH1  ARG  51          2HH1      ARG  51 -10.115  -0.159  -9.781
  335   1HH2  ARG  51          1HH2      ARG  51  -8.122   1.181 -12.328
  336   2HH2  ARG  51          2HH2      ARG  51  -9.352   0.021 -11.936
  337    H    LYS  52           H        LYS  52  -2.496   4.714  -6.501
  338    HA   LYS  52           HA       LYS  52  -0.575   3.399  -8.279
  339   1HB   LYS  52          1HB       LYS  52  -0.409   6.046  -6.861
  340   2HB   LYS  52          2HB       LYS  52   1.066   5.149  -7.218
  341   1HG   LYS  52          1HG       LYS  52   0.544   5.168  -9.580
  342   2HG   LYS  52          2HG       LYS  52  -0.990   5.975  -9.262
  343   1HD   LYS  52          1HD       LYS  52   1.667   7.159  -8.491
  344   2HD   LYS  52          2HD       LYS  52   0.926   7.434 -10.068
  345   1HE   LYS  52          1HE       LYS  52  -0.306   8.106  -7.396
  346   2HE   LYS  52          2HE       LYS  52   0.447   9.255  -8.507
  347   1HZ   LYS  52          1HZ       LYS  52  -1.254   8.690 -10.158
  348   2HZ   LYS  52          2HZ       LYS  52  -1.979   7.622  -9.050
  349   3HZ   LYS  52          3HZ       LYS  52  -1.948   9.288  -8.731
  350    H    TRP  53           H        TRP  53   0.333   1.731  -7.381
  351    HA   TRP  53           HA       TRP  53   0.489   1.599  -4.443
  352   1HB   TRP  53          1HB       TRP  53  -0.235  -0.704  -4.613
  353   2HB   TRP  53          2HB       TRP  53  -1.400   0.339  -5.353
  354    HD1  TRP  53           HD1      TRP  53  -1.052   0.493  -8.247
  355    HE1  TRP  53           1HE      TRP  53  -0.543  -1.502  -9.808
  356    HE3  TRP  53           3HE      TRP  53   0.672  -2.690  -4.763
  357    HZ2  TRP  53           2HZ      TRP  53   0.490  -4.155  -9.534
  358    HZ3  TRP  53           3HZ      TRP  53   1.418  -4.974  -5.440
  359    HH2  TRP  53           HH2      TRP  53   1.322  -5.672  -7.783
  360    H    GLY  54           H        GLY  54   1.651  -0.496  -3.831
  361   1HA   GLY  54          1HA       GLY  54   3.806  -1.460  -5.404
  362   2HA   GLY  54          2HA       GLY  54   4.374  -0.278  -4.222
  363    H    PHE  55           H        PHE  55   4.893  -3.221  -4.260
  364    HA   PHE  55           HA       PHE  55   3.240  -4.481  -2.366
  365   1HB   PHE  55          1HB       PHE  55   6.022  -5.077  -3.336
  366   2HB   PHE  55          2HB       PHE  55   5.226  -6.060  -2.123
  367    HD1  PHE  55           1HD      PHE  55   2.437  -5.811  -3.301
  368    HD2  PHE  55           2HD      PHE  55   6.220  -6.723  -5.017
  369    HE1  PHE  55           1HE      PHE  55   1.316  -7.206  -5.003
  370    HE2  PHE  55           2HE      PHE  55   5.107  -8.104  -6.734
  371    HZ   PHE  55           HZ       PHE  55   2.659  -8.340  -6.728
  372    H    CYS  56           H        CYS  56   3.916  -5.326  -0.292
  373    HA   CYS  56           HA       CYS  56   4.655  -3.240   1.516
  374   1HB   CYS  56          1HB       CYS  56   3.053  -5.238   1.898
  375   2HB   CYS  56          2HB       CYS  56   4.511  -6.187   2.167
  376    HA   PRO  57           HA       PRO  57   9.021  -4.209   1.311
  377   1HB   PRO  57          1HB       PRO  57   9.977  -2.146   2.601
  378   2HB   PRO  57          2HB       PRO  57   9.056  -1.871   1.107
  379   1HG   PRO  57          1HG       PRO  57   8.091  -1.845   3.927
  380   2HG   PRO  57          2HG       PRO  57   7.936  -0.532   2.736
  381   1HD   PRO  57          1HD       PRO  57   5.936  -2.311   3.183
  382   2HD   PRO  57          2HD       PRO  57   6.261  -1.662   1.558
  383    H    ASP  58           H        ASP  58  10.767  -3.616   3.284
  384    HA   ASP  58           HA       ASP  58  11.824  -4.842   4.921
  385   1HB   ASP  58          1HB       ASP  58  10.830  -2.780   5.928
  386   2HB   ASP  58          2HB       ASP  58   9.476  -3.764   6.460
  387    H    GLN  59           H        GLN  59  10.766  -6.843   3.611
  388    HA   GLN  59           HA       GLN  59   9.096  -8.353   5.483
  389   1HB   GLN  59          1HB       GLN  59   9.799  -8.925   2.598
  390   2HB   GLN  59          2HB       GLN  59   8.789  -9.954   3.605
  391   1HG   GLN  59          1HG       GLN  59   7.301  -7.905   3.899
  392   2HG   GLN  59          2HG       GLN  59   8.215  -7.197   2.569
  393   1HE2  GLN  59          1HE2      GLN  59   5.152  -9.552   1.787
  394   2HE2  GLN  59          2HE2      GLN  59   5.468  -8.764   3.290
  395    H    GLY  60           H        GLY  60  11.714  -7.932   6.255
  396   1HA   GLY  60          1HA       GLY  60  12.806 -10.667   6.056
  397   2HA   GLY  60          2HA       GLY  60  13.849  -9.251   6.024
  Start of MODEL   17
    1    H    SER   1           1H       SER   1  16.224   5.438   7.534
    2    HA   SER   1           HA       SER   1  16.014   2.874   7.576
    3   1HB   SER   1          1HB       SER   1  13.604   3.881   9.116
    4   2HB   SER   1          2HB       SER   1  13.819   2.235   8.512
    5    HG   SER   1           HG       SER   1  15.336   1.860  10.014
    6    H    TRP   2           H        TRP   2  15.063   2.247   5.687
    7    HA   TRP   2           HA       TRP   2  13.729   4.345   4.146
    8   1HB   TRP   2          1HB       TRP   2  14.885   1.682   3.311
    9   2HB   TRP   2          2HB       TRP   2  14.056   2.777   2.213
   10    HD1  TRP   2           HD1      TRP   2  15.326   5.475   2.547
   11    HE1  TRP   2           1HE      TRP   2  17.837   5.897   2.163
   12    HE3  TRP   2           3HE      TRP   2  17.032   0.712   3.195
   13    HZ2  TRP   2           2HZ      TRP   2  20.226   4.393   2.140
   14    HZ3  TRP   2           3HZ      TRP   2  19.447   0.280   2.986
   15    HH2  TRP   2           HH2      TRP   2  21.013   2.085   2.471
   16    H    MET   3           H        MET   3  11.575   4.383   4.475
   17    HA   MET   3           HA       MET   3  10.129   1.874   4.736
   18   1HB   MET   3          1HB       MET   3   8.188   3.295   5.286
   19   2HB   MET   3          2HB       MET   3   9.552   3.610   6.337
   20   1HG   MET   3          1HG       MET   3  10.040   5.652   5.177
   21   2HG   MET   3          2HG       MET   3   8.810   5.301   3.962
   22   1HE   MET   3          1HE       MET   3   6.558   4.466   4.776
   23   2HE   MET   3          2HE       MET   3   6.190   4.401   6.500
   24   3HE   MET   3          3HE       MET   3   5.545   5.710   5.508
   25    H    SER   4           H        SER   4  11.359   2.431   2.303
   26    HA   SER   4           HA       SER   4   9.444   3.416   0.410
   27   1HB   SER   4          1HB       SER   4  11.985   1.846  -0.078
   28   2HB   SER   4          2HB       SER   4  11.093   2.800  -1.265
   29    HG   SER   4           HG       SER   4  11.651   4.670  -0.166
   30    H    THR   5           H        THR   5   8.683   2.056  -1.429
   31    HA   THR   5           HA       THR   5   7.838  -0.532  -0.384
   32    HB   THR   5           HB       THR   5   6.013  -0.313  -2.034
   33    HG1  THR   5           1HG      THR   5   6.751   2.363  -2.434
   34   1HG2  THR   5          1HG2      THR   5   5.551   2.235  -0.875
   35   2HG2  THR   5          2HG2      THR   5   4.828   0.680  -0.468
   36   3HG2  THR   5          3HG2      THR   5   6.320   1.189   0.320
   37    H    VAL   6           H        VAL   6   7.239  -2.107  -2.019
   38    HA   VAL   6           HA       VAL   6   9.254  -2.455  -4.159
   39    HB   VAL   6           HB       VAL   6   7.728  -4.816  -3.332
   40   1HG1  VAL   6          1HG1      VAL   6  10.381  -4.155  -4.304
   41   2HG1  VAL   6          2HG1      VAL   6  10.386  -5.431  -3.084
   42   3HG1  VAL   6          3HG1      VAL   6   9.407  -5.607  -4.542
   43   1HG2  VAL   6          1HG2      VAL   6   8.204  -3.473  -1.159
   44   2HG2  VAL   6          2HG2      VAL   6   8.498  -5.213  -1.212
   45   3HG2  VAL   6          3HG2      VAL   6   9.847  -4.086  -1.371
   46    H    GLY   7           H        GLY   7   7.706  -4.653  -5.136
   47   1HA   GLY   7          1HA       GLY   7   6.207  -4.831  -6.946
   48   2HA   GLY   7          2HA       GLY   7   5.132  -4.630  -5.607
   49    H    GLY   8           H        GLY   8   3.580  -3.339  -5.994
   50   1HA   GLY   8          1HA       GLY   8   2.298  -1.692  -6.947
   51   2HA   GLY   8          2HA       GLY   8   3.560  -0.693  -6.263
   52    H    ASN   9           H        ASN   9   3.472   0.877  -7.700
   53    HA   ASN   9           HA       ASN   9   4.811   0.443 -10.209
   54   1HB   ASN   9          1HB       ASN   9   3.082   1.590 -11.565
   55   2HB   ASN   9          2HB       ASN   9   2.559   0.035 -10.955
   56   1HD2  ASN   9          1HD2      ASN   9   0.826   2.652  -8.548
   57   2HD2  ASN   9          2HD2      ASN   9   2.482   2.172  -8.459
   58    H    SER  10           H        SER  10   4.649   1.977  -7.504
   59    HA   SER  10           HA       SER  10   5.019   4.705  -8.445
   60   1HB   SER  10          1HB       SER  10   5.040   3.609  -5.621
   61   2HB   SER  10          2HB       SER  10   4.880   5.294  -6.099
   62    HG   SER  10           HG       SER  10   2.883   4.085  -5.545
   63    H    GLY  11           H        GLY  11   6.935   2.324  -8.766
   64   1HA   GLY  11          1HA       GLY  11   9.223   2.106  -8.895
   65   2HA   GLY  11          2HA       GLY  11   9.354   3.779  -8.364
   66    H    GLY  12           H        GLY  12   9.771   4.231  -6.260
   67   1HA   GLY  12          1HA       GLY  12   9.794   2.009  -4.339
   68   2HA   GLY  12          2HA       GLY  12  11.290   2.890  -4.620
   69    H    ALA  13           H        ALA  13   8.058   4.275  -4.585
   70    HA   ALA  13           HA       ALA  13   8.858   6.277  -2.688
   71   1HB   ALA  13          1HB       ALA  13   7.007   6.217  -4.682
   72   2HB   ALA  13          2HB       ALA  13   5.990   6.022  -3.254
   73   3HB   ALA  13          3HB       ALA  13   7.055   7.420  -3.394
   74    HA   PRO  14           HA       PRO  14   7.601   4.278   1.056
   75   1HB   PRO  14          1HB       PRO  14   6.797   6.869   2.144
   76   2HB   PRO  14          2HB       PRO  14   8.145   5.831   2.615
   77   1HG   PRO  14          1HG       PRO  14   8.497   8.195   1.347
   78   2HG   PRO  14          2HG       PRO  14   9.592   6.817   1.127
   79   1HD   PRO  14          1HD       PRO  14   7.395   7.798  -0.659
   80   2HD   PRO  14          2HD       PRO  14   9.005   7.185  -1.085
   81    H    CYS  15           H        CYS  15   5.773   3.789   2.375
   82    HA   CYS  15           HA       CYS  15   3.254   4.101   0.996
   83   1HB   CYS  15          1HB       CYS  15   3.357   3.024   3.783
   84   2HB   CYS  15          2HB       CYS  15   2.420   2.456   2.411
   85    H    VAL  16           H        VAL  16   1.592   5.491   1.576
   86    HA   VAL  16           HA       VAL  16   2.171   7.333   3.792
   87    HB   VAL  16           HB       VAL  16   0.119   7.639   1.591
   88   1HG1  VAL  16          1HG1      VAL  16   0.911   9.346   3.923
   89   2HG1  VAL  16          2HG1      VAL  16   0.270  10.080   2.454
   90   3HG1  VAL  16          3HG1      VAL  16  -0.702   8.918   3.356
   91   1HG2  VAL  16          1HG2      VAL  16   2.936   8.093   1.601
   92   2HG2  VAL  16          2HG2      VAL  16   1.776   8.370   0.302
   93   3HG2  VAL  16          3HG2      VAL  16   2.101   9.639   1.481
   94    H    PHE  17           H        PHE  17   1.274   6.771   5.671
   95    HA   PHE  17           HA       PHE  17  -1.317   5.396   5.626
   96   1HB   PHE  17          1HB       PHE  17   0.856   5.469   7.713
   97   2HB   PHE  17          2HB       PHE  17  -0.709   4.715   7.949
   98    HD1  PHE  17           1HD      PHE  17  -1.337   3.049   5.869
   99    HD2  PHE  17           2HD      PHE  17   2.554   4.080   7.238
  100    HE1  PHE  17           1HE      PHE  17  -0.447   0.969   4.909
  101    HE2  PHE  17           2HE      PHE  17   3.461   2.009   6.279
  102    HZ   PHE  17           HZ       PHE  17   1.964   0.429   5.087
  103    HA   PRO  18           HA       PRO  18  -2.816   4.885   6.784
  104   1HB   PRO  18          1HB       PRO  18  -5.482   5.782   7.129
  105   2HB   PRO  18          2HB       PRO  18  -4.500   4.908   8.306
  106   1HG   PRO  18          1HG       PRO  18  -5.396   7.547   8.557
  107   2HG   PRO  18          2HG       PRO  18  -4.112   6.794   9.512
  108   1HD   PRO  18          1HD       PRO  18  -3.901   8.589   7.139
  109   2HD   PRO  18          2HD       PRO  18  -2.855   8.485   8.573
  110    H    PHE  19           H        PHE  19  -3.397   4.089   4.814
  111    HA   PHE  19           HA       PHE  19  -4.424   6.069   2.889
  112   1HB   PHE  19          1HB       PHE  19  -3.637   4.681   1.092
  113   2HB   PHE  19          2HB       PHE  19  -2.312   4.974   2.208
  114    HD1  PHE  19           1HD      PHE  19  -1.689   3.113   3.823
  115    HD2  PHE  19           2HD      PHE  19  -4.274   2.533   0.499
  116    HE1  PHE  19           1HE      PHE  19  -1.262   0.693   3.904
  117    HE2  PHE  19           2HE      PHE  19  -3.838   0.116   0.574
  118    HZ   PHE  19           HZ       PHE  19  -2.342  -0.806   2.283
  119    H    THR  20           H        THR  20  -6.404   5.873   2.114
  120    HA   THR  20           HA       THR  20  -7.996   3.663   3.145
  121    HB   THR  20           HB       THR  20  -8.974   6.050   1.564
  122    HG1  THR  20           1HG      THR  20  -8.424   7.239   3.178
  123   1HG2  THR  20          1HG2      THR  20 -10.832   5.562   3.468
  124   2HG2  THR  20          2HG2      THR  20 -10.897   4.952   1.815
  125   3HG2  THR  20          3HG2      THR  20 -10.269   3.931   3.107
  126    H    PHE  21           H        PHE  21  -8.668   2.022   2.028
  127    HA   PHE  21           HA       PHE  21  -8.797   2.175  -0.920
  128   1HB   PHE  21          1HB       PHE  21  -6.785   0.843   0.075
  129   2HB   PHE  21          2HB       PHE  21  -7.996  -0.315   0.568
  130    HD1  PHE  21           1HD      PHE  21  -8.851   1.255  -2.543
  131    HD2  PHE  21           2HD      PHE  21  -6.550  -1.861  -0.777
  132    HE1  PHE  21           1HE      PHE  21  -8.701   0.119  -4.705
  133    HE2  PHE  21           2HE      PHE  21  -6.395  -2.990  -2.937
  134    HZ   PHE  21           HZ       PHE  21  -7.456  -1.990  -4.930
  135    H    LEU  22           H        LEU  22 -10.546   1.029  -1.763
  136    HA   LEU  22           HA       LEU  22 -12.725   0.531  -1.834
  137   1HB   LEU  22          1HB       LEU  22 -11.442  -1.512  -0.127
  138   2HB   LEU  22          2HB       LEU  22 -13.003  -1.765  -0.888
  139    HG   LEU  22           HG       LEU  22 -11.828  -2.614  -2.589
  140   1HD1  LEU  22          1HD1      LEU  22 -11.688   0.134  -3.022
  141   2HD1  LEU  22          2HD1      LEU  22 -10.233  -0.645  -3.641
  142   3HD1  LEU  22          3HD1      LEU  22 -11.823  -1.180  -4.188
  143   1HD2  LEU  22          1HD2      LEU  22  -9.749  -2.040  -0.794
  144   2HD2  LEU  22          2HD2      LEU  22  -9.959  -3.409  -1.886
  145   3HD2  LEU  22          3HD2      LEU  22  -9.211  -1.923  -2.469
  146    H    GLY  23           H        GLY  23 -12.291   2.494   0.180
  147   1HA   GLY  23          1HA       GLY  23 -13.828   3.531   1.590
  148   2HA   GLY  23          2HA       GLY  23 -14.676   2.006   1.760
  149    H    ASN  24           H        ASN  24 -11.656   1.008   2.448
  150    HA   ASN  24           HA       ASN  24 -12.047   1.606   5.303
  151   1HB   ASN  24          1HB       ASN  24 -10.595  -0.661   3.938
  152   2HB   ASN  24          2HB       ASN  24 -10.721  -0.447   5.677
  153   1HD2  ASN  24          1HD2      ASN  24 -13.567  -2.341   3.698
  154   2HD2  ASN  24          2HD2      ASN  24 -11.988  -2.008   3.098
  155    H    LYS  25           H        LYS  25 -10.505   2.580   6.471
  156    HA   LYS  25           HA       LYS  25  -8.274   3.780   5.156
  157   1HB   LYS  25          1HB       LYS  25  -9.228   3.735   8.019
  158   2HB   LYS  25          2HB       LYS  25  -7.965   4.760   7.395
  159   1HG   LYS  25          1HG       LYS  25  -9.479   5.981   6.025
  160   2HG   LYS  25          2HG       LYS  25 -10.764   4.821   6.339
  161   1HD   LYS  25          1HD       LYS  25 -11.111   6.873   7.607
  162   2HD   LYS  25          2HD       LYS  25 -10.834   5.507   8.684
  163   1HE   LYS  25          1HE       LYS  25  -8.595   7.324   7.858
  164   2HE   LYS  25          2HE       LYS  25  -9.655   7.735   9.202
  165   1HZ   LYS  25          1HZ       LYS  25  -9.051   5.386  10.030
  166   2HZ   LYS  25          2HZ       LYS  25  -7.729   5.523   8.981
  167   3HZ   LYS  25          3HZ       LYS  25  -7.929   6.639  10.246
  168    H    TYR  26           H        TYR  26  -6.304   2.797   4.977
  169    HA   TYR  26           HA       TYR  26  -5.780   0.573   6.797
  170   1HB   TYR  26          1HB       TYR  26  -4.483   1.226   4.153
  171   2HB   TYR  26          2HB       TYR  26  -4.170  -0.196   5.136
  172    HD1  TYR  26           1HD      TYR  26  -7.274  -0.397   5.848
  173    HD2  TYR  26           2HD      TYR  26  -5.045  -0.181   2.245
  174    HE1  TYR  26           1HE      TYR  26  -9.038  -1.625   4.684
  175    HE2  TYR  26           2HE      TYR  26  -6.803  -1.406   1.076
  176    HH   TYR  26           HH       TYR  26  -9.653  -1.617   1.802
  177    H    GLU  27           H        GLU  27  -4.686   1.081   8.427
  178    HA   GLU  27           HA       GLU  27  -2.785   3.262   8.437
  179   1HB   GLU  27          1HB       GLU  27  -3.599   1.423  10.673
  180   2HB   GLU  27          2HB       GLU  27  -2.785   2.960  10.815
  181   1HG   GLU  27          1HG       GLU  27  -4.749   4.108   9.939
  182   2HG   GLU  27          2HG       GLU  27  -5.575   2.562   9.778
  183    H    SER  28           H        SER  28  -2.801  -0.084   8.029
  184    HA   SER  28           HA       SER  28   0.116  -0.193   8.244
  185   1HB   SER  28          1HB       SER  28  -0.348  -2.675   8.835
  186   2HB   SER  28          2HB       SER  28  -0.570  -1.477  10.108
  187    HG   SER  28           HG       SER  28  -2.329  -2.967   9.955
  188    H    CYS  29           H        CYS  29   0.629  -2.559   7.019
  189    HA   CYS  29           HA       CYS  29  -0.020  -2.013   4.324
  190   1HB   CYS  29          1HB       CYS  29   1.052  -4.564   5.533
  191   2HB   CYS  29          2HB       CYS  29   0.985  -4.206   3.828
  192    H    THR  30           H        THR  30  -1.044  -3.570   2.892
  193    HA   THR  30           HA       THR  30  -3.234  -5.110   4.094
  194    HB   THR  30           HB       THR  30  -4.149  -2.840   3.459
  195    HG1  THR  30           1HG      THR  30  -5.666  -4.385   3.291
  196   1HG2  THR  30          1HG2      THR  30  -4.364  -3.037   0.705
  197   2HG2  THR  30          2HG2      THR  30  -3.393  -1.874   1.604
  198   3HG2  THR  30          3HG2      THR  30  -2.667  -3.378   1.030
  199    H    SER  31           H        SER  31  -4.421  -6.103   1.993
  200    HA   SER  31           HA       SER  31  -2.457  -6.900   0.005
  201   1HB   SER  31          1HB       SER  31  -3.253  -9.327   0.328
  202   2HB   SER  31          2HB       SER  31  -2.146  -8.671   1.553
  203    HG   SER  31           HG       SER  31  -4.887  -9.272   1.734
  204    H    ALA  32           H        ALA  32  -4.903  -5.293   0.476
  205    HA   ALA  32           HA       ALA  32  -7.153  -6.358  -0.823
  206   1HB   ALA  32          1HB       ALA  32  -6.561  -4.082   0.608
  207   2HB   ALA  32          2HB       ALA  32  -6.779  -3.445  -1.024
  208   3HB   ALA  32          3HB       ALA  32  -8.072  -4.362  -0.255
  209    H    GLY  33           H        GLY  33  -7.961  -6.118  -2.882
  210   1HA   GLY  33          1HA       GLY  33  -7.948  -5.835  -5.155
  211   2HA   GLY  33          2HA       GLY  33  -6.742  -4.582  -4.921
  212    H    ARG  34           H        ARG  34  -5.611  -7.417  -3.556
  213    HA   ARG  34           HA       ARG  34  -4.040  -7.957  -5.992
  214   1HB   ARG  34          1HB       ARG  34  -3.451  -8.315  -3.072
  215   2HB   ARG  34          2HB       ARG  34  -2.497  -9.098  -4.315
  216   1HG   ARG  34          1HG       ARG  34  -2.318  -6.595  -5.208
  217   2HG   ARG  34          2HG       ARG  34  -2.610  -6.246  -3.504
  218   1HD   ARG  34          1HD       ARG  34  -0.178  -7.035  -4.710
  219   2HD   ARG  34          2HD       ARG  34  -0.467  -6.741  -3.016
  220    HE   ARG  34           HE       ARG  34  -0.356  -9.293  -4.369
  221   1HH1  ARG  34          1HH1      ARG  34  -1.001  -7.370  -1.596
  222   2HH1  ARG  34          2HH1      ARG  34  -1.115  -8.711  -0.507
  223   1HH2  ARG  34          1HH2      ARG  34  -0.604 -11.074  -3.068
  224   2HH2  ARG  34          2HH2      ARG  34  -0.943 -10.874  -1.375
  225    H    SER  35           H        SER  35  -4.696  -9.893  -3.119
  226    HA   SER  35           HA       SER  35  -5.678 -11.889  -2.768
  227   1HB   SER  35          1HB       SER  35  -6.618 -11.719  -5.629
  228   2HB   SER  35          2HB       SER  35  -7.181 -12.876  -4.423
  229    HG   SER  35           HG       SER  35  -8.491 -11.405  -3.703
  230    H    ASP  36           H        ASP  36  -2.842 -11.730  -3.912
  231    HA   ASP  36           HA       ASP  36  -2.842 -14.467  -4.916
  232   1HB   ASP  36          1HB       ASP  36  -0.552 -13.967  -5.840
  233   2HB   ASP  36          2HB       ASP  36  -1.903 -13.252  -6.669
  234    H    GLY  37           H        GLY  37  -0.069 -12.734  -3.667
  235   1HA   GLY  37          1HA       GLY  37  -0.127 -14.486  -1.347
  236   2HA   GLY  37          2HA       GLY  37   1.281 -14.522  -2.371
  237    H    LYS  38           H        LYS  38   1.681 -11.777  -2.790
  238    HA   LYS  38           HA       LYS  38   3.143 -11.063  -0.511
  239   1HB   LYS  38          1HB       LYS  38   2.214  -9.136  -2.642
  240   2HB   LYS  38          2HB       LYS  38   3.715  -9.105  -1.705
  241   1HG   LYS  38          1HG       LYS  38   4.575  -9.968  -3.594
  242   2HG   LYS  38          2HG       LYS  38   4.036 -11.477  -2.887
  243   1HD   LYS  38          1HD       LYS  38   1.965 -11.336  -4.206
  244   2HD   LYS  38          2HD       LYS  38   2.550  -9.839  -4.940
  245   1HE   LYS  38          1HE       LYS  38   4.525 -11.082  -5.779
  246   2HE   LYS  38          2HE       LYS  38   3.826 -12.565  -5.132
  247   1HZ   LYS  38          1HZ       LYS  38   1.792 -11.676  -6.619
  248   2HZ   LYS  38          2HZ       LYS  38   3.103 -11.056  -7.507
  249   3HZ   LYS  38          3HZ       LYS  38   2.999 -12.722  -7.204
  250    H    MET  39           H        MET  39   2.759  -8.310  -0.379
  251    HA   MET  39           HA       MET  39   0.129  -7.599   0.435
  252   1HB   MET  39          1HB       MET  39   2.336  -7.937   2.476
  253   2HB   MET  39          2HB       MET  39   0.976  -6.864   2.700
  254   1HG   MET  39          1HG       MET  39  -0.564  -8.736   2.585
  255   2HG   MET  39          2HG       MET  39   0.787  -9.834   2.311
  256   1HE   MET  39          1HE       MET  39  -0.893  -7.319   4.663
  257   2HE   MET  39          2HE       MET  39  -0.146  -7.605   6.234
  258   3HE   MET  39          3HE       MET  39   0.752  -6.760   4.970
  259    H    TRP  40           H        TRP  40  -0.037  -5.308   0.518
  260    HA   TRP  40           HA       TRP  40   2.462  -3.884  -0.082
  261   1HB   TRP  40          1HB       TRP  40   1.292  -2.623  -1.853
  262   2HB   TRP  40          2HB       TRP  40   1.382  -4.340  -2.211
  263    HD1  TRP  40           HD1      TRP  40  -0.998  -5.748  -1.650
  264    HE1  TRP  40           1HE      TRP  40  -3.428  -4.946  -1.938
  265    HE3  TRP  40           3HE      TRP  40  -0.171  -0.733  -1.900
  266    HZ2  TRP  40           2HZ      TRP  40  -4.795  -2.517  -2.218
  267    HZ3  TRP  40           3HZ      TRP  40  -2.091   0.764  -2.172
  268    HH2  TRP  40           HH2      TRP  40  -4.360  -0.112  -2.334
  269    H    CYS  41           H        CYS  41   1.737  -1.462  -0.492
  270    HA   CYS  41           HA       CYS  41  -0.142  -0.415   1.446
  271   1HB   CYS  41          1HB       CYS  41   1.663   1.089   2.406
  272   2HB   CYS  41          2HB       CYS  41   1.757  -0.598   2.906
  273    H    ALA  42           H        ALA  42  -0.926   1.551   0.701
  274    HA   ALA  42           HA       ALA  42  -0.157   2.288  -1.956
  275   1HB   ALA  42          1HB       ALA  42  -2.356   2.843  -0.250
  276   2HB   ALA  42          2HB       ALA  42  -1.675   4.377  -0.789
  277   3HB   ALA  42          3HB       ALA  42  -2.186   3.175  -1.974
  278    H    THR  43           H        THR  43   0.734   4.235  -2.625
  279    HA   THR  43           HA       THR  43   2.564   5.401  -0.657
  280    HB   THR  43           HB       THR  43   3.864   6.113  -2.610
  281    HG1  THR  43           1HG      THR  43   2.077   6.414  -4.046
  282   1HG2  THR  43          1HG2      THR  43   3.648   3.551  -3.698
  283   2HG2  THR  43          2HG2      THR  43   4.783   4.092  -2.460
  284   3HG2  THR  43          3HG2      THR  43   3.240   3.377  -1.993
  285    H    THR  44           H        THR  44  -0.356   5.926  -1.231
  286    HA   THR  44           HA       THR  44  -0.166   8.846  -1.283
  287    HB   THR  44           HB       THR  44  -2.250   8.934  -2.634
  288    HG1  THR  44           1HG      THR  44  -3.328   7.182  -2.973
  289   1HG2  THR  44          1HG2      THR  44  -0.693   7.257  -4.426
  290   2HG2  THR  44          2HG2      THR  44  -1.142   8.958  -4.562
  291   3HG2  THR  44          3HG2      THR  44   0.268   8.490  -3.606
  292    H    ALA  45           H        ALA  45  -1.840   9.889  -0.048
  293    HA   ALA  45           HA       ALA  45  -2.555   8.553   2.322
  294   1HB   ALA  45          1HB       ALA  45  -2.376  11.091   1.828
  295   2HB   ALA  45          2HB       ALA  45  -4.070  10.950   1.360
  296   3HB   ALA  45          3HB       ALA  45  -3.571  10.528   2.999
  297    H    ASN  46           H        ASN  46  -4.335   9.126  -0.651
  298    HA   ASN  46           HA       ASN  46  -6.397   7.280   0.337
  299   1HB   ASN  46          1HB       ASN  46  -7.262   9.620   0.163
  300   2HB   ASN  46          2HB       ASN  46  -6.878   9.595  -1.558
  301   1HD2  ASN  46          1HD2      ASN  46 -10.309   8.128  -0.205
  302   2HD2  ASN  46          2HD2      ASN  46  -9.189   9.022   0.756
  303    H    TYR  47           H        TYR  47  -5.975   5.431  -0.682
  304    HA   TYR  47           HA       TYR  47  -4.634   5.341  -3.194
  305   1HB   TYR  47          1HB       TYR  47  -4.378   3.615  -1.427
  306   2HB   TYR  47          2HB       TYR  47  -6.031   3.090  -1.748
  307    HD1  TYR  47           1HD      TYR  47  -2.824   3.713  -3.560
  308    HD2  TYR  47           2HD      TYR  47  -6.354   1.367  -3.252
  309    HE1  TYR  47           1HE      TYR  47  -2.013   2.263  -5.374
  310    HE2  TYR  47           2HE      TYR  47  -5.546  -0.089  -5.049
  311    HH   TYR  47           HH       TYR  47  -3.830  -0.632  -6.338
  312    H    ASP  48           H        ASP  48  -7.980   5.092  -2.199
  313    HA   ASP  48           HA       ASP  48  -9.100   3.914  -4.436
  314   1HB   ASP  48          1HB       ASP  48 -10.131   5.871  -2.421
  315   2HB   ASP  48          2HB       ASP  48 -11.131   5.416  -3.797
  316    H    ASP  49           H        ASP  49  -8.083   7.233  -3.979
  317    HA   ASP  49           HA       ASP  49  -9.238   8.037  -6.524
  318   1HB   ASP  49          1HB       ASP  49  -7.884   9.537  -4.300
  319   2HB   ASP  49          2HB       ASP  49  -8.311  10.296  -5.825
  320    H    ASP  50           H        ASP  50  -6.005   8.306  -4.988
  321    HA   ASP  50           HA       ASP  50  -4.782   9.023  -7.477
  322   1HB   ASP  50          1HB       ASP  50  -3.587   8.327  -4.792
  323   2HB   ASP  50          2HB       ASP  50  -2.651   8.881  -6.175
  324    H    ARG  51           H        ARG  51  -5.385   6.006  -5.949
  325    HA   ARG  51           HA       ARG  51  -4.605   3.909  -6.228
  326   1HB   ARG  51          1HB       ARG  51  -5.074   4.829  -9.027
  327   2HB   ARG  51          2HB       ARG  51  -4.967   3.140  -8.534
  328   1HG   ARG  51          1HG       ARG  51  -6.744   4.089  -6.742
  329   2HG   ARG  51          2HG       ARG  51  -7.121   5.093  -8.150
  330   1HD   ARG  51          1HD       ARG  51  -6.838   2.123  -8.321
  331   2HD   ARG  51          2HD       ARG  51  -8.356   2.893  -7.853
  332    HE   ARG  51           HE       ARG  51  -7.565   4.142 -10.185
  333   1HH1  ARG  51          1HH1      ARG  51  -8.316   0.856  -9.250
  334   2HH1  ARG  51          2HH1      ARG  51  -8.995   0.436 -10.792
  335   1HH2  ARG  51          1HH2      ARG  51  -8.392   3.590 -12.217
  336   2HH2  ARG  51          2HH2      ARG  51  -9.054   2.004 -12.485
  337    H    LYS  52           H        LYS  52  -2.348   5.083  -5.586
  338    HA   LYS  52           HA       LYS  52  -0.458   3.843  -7.442
  339   1HB   LYS  52          1HB       LYS  52  -0.150   6.460  -5.992
  340   2HB   LYS  52          2HB       LYS  52   1.261   5.531  -6.483
  341   1HG   LYS  52          1HG       LYS  52   0.400   5.569  -8.817
  342   2HG   LYS  52          2HG       LYS  52  -0.888   6.641  -8.265
  343   1HD   LYS  52          1HD       LYS  52   0.710   8.318  -7.636
  344   2HD   LYS  52          2HD       LYS  52   2.059   7.232  -7.985
  345   1HE   LYS  52          1HE       LYS  52   1.254   7.151 -10.363
  346   2HE   LYS  52          2HE       LYS  52   0.087   8.404  -9.943
  347   1HZ   LYS  52          1HZ       LYS  52   3.037   8.677  -9.722
  348   2HZ   LYS  52          2HZ       LYS  52   2.086   9.320 -10.964
  349   3HZ   LYS  52          3HZ       LYS  52   1.899   9.881  -9.368
  350    H    TRP  53           H        TRP  53   0.400   2.131  -6.583
  351    HA   TRP  53           HA       TRP  53   0.615   2.001  -3.652
  352   1HB   TRP  53          1HB       TRP  53  -0.052  -0.314  -3.798
  353   2HB   TRP  53          2HB       TRP  53  -1.249   0.700  -4.516
  354    HD1  TRP  53           HD1      TRP  53  -0.885   0.846  -7.445
  355    HE1  TRP  53           1HE      TRP  53  -0.464  -1.194  -8.972
  356    HE3  TRP  53           3HE      TRP  53   0.756  -2.318  -3.916
  357    HZ2  TRP  53           2HZ      TRP  53   0.485  -3.875  -8.657
  358    HZ3  TRP  53           3HZ      TRP  53   1.421  -4.634  -4.551
  359    HH2  TRP  53           HH2      TRP  53   1.281  -5.382  -6.882
  360    H    GLY  54           H        GLY  54   1.886   0.121  -2.918
  361   1HA   GLY  54          1HA       GLY  54   4.130  -0.714  -4.525
  362   2HA   GLY  54          2HA       GLY  54   4.553   0.397  -3.224
  363    H    PHE  55           H        PHE  55   5.352  -2.385  -3.468
  364    HA   PHE  55           HA       PHE  55   3.732  -3.897  -1.650
  365   1HB   PHE  55          1HB       PHE  55   6.174  -4.391  -3.249
  366   2HB   PHE  55          2HB       PHE  55   5.962  -5.378  -1.810
  367    HD1  PHE  55           1HD      PHE  55   2.892  -5.106  -2.102
  368    HD2  PHE  55           2HD      PHE  55   5.994  -6.413  -4.684
  369    HE1  PHE  55           1HE      PHE  55   1.286  -6.600  -3.213
  370    HE2  PHE  55           2HE      PHE  55   4.383  -7.914  -5.832
  371    HZ   PHE  55           HZ       PHE  55   2.022  -8.006  -5.087
  372    H    CYS  56           H        CYS  56   4.440  -4.880   0.267
  373    HA   CYS  56           HA       CYS  56   6.165  -3.166   1.905
  374   1HB   CYS  56          1HB       CYS  56   4.146  -5.306   2.699
  375   2HB   CYS  56          2HB       CYS  56   5.144  -4.397   3.840
  376    HA   PRO  57           HA       PRO  57   9.144  -6.382   1.233
  377   1HB   PRO  57          1HB       PRO  57  11.224  -5.347   2.474
  378   2HB   PRO  57          2HB       PRO  57  10.543  -4.536   1.047
  379   1HG   PRO  57          1HG       PRO  57   9.922  -4.068   3.928
  380   2HG   PRO  57          2HG       PRO  57  10.524  -2.864   2.763
  381   1HD   PRO  57          1HD       PRO  57   7.903  -3.058   3.276
  382   2HD   PRO  57          2HD       PRO  57   8.467  -2.831   1.602
  383    H    ASP  58           H        ASP  58  11.126  -6.994   2.975
  384    HA   ASP  58           HA       ASP  58  11.572  -8.682   4.437
  385   1HB   ASP  58          1HB       ASP  58  11.746  -6.599   5.743
  386   2HB   ASP  58          2HB       ASP  58  10.069  -6.789   6.236
  387    H    GLN  59           H        GLN  59   9.784  -9.859   3.065
  388    HA   GLN  59           HA       GLN  59   7.700 -10.797   4.921
  389   1HB   GLN  59          1HB       GLN  59   7.714 -10.702   1.906
  390   2HB   GLN  59          2HB       GLN  59   6.549 -11.648   2.821
  391   1HG   GLN  59          1HG       GLN  59   5.993  -9.459   4.014
  392   2HG   GLN  59          2HG       GLN  59   6.863  -8.678   2.687
  393   1HE2  GLN  59          1HE2      GLN  59   3.085  -9.783   2.217
  394   2HE2  GLN  59          2HE2      GLN  59   3.914  -9.713   3.731
  395    H    GLY  60           H        GLY  60  10.570 -11.666   4.479
  396   1HA   GLY  60          1HA       GLY  60   9.945 -14.524   4.089
  397   2HA   GLY  60          2HA       GLY  60  11.406 -13.802   3.426
  Start of MODEL   18
    1    H    SER   1           1H       SER   1  18.779   6.013  -0.132
    2    HA   SER   1           HA       SER   1  16.695   5.266  -0.173
    3   1HB   SER   1          1HB       SER   1  18.326   3.476  -0.685
    4   2HB   SER   1          2HB       SER   1  18.273   2.955   0.999
    5    HG   SER   1           HG       SER   1  16.743   1.703   0.225
    6    H    TRP   2           H        TRP   2  14.864   5.449   0.913
    7    HA   TRP   2           HA       TRP   2  14.907   5.194   3.831
    8   1HB   TRP   2          1HB       TRP   2  12.601   6.296   3.598
    9   2HB   TRP   2          2HB       TRP   2  14.005   7.277   3.211
   10    HD1  TRP   2           HD1      TRP   2  11.711   4.944   1.072
   11    HE1  TRP   2           1HE      TRP   2  11.119   6.206  -1.092
   12    HE3  TRP   2           3HE      TRP   2  14.246   9.296   1.950
   13    HZ2  TRP   2           2HZ      TRP   2  11.651   8.714  -2.263
   14    HZ3  TRP   2           3HZ      TRP   2  14.148  11.075   0.258
   15    HH2  TRP   2           HH2      TRP   2  12.878  10.788  -1.806
   16    H    MET   3           H        MET   3  11.817   4.943   3.435
   17    HA   MET   3           HA       MET   3  11.814   2.032   3.542
   18   1HB   MET   3          1HB       MET   3   9.579   4.021   4.034
   19   2HB   MET   3          2HB       MET   3   9.489   2.290   4.319
   20   1HG   MET   3          1HG       MET   3  11.178   2.441   6.039
   21   2HG   MET   3          2HG       MET   3  11.390   4.160   5.707
   22   1HE   MET   3          1HE       MET   3  11.246   3.341   8.341
   23   2HE   MET   3          2HE       MET   3  10.575   4.959   8.561
   24   3HE   MET   3          3HE       MET   3   9.754   3.562   9.259
   25    H    SER   4           H        SER   4  12.411   2.178   1.146
   26    HA   SER   4           HA       SER   4  10.435   2.989  -0.729
   27   1HB   SER   4          1HB       SER   4  12.608   0.968  -1.279
   28   2HB   SER   4          2HB       SER   4  11.897   2.140  -2.391
   29    HG   SER   4           HG       SER   4  13.932   2.440  -0.557
   30    H    THR   5           H        THR   5   9.396   1.505  -2.292
   31    HA   THR   5           HA       THR   5   8.351  -0.858  -0.912
   32    HB   THR   5           HB       THR   5   6.482  -0.560  -2.641
   33    HG1  THR   5           1HG      THR   5   7.329   2.110  -2.787
   34   1HG2  THR   5          1HG2      THR   5   6.205   1.888  -1.199
   35   2HG2  THR   5          2HG2      THR   5   5.327   0.369  -1.019
   36   3HG2  THR   5          3HG2      THR   5   6.842   0.623  -0.148
   37    H    VAL   6           H        VAL   6   7.416  -2.470  -2.493
   38    HA   VAL   6           HA       VAL   6   9.315  -3.073  -4.681
   39    HB   VAL   6           HB       VAL   6   7.751  -5.345  -3.759
   40   1HG1  VAL   6          1HG1      VAL   6  10.341  -4.787  -4.827
   41   2HG1  VAL   6          2HG1      VAL   6  10.498  -5.833  -3.415
   42   3HG1  VAL   6          3HG1      VAL   6   9.461  -6.315  -4.758
   43   1HG2  VAL   6          1HG2      VAL   6   9.106  -3.766  -1.697
   44   2HG2  VAL   6          2HG2      VAL   6   7.830  -4.974  -1.556
   45   3HG2  VAL   6          3HG2      VAL   6   9.513  -5.483  -1.704
   46    H    GLY   7           H        GLY   7   7.847  -5.026  -5.883
   47   1HA   GLY   7          1HA       GLY   7   6.250  -5.116  -7.585
   48   2HA   GLY   7          2HA       GLY   7   5.190  -4.990  -6.207
   49    H    GLY   8           H        GLY   8   3.671  -3.612  -6.492
   50   1HA   GLY   8          1HA       GLY   8   2.443  -1.869  -7.384
   51   2HA   GLY   8          2HA       GLY   8   3.676  -0.978  -6.525
   52    H    ASN   9           H        ASN   9   3.800   0.758  -7.772
   53    HA   ASN   9           HA       ASN   9   5.127   0.424 -10.323
   54   1HB   ASN   9          1HB       ASN   9   3.650   2.049 -11.484
   55   2HB   ASN   9          2HB       ASN   9   2.866   0.536 -11.104
   56   1HD2  ASN   9          1HD2      ASN   9   1.531   3.005  -8.337
   57   2HD2  ASN   9          2HD2      ASN   9   3.077   2.234  -8.313
   58    H    SER  10           H        SER  10   4.977   1.773  -7.404
   59    HA   SER  10           HA       SER  10   6.042   4.375  -8.100
   60   1HB   SER  10          1HB       SER  10   5.725   3.173  -5.346
   61   2HB   SER  10          2HB       SER  10   5.817   4.877  -5.781
   62    HG   SER  10           HG       SER  10   3.653   4.103  -5.344
   63    H    GLY  11           H        GLY  11   7.055   1.731  -5.910
   64   1HA   GLY  11          1HA       GLY  11   9.121   0.710  -5.687
   65   2HA   GLY  11          2HA       GLY  11   9.691   1.649  -7.060
   66    H    GLY  12           H        GLY  12  10.144   3.973  -6.626
   67   1HA   GLY  12          1HA       GLY  12  11.886   4.172  -4.365
   68   2HA   GLY  12          2HA       GLY  12  11.566   5.432  -5.548
   69    H    ALA  13           H        ALA  13   8.576   4.785  -4.724
   70    HA   ALA  13           HA       ALA  13   8.555   6.863  -2.682
   71   1HB   ALA  13          1HB       ALA  13   7.089   6.917  -4.758
   72   2HB   ALA  13          2HB       ALA  13   6.129   5.657  -3.983
   73   3HB   ALA  13          3HB       ALA  13   6.296   7.239  -3.216
   74    HA   PRO  14           HA       PRO  14   7.644   3.904   0.484
   75   1HB   PRO  14          1HB       PRO  14   7.272   5.643   2.510
   76   2HB   PRO  14          2HB       PRO  14   8.863   5.368   1.791
   77   1HG   PRO  14          1HG       PRO  14   7.011   7.669   1.490
   78   2HG   PRO  14          2HG       PRO  14   8.778   7.627   1.410
   79   1HD   PRO  14          1HD       PRO  14   6.981   7.680  -0.773
   80   2HD   PRO  14          2HD       PRO  14   8.733   7.411  -0.842
   81    H    CYS  15           H        CYS  15   5.907   3.415   2.114
   82    HA   CYS  15           HA       CYS  15   3.315   3.856   0.926
   83   1HB   CYS  15          1HB       CYS  15   3.590   2.603   3.626
   84   2HB   CYS  15          2HB       CYS  15   2.537   2.161   2.290
   85    H    VAL  16           H        VAL  16   1.656   5.122   1.745
   86    HA   VAL  16           HA       VAL  16   2.374   6.883   3.996
   87    HB   VAL  16           HB       VAL  16   0.325   7.360   1.824
   88   1HG1  VAL  16          1HG1      VAL  16   0.045   8.354   4.234
   89   2HG1  VAL  16          2HG1      VAL  16   1.296   9.474   3.694
   90   3HG1  VAL  16          3HG1      VAL  16  -0.229   9.363   2.812
   91   1HG2  VAL  16          1HG2      VAL  16   3.162   7.850   1.935
   92   2HG2  VAL  16          2HG2      VAL  16   2.041   8.052   0.589
   93   3HG2  VAL  16          3HG2      VAL  16   2.264   9.357   1.754
   94    H    PHE  17           H        PHE  17   1.481   6.215   5.857
   95    HA   PHE  17           HA       PHE  17  -1.190   4.993   5.754
   96   1HB   PHE  17          1HB       PHE  17   1.067   4.614   7.727
   97   2HB   PHE  17          2HB       PHE  17  -0.545   3.968   7.949
   98    HD1  PHE  17           1HD      PHE  17  -0.456   3.584   4.666
   99    HD2  PHE  17           2HD      PHE  17   1.673   2.205   8.072
  100    HE1  PHE  17           1HE      PHE  17   0.239   1.584   3.416
  101    HE2  PHE  17           2HE      PHE  17   2.381   0.208   6.847
  102    HZ   PHE  17           HZ       PHE  17   1.672  -0.137   4.498
  103    HA   PRO  18           HA       PRO  18  -2.667   4.425   6.992
  104   1HB   PRO  18          1HB       PRO  18  -5.222   5.506   7.580
  105   2HB   PRO  18          2HB       PRO  18  -4.286   4.384   8.572
  106   1HG   PRO  18          1HG       PRO  18  -4.902   7.018   9.247
  107   2HG   PRO  18          2HG       PRO  18  -3.619   6.043   9.983
  108   1HD   PRO  18          1HD       PRO  18  -3.433   8.127   7.842
  109   2HD   PRO  18          2HD       PRO  18  -2.309   7.766   9.176
  110    H    PHE  19           H        PHE  19  -3.435   3.896   5.003
  111    HA   PHE  19           HA       PHE  19  -4.353   6.152   3.352
  112   1HB   PHE  19          1HB       PHE  19  -3.798   4.884   1.367
  113   2HB   PHE  19          2HB       PHE  19  -2.401   4.945   2.426
  114    HD1  PHE  19           1HD      PHE  19  -1.785   2.891   3.731
  115    HD2  PHE  19           2HD      PHE  19  -4.725   2.848   0.657
  116    HE1  PHE  19           1HE      PHE  19  -1.529   0.455   3.525
  117    HE2  PHE  19           2HE      PHE  19  -4.475   0.409   0.448
  118    HZ   PHE  19           HZ       PHE  19  -2.871  -0.791   1.881
  119    H    THR  20           H        THR  20  -5.871   5.087   1.445
  120    HA   THR  20           HA       THR  20  -7.860   3.453   2.858
  121    HB   THR  20           HB       THR  20  -8.496   5.932   1.232
  122    HG1  THR  20           1HG      THR  20  -7.593   6.500   3.214
  123   1HG2  THR  20          1HG2      THR  20 -10.685   5.537   2.708
  124   2HG2  THR  20          2HG2      THR  20 -10.489   4.909   1.071
  125   3HG2  THR  20          3HG2      THR  20 -10.193   3.861   2.459
  126    H    PHE  21           H        PHE  21  -8.533   1.806   1.750
  127    HA   PHE  21           HA       PHE  21  -8.558   1.899  -1.193
  128   1HB   PHE  21          1HB       PHE  21  -6.522   0.639  -0.194
  129   2HB   PHE  21          2HB       PHE  21  -7.689  -0.553   0.328
  130    HD1  PHE  21           1HD      PHE  21  -8.313   1.086  -2.885
  131    HD2  PHE  21           2HD      PHE  21  -6.502  -2.222  -0.929
  132    HE1  PHE  21           1HE      PHE  21  -8.095  -0.089  -5.031
  133    HE2  PHE  21           2HE      PHE  21  -6.293  -3.399  -3.054
  134    HZ   PHE  21           HZ       PHE  21  -7.078  -2.326  -5.135
  135    H    LEU  22           H        LEU  22 -10.270   0.796  -2.078
  136    HA   LEU  22           HA       LEU  22 -12.428   0.261  -2.229
  137   1HB   LEU  22          1HB       LEU  22 -11.116  -1.793  -0.573
  138   2HB   LEU  22          2HB       LEU  22 -12.688  -2.061  -1.313
  139    HG   LEU  22           HG       LEU  22 -11.603  -2.746  -3.128
  140   1HD1  LEU  22          1HD1      LEU  22 -11.428  -0.089  -3.453
  141   2HD1  LEU  22          2HD1      LEU  22  -9.786  -0.668  -3.740
  142   3HD1  LEU  22          3HD1      LEU  22 -11.129  -1.322  -4.678
  143   1HD2  LEU  22          1HD2      LEU  22  -9.782  -3.024  -1.262
  144   2HD2  LEU  22          2HD2      LEU  22  -9.604  -3.592  -2.923
  145   3HD2  LEU  22          3HD2      LEU  22  -8.915  -2.042  -2.447
  146    H    GLY  23           H        GLY  23 -12.159   2.175  -0.155
  147   1HA   GLY  23          1HA       GLY  23 -13.738   3.112   1.270
  148   2HA   GLY  23          2HA       GLY  23 -14.596   1.585   1.275
  149    H    ASN  24           H        ASN  24 -11.472   0.763   2.085
  150    HA   ASN  24           HA       ASN  24 -12.152   0.957   4.947
  151   1HB   ASN  24          1HB       ASN  24 -10.278  -0.943   3.523
  152   2HB   ASN  24          2HB       ASN  24 -10.652  -0.960   5.239
  153   1HD2  ASN  24          1HD2      ASN  24 -12.963  -2.877   2.648
  154   2HD2  ASN  24          2HD2      ASN  24 -11.417  -2.214   2.277
  155    H    LYS  25           H        LYS  25 -10.459   1.388   6.462
  156    HA   LYS  25           HA       LYS  25  -8.459   3.225   5.444
  157   1HB   LYS  25          1HB       LYS  25  -9.345   2.530   8.251
  158   2HB   LYS  25          2HB       LYS  25  -8.293   3.841   7.797
  159   1HG   LYS  25          1HG       LYS  25 -10.024   5.069   6.808
  160   2HG   LYS  25          2HG       LYS  25 -11.086   3.661   6.745
  161   1HD   LYS  25          1HD       LYS  25 -11.976   4.790   8.535
  162   2HD   LYS  25          2HD       LYS  25 -10.836   3.729   9.353
  163   1HE   LYS  25          1HE       LYS  25 -10.372   6.621   8.634
  164   2HE   LYS  25          2HE       LYS  25 -10.727   5.999  10.243
  165   1HZ   LYS  25          1HZ       LYS  25  -8.624   4.628   9.946
  166   2HZ   LYS  25          2HZ       LYS  25  -8.272   5.643   8.628
  167   3HZ   LYS  25          3HZ       LYS  25  -8.430   6.302  10.181
  168    H    TYR  26           H        TYR  26  -6.339   2.575   5.280
  169    HA   TYR  26           HA       TYR  26  -5.648   0.075   6.648
  170   1HB   TYR  26          1HB       TYR  26  -4.502   1.238   4.117
  171   2HB   TYR  26          2HB       TYR  26  -4.001  -0.265   4.872
  172    HD1  TYR  26           1HD      TYR  26  -7.000   1.409   3.452
  173    HD2  TYR  26           2HD      TYR  26  -5.016  -2.249   4.254
  174    HE1  TYR  26           1HE      TYR  26  -8.709   0.212   2.191
  175    HE2  TYR  26           2HE      TYR  26  -6.714  -3.463   2.980
  176    HH   TYR  26           HH       TYR  26  -9.203  -1.775   1.169
  177    H    GLU  27           H        GLU  27  -4.505   0.390   8.323
  178    HA   GLU  27           HA       GLU  27  -2.667   2.640   8.537
  179   1HB   GLU  27          1HB       GLU  27  -3.768   0.677  10.530
  180   2HB   GLU  27          2HB       GLU  27  -2.570   1.881  10.929
  181   1HG   GLU  27          1HG       GLU  27  -4.088   3.661  10.463
  182   2HG   GLU  27          2HG       GLU  27  -5.262   2.538   9.777
  183    H    SER  28           H        SER  28  -2.626  -0.547   7.663
  184    HA   SER  28           HA       SER  28   0.261  -0.748   8.055
  185   1HB   SER  28          1HB       SER  28  -0.251  -3.256   8.434
  186   2HB   SER  28          2HB       SER  28  -0.572  -2.156   9.776
  187    HG   SER  28           HG       SER  28  -2.262  -3.825   8.807
  188    H    CYS  29           H        CYS  29   0.741  -3.067   6.667
  189    HA   CYS  29           HA       CYS  29   0.141  -2.281   3.997
  190   1HB   CYS  29          1HB       CYS  29   1.404  -4.784   5.100
  191   2HB   CYS  29          2HB       CYS  29   1.151  -4.523   3.392
  192    H    THR  30           H        THR  30  -0.803  -3.933   2.456
  193    HA   THR  30           HA       THR  30  -2.997  -5.460   3.649
  194    HB   THR  30           HB       THR  30  -3.939  -3.184   3.174
  195    HG1  THR  30           1HG      THR  30  -5.445  -4.714   2.946
  196   1HG2  THR  30          1HG2      THR  30  -3.595  -3.723   0.257
  197   2HG2  THR  30          2HG2      THR  30  -3.969  -2.212   1.085
  198   3HG2  THR  30          3HG2      THR  30  -2.337  -2.877   1.154
  199    H    SER  31           H        SER  31  -4.167  -6.696   1.983
  200    HA   SER  31           HA       SER  31  -2.421  -7.429  -0.265
  201   1HB   SER  31          1HB       SER  31  -3.317  -9.749  -0.034
  202   2HB   SER  31          2HB       SER  31  -2.382  -9.237   1.371
  203    HG   SER  31           HG       SER  31  -4.460  -8.686   2.350
  204    H    ALA  32           H        ALA  32  -4.836  -5.666   0.450
  205    HA   ALA  32           HA       ALA  32  -7.156  -6.513  -0.814
  206   1HB   ALA  32          1HB       ALA  32  -5.977  -3.816  -0.242
  207   2HB   ALA  32          2HB       ALA  32  -7.450  -3.941  -1.201
  208   3HB   ALA  32          3HB       ALA  32  -7.418  -4.568   0.447
  209    H    GLY  33           H        GLY  33  -7.900  -6.558  -2.839
  210   1HA   GLY  33          1HA       GLY  33  -7.951  -6.276  -5.135
  211   2HA   GLY  33          2HA       GLY  33  -6.587  -5.173  -4.991
  212    H    ARG  34           H        ARG  34  -5.423  -7.653  -3.350
  213    HA   ARG  34           HA       ARG  34  -4.348  -8.971  -5.748
  214   1HB   ARG  34          1HB       ARG  34  -3.083  -8.774  -3.008
  215   2HB   ARG  34          2HB       ARG  34  -2.370  -9.477  -4.432
  216   1HG   ARG  34          1HG       ARG  34  -2.749  -7.042  -5.394
  217   2HG   ARG  34          2HG       ARG  34  -2.671  -6.638  -3.683
  218   1HD   ARG  34          1HD       ARG  34  -0.469  -6.518  -4.773
  219   2HD   ARG  34          2HD       ARG  34  -0.510  -7.718  -3.478
  220    HE   ARG  34           HE       ARG  34  -0.086  -9.336  -5.022
  221   1HH1  ARG  34          1HH1      ARG  34  -1.166  -6.458  -6.677
  222   2HH1  ARG  34          2HH1      ARG  34  -0.957  -7.117  -8.268
  223   1HH2  ARG  34          1HH2      ARG  34   0.232 -10.222  -7.098
  224   2HH2  ARG  34          2HH2      ARG  34  -0.160  -9.282  -8.504
  225    H    SER  35           H        SER  35  -4.500  -9.752  -2.316
  226    HA   SER  35           HA       SER  35  -5.056 -11.600  -1.147
  227   1HB   SER  35          1HB       SER  35  -7.088 -11.896  -3.366
  228   2HB   SER  35          2HB       SER  35  -7.125 -12.772  -1.833
  229    HG   SER  35           HG       SER  35  -8.445 -10.922  -1.740
  230    H    ASP  36           H        ASP  36  -3.002 -11.818  -3.254
  231    HA   ASP  36           HA       ASP  36  -3.263 -14.617  -3.996
  232   1HB   ASP  36          1HB       ASP  36  -1.266 -14.162  -5.434
  233   2HB   ASP  36          2HB       ASP  36  -2.696 -13.267  -5.861
  234    H    GLY  37           H        GLY  37  -0.720 -12.496  -2.910
  235   1HA   GLY  37          1HA       GLY  37  -0.047 -14.033  -0.648
  236   2HA   GLY  37          2HA       GLY  37   1.062 -14.393  -1.958
  237    H    LYS  38           H        LYS  38   1.432 -11.948  -3.140
  238    HA   LYS  38           HA       LYS  38   3.202 -10.700  -1.308
  239   1HB   LYS  38          1HB       LYS  38   2.306  -9.526  -3.924
  240   2HB   LYS  38          2HB       LYS  38   3.857  -9.341  -3.121
  241   1HG   LYS  38          1HG       LYS  38   4.474 -10.819  -4.699
  242   2HG   LYS  38          2HG       LYS  38   3.959 -11.958  -3.474
  243   1HD   LYS  38          1HD       LYS  38   1.841 -12.274  -4.569
  244   2HD   LYS  38          2HD       LYS  38   2.194 -10.974  -5.714
  245   1HE   LYS  38          1HE       LYS  38   3.710 -13.574  -5.468
  246   2HE   LYS  38          2HE       LYS  38   2.532 -13.185  -6.722
  247   1HZ   LYS  38          1HZ       LYS  38   3.970 -11.365  -7.441
  248   2HZ   LYS  38          2HZ       LYS  38   5.112 -11.774  -6.254
  249   3HZ   LYS  38          3HZ       LYS  38   4.783 -12.855  -7.520
  250    H    MET  39           H        MET  39   2.438  -9.455   0.321
  251    HA   MET  39           HA       MET  39   0.041  -7.882  -0.038
  252   1HB   MET  39          1HB       MET  39   2.010  -7.970   2.266
  253   2HB   MET  39          2HB       MET  39   0.442  -7.177   2.281
  254   1HG   MET  39          1HG       MET  39  -0.632  -9.365   1.899
  255   2HG   MET  39          2HG       MET  39   0.948 -10.128   2.010
  256   1HE   MET  39          1HE       MET  39  -1.255  -7.595   3.515
  257   2HE   MET  39          2HE       MET  39  -1.853  -8.438   4.943
  258   3HE   MET  39          3HE       MET  39  -0.497  -7.319   5.084
  259    H    TRP  40           H        TRP  40  -0.016  -5.595  -0.031
  260    HA   TRP  40           HA       TRP  40   2.563  -4.305  -0.625
  261   1HB   TRP  40          1HB       TRP  40   1.381  -2.945  -2.336
  262   2HB   TRP  40          2HB       TRP  40   1.398  -4.662  -2.731
  263    HD1  TRP  40           HD1      TRP  40  -1.051  -5.978  -2.008
  264    HE1  TRP  40           1HE      TRP  40  -3.445  -5.070  -2.228
  265    HE3  TRP  40           3HE      TRP  40   0.000  -1.007  -2.407
  266    HZ2  TRP  40           2HZ      TRP  40  -4.708  -2.586  -2.502
  267    HZ3  TRP  40           3HZ      TRP  40  -1.869   0.574  -2.623
  268    HH2  TRP  40           HH2      TRP  40  -4.175  -0.202  -2.679
  269    H    CYS  41           H        CYS  41   1.629  -1.769  -1.048
  270    HA   CYS  41           HA       CYS  41  -0.033  -0.840   1.118
  271   1HB   CYS  41          1HB       CYS  41   1.736   0.550   2.156
  272   2HB   CYS  41          2HB       CYS  41   2.092  -1.169   2.317
  273    H    ALA  42           H        ALA  42  -0.678   1.354   0.733
  274    HA   ALA  42           HA       ALA  42  -0.202   2.216  -1.981
  275   1HB   ALA  42          1HB       ALA  42  -2.376   2.433  -0.453
  276   2HB   ALA  42          2HB       ALA  42  -1.638   3.993  -0.097
  277   3HB   ALA  42          3HB       ALA  42  -2.021   3.559  -1.764
  278    H    THR  43           H        THR  43   0.885   4.050  -2.614
  279    HA   THR  43           HA       THR  43   2.771   5.057  -0.619
  280    HB   THR  43           HB       THR  43   4.070   5.834  -2.567
  281    HG1  THR  43           1HG      THR  43   2.635   6.234  -4.158
  282   1HG2  THR  43          1HG2      THR  43   3.799   3.267  -3.668
  283   2HG2  THR  43          2HG2      THR  43   4.979   3.812  -2.478
  284   3HG2  THR  43          3HG2      THR  43   3.453   3.108  -1.947
  285    H    THR  44           H        THR  44  -0.135   5.800  -1.219
  286    HA   THR  44           HA       THR  44   0.275   8.694  -1.034
  287    HB   THR  44           HB       THR  44  -1.865   8.972  -2.347
  288    HG1  THR  44           1HG      THR  44  -2.915   7.261  -2.909
  289   1HG2  THR  44          1HG2      THR  44  -0.073   7.524  -4.197
  290   2HG2  THR  44          2HG2      THR  44  -0.848   9.103  -4.364
  291   3HG2  THR  44          3HG2      THR  44   0.587   8.924  -3.347
  292    H    ALA  45           H        ALA  45  -1.526   9.771   0.113
  293    HA   ALA  45           HA       ALA  45  -2.304   8.340   2.434
  294   1HB   ALA  45          1HB       ALA  45  -2.306  11.034   1.608
  295   2HB   ALA  45          2HB       ALA  45  -3.967  10.643   2.063
  296   3HB   ALA  45          3HB       ALA  45  -2.654  10.391   3.213
  297    H    ASN  46           H        ASN  46  -3.795   8.820  -0.649
  298    HA   ASN  46           HA       ASN  46  -6.024   7.148   0.240
  299   1HB   ASN  46          1HB       ASN  46  -6.758   9.557   0.017
  300   2HB   ASN  46          2HB       ASN  46  -6.344   9.456  -1.693
  301   1HD2  ASN  46          1HD2      ASN  46  -9.857   8.215  -0.373
  302   2HD2  ASN  46          2HD2      ASN  46  -8.717   9.103   0.568
  303    H    TYR  47           H        TYR  47  -5.916   5.323  -0.887
  304    HA   TYR  47           HA       TYR  47  -4.365   5.254  -3.323
  305   1HB   TYR  47          1HB       TYR  47  -4.146   3.452  -1.614
  306   2HB   TYR  47          2HB       TYR  47  -5.804   2.961  -1.980
  307    HD1  TYR  47           1HD      TYR  47  -2.511   3.522  -3.613
  308    HD2  TYR  47           2HD      TYR  47  -6.200   1.422  -3.674
  309    HE1  TYR  47           1HE      TYR  47  -1.701   2.181  -5.499
  310    HE2  TYR  47           2HE      TYR  47  -5.403   0.067  -5.557
  311    HH   TYR  47           HH       TYR  47  -2.145   0.434  -6.853
  312    H    ASP  48           H        ASP  48  -7.766   4.929  -2.429
  313    HA   ASP  48           HA       ASP  48  -8.759   3.807  -4.750
  314   1HB   ASP  48          1HB       ASP  48  -9.967   5.786  -2.835
  315   2HB   ASP  48          2HB       ASP  48 -10.871   5.150  -4.204
  316    H    ASP  49           H        ASP  49  -7.904   7.143  -4.115
  317    HA   ASP  49           HA       ASP  49  -8.869   8.005  -6.703
  318   1HB   ASP  49          1HB       ASP  49  -7.722   9.391  -4.317
  319   2HB   ASP  49          2HB       ASP  49  -7.748  10.215  -5.871
  320    H    ASP  50           H        ASP  50  -5.724   8.481  -5.080
  321    HA   ASP  50           HA       ASP  50  -4.367   9.084  -7.493
  322   1HB   ASP  50          1HB       ASP  50  -3.330   8.410  -4.743
  323   2HB   ASP  50          2HB       ASP  50  -2.299   8.915  -6.075
  324    H    ARG  51           H        ARG  51  -5.034   6.061  -6.016
  325    HA   ARG  51           HA       ARG  51  -4.214   3.974  -6.225
  326   1HB   ARG  51          1HB       ARG  51  -4.466   4.768  -9.095
  327   2HB   ARG  51          2HB       ARG  51  -4.574   3.136  -8.445
  328   1HG   ARG  51          1HG       ARG  51  -6.391   4.317  -6.908
  329   2HG   ARG  51          2HG       ARG  51  -6.513   5.354  -8.331
  330   1HD   ARG  51          1HD       ARG  51  -6.791   3.327  -9.698
  331   2HD   ARG  51          2HD       ARG  51  -6.823   2.383  -8.205
  332    HE   ARG  51           HE       ARG  51  -8.738   4.271  -7.817
  333   1HH1  ARG  51          1HH1      ARG  51  -8.137   1.967 -10.370
  334   2HH1  ARG  51          2HH1      ARG  51  -9.812   1.736 -10.737
  335   1HH2  ARG  51          1HH2      ARG  51 -10.946   4.016  -8.333
  336   2HH2  ARG  51          2HH2      ARG  51 -11.416   2.905  -9.580
  337    H    LYS  52           H        LYS  52  -2.028   5.192  -5.507
  338    HA   LYS  52           HA       LYS  52  -0.011   4.104  -7.327
  339   1HB   LYS  52          1HB       LYS  52   0.212   6.414  -5.390
  340   2HB   LYS  52          2HB       LYS  52   1.613   5.639  -6.118
  341   1HG   LYS  52          1HG       LYS  52   1.026   6.342  -8.276
  342   2HG   LYS  52          2HG       LYS  52  -0.601   6.801  -7.772
  343   1HD   LYS  52          1HD       LYS  52   0.445   8.544  -6.305
  344   2HD   LYS  52          2HD       LYS  52   2.002   8.126  -7.021
  345   1HE   LYS  52          1HE       LYS  52   1.221   8.769  -9.211
  346   2HE   LYS  52          2HE       LYS  52  -0.397   9.078  -8.580
  347   1HZ   LYS  52          1HZ       LYS  52   1.385  10.588  -7.050
  348   2HZ   LYS  52          2HZ       LYS  52   1.828  10.825  -8.673
  349   3HZ   LYS  52          3HZ       LYS  52   0.234  11.151  -8.163
  350    H    TRP  53           H        TRP  53   0.824   2.306  -6.635
  351    HA   TRP  53           HA       TRP  53   0.859   1.775  -3.754
  352   1HB   TRP  53          1HB       TRP  53   0.068  -0.442  -4.195
  353   2HB   TRP  53          2HB       TRP  53  -1.039   0.720  -4.841
  354    HD1  TRP  53           HD1      TRP  53  -0.339   1.220  -7.715
  355    HE1  TRP  53           1HE      TRP  53  -0.025  -0.667  -9.444
  356    HE3  TRP  53           3HE      TRP  53   0.503  -2.519  -4.476
  357    HZ2  TRP  53           2HZ      TRP  53   0.499  -3.486  -9.373
  358    HZ3  TRP  53           3HZ      TRP  53   0.891  -4.815  -5.329
  359    HH2  TRP  53           HH2      TRP  53   0.892  -5.283  -7.739
  360    H    GLY  54           H        GLY  54   2.017  -0.200  -3.222
  361   1HA   GLY  54          1HA       GLY  54   4.181  -1.122  -4.843
  362   2HA   GLY  54          2HA       GLY  54   4.724  -0.025  -3.574
  363    H    PHE  55           H        PHE  55   5.048  -3.009  -3.976
  364    HA   PHE  55           HA       PHE  55   3.507  -4.433  -2.141
  365   1HB   PHE  55          1HB       PHE  55   6.273  -4.867  -3.242
  366   2HB   PHE  55          2HB       PHE  55   5.539  -5.985  -2.109
  367    HD1  PHE  55           1HD      PHE  55   2.853  -4.828  -3.873
  368    HD2  PHE  55           2HD      PHE  55   6.320  -7.235  -4.412
  369    HE1  PHE  55           1HE      PHE  55   1.743  -6.014  -5.723
  370    HE2  PHE  55           2HE      PHE  55   5.207  -8.428  -6.262
  371    HZ   PHE  55           HZ       PHE  55   2.916  -7.809  -6.924
  372    H    CYS  56           H        CYS  56   3.973  -5.197  -0.042
  373    HA   CYS  56           HA       CYS  56   4.977  -3.254   1.743
  374   1HB   CYS  56          1HB       CYS  56   3.316  -5.253   2.139
  375   2HB   CYS  56          2HB       CYS  56   4.784  -6.169   2.459
  376    HA   PRO  57           HA       PRO  57   9.268  -4.152   1.136
  377   1HB   PRO  57          1HB       PRO  57  10.337  -2.616   3.029
  378   2HB   PRO  57          2HB       PRO  57   9.573  -1.924   1.585
  379   1HG   PRO  57          1HG       PRO  57   8.374  -2.449   4.272
  380   2HG   PRO  57          2HG       PRO  57   8.378  -0.913   3.382
  381   1HD   PRO  57          1HD       PRO  57   6.253  -2.509   3.320
  382   2HD   PRO  57          2HD       PRO  57   6.801  -1.707   1.829
  383    H    ASP  58           H        ASP  58   7.524  -5.359   3.424
  384    HA   ASP  58           HA       ASP  58   9.575  -7.183   4.319
  385   1HB   ASP  58          1HB       ASP  58   9.467  -5.115   5.905
  386   2HB   ASP  58          2HB       ASP  58   7.980  -5.854   6.488
  387    H    GLN  59           H        GLN  59   8.661  -9.122   4.033
  388    HA   GLN  59           HA       GLN  59   5.755  -9.360   4.354
  389   1HB   GLN  59          1HB       GLN  59   7.751 -11.198   3.028
  390   2HB   GLN  59          2HB       GLN  59   6.029 -11.520   3.152
  391   1HG   GLN  59          1HG       GLN  59   5.562  -9.525   1.841
  392   2HG   GLN  59          2HG       GLN  59   7.289  -9.193   1.727
  393   1HE2  GLN  59          1HE2      GLN  59   5.523 -11.537  -0.936
  394   2HE2  GLN  59          2HE2      GLN  59   4.698 -10.535   0.206
  395    H    GLY  60           H        GLY  60   5.043 -10.097   6.226
  396   1HA   GLY  60          1HA       GLY  60   6.460 -12.318   7.510
  397   2HA   GLY  60          2HA       GLY  60   6.182 -10.859   8.451
  Start of MODEL   19
    1    H    SER   1           1H       SER   1   9.066   6.777   8.576
    2    HA   SER   1           HA       SER   1  11.087   7.962   7.976
    3   1HB   SER   1          1HB       SER   1  12.520   5.914   8.243
    4   2HB   SER   1          2HB       SER   1  11.191   6.016   9.397
    5    HG   SER   1           HG       SER   1  11.032   3.990   8.663
    6    H    TRP   2           H        TRP   2  13.172   6.485   6.675
    7    HA   TRP   2           HA       TRP   2  12.579   7.278   3.944
    8   1HB   TRP   2          1HB       TRP   2  15.021   7.033   3.559
    9   2HB   TRP   2          2HB       TRP   2  14.619   8.174   4.839
   10    HD1  TRP   2           HD1      TRP   2  15.661   4.412   4.633
   11    HE1  TRP   2           1HE      TRP   2  17.290   3.945   6.579
   12    HE3  TRP   2           3HE      TRP   2  15.593   9.015   6.878
   13    HZ2  TRP   2           2HZ      TRP   2  18.371   5.341   8.786
   14    HZ3  TRP   2           3HZ      TRP   2  16.940   9.359   8.906
   15    HH2  TRP   2           HH2      TRP   2  18.299   7.558   9.840
   16    H    MET   3           H        MET   3  11.757   4.618   5.315
   17    HA   MET   3           HA       MET   3  13.089   2.680   3.649
   18   1HB   MET   3          1HB       MET   3  11.585   1.047   4.703
   19   2HB   MET   3          2HB       MET   3  12.429   2.013   5.896
   20   1HG   MET   3          1HG       MET   3  10.455   3.302   6.337
   21   2HG   MET   3          2HG       MET   3   9.603   2.530   5.000
   22   1HE   MET   3          1HE       MET   3  12.055   1.044   7.523
   23   2HE   MET   3          2HE       MET   3  11.063   1.808   8.764
   24   3HE   MET   3          3HE       MET   3  11.061   0.054   8.593
   25    H    SER   4           H        SER   4  12.419   1.972   1.712
   26    HA   SER   4           HA       SER   4   9.978   3.165   0.635
   27   1HB   SER   4          1HB       SER   4  12.013   1.558  -0.904
   28   2HB   SER   4          2HB       SER   4  10.862   2.750  -1.522
   29    HG   SER   4           HG       SER   4  12.052   4.345  -0.302
   30    H    THR   5           H        THR   5   8.764   1.773  -0.977
   31    HA   THR   5           HA       THR   5   8.018  -0.695   0.357
   32    HB   THR   5           HB       THR   5   6.150  -0.656  -1.307
   33    HG1  THR   5           1HG      THR   5   7.695   1.044  -2.543
   34   1HG2  THR   5          1HG2      THR   5   6.068   2.055  -0.175
   35   2HG2  THR   5          2HG2      THR   5   4.867   0.764  -0.147
   36   3HG2  THR   5          3HG2      THR   5   6.237   0.712   0.962
   37    H    VAL   6           H        VAL   6   7.202  -2.395  -1.241
   38    HA   VAL   6           HA       VAL   6   9.257  -2.981  -3.286
   39    HB   VAL   6           HB       VAL   6   7.650  -5.261  -2.466
   40   1HG1  VAL   6          1HG1      VAL   6   9.909  -5.073  -3.731
   41   2HG1  VAL   6          2HG1      VAL   6  10.605  -5.085  -2.110
   42   3HG1  VAL   6          3HG1      VAL   6   9.615  -6.439  -2.653
   43   1HG2  VAL   6          1HG2      VAL   6   8.039  -3.716  -0.312
   44   2HG2  VAL   6          2HG2      VAL   6   8.001  -5.479  -0.249
   45   3HG2  VAL   6          3HG2      VAL   6   9.547  -4.629  -0.297
   46    H    GLY   7           H        GLY   7   7.855  -4.972  -4.548
   47   1HA   GLY   7          1HA       GLY   7   6.368  -5.052  -6.359
   48   2HA   GLY   7          2HA       GLY   7   5.240  -4.927  -5.050
   49    H    GLY   8           H        GLY   8   3.695  -3.643  -5.535
   50   1HA   GLY   8          1HA       GLY   8   2.469  -1.937  -6.446
   51   2HA   GLY   8          2HA       GLY   8   3.657  -0.975  -5.594
   52    H    ASN   9           H        ASN   9   3.514   0.696  -6.977
   53    HA   ASN   9           HA       ASN   9   5.032   0.386  -9.439
   54   1HB   ASN   9          1HB       ASN   9   3.429   1.788 -10.732
   55   2HB   ASN   9          2HB       ASN   9   2.805   0.210 -10.307
   56   1HD2  ASN   9          1HD2      ASN   9   1.083   2.599  -7.684
   57   2HD2  ASN   9          2HD2      ASN   9   2.704   2.009  -7.590
   58    H    SER  10           H        SER  10   4.776   1.797  -6.599
   59    HA   SER  10           HA       SER  10   5.325   4.536  -7.319
   60   1HB   SER  10          1HB       SER  10   5.573   3.195  -4.612
   61   2HB   SER  10          2HB       SER  10   5.421   4.921  -4.944
   62    HG   SER  10           HG       SER  10   3.425   3.907  -4.309
   63    H    GLY  11           H        GLY  11   7.075   1.767  -5.948
   64   1HA   GLY  11          1HA       GLY  11   9.311   1.221  -6.387
   65   2HA   GLY  11          2HA       GLY  11   9.550   2.827  -7.056
   66    H    GLY  12           H        GLY  12  10.498   4.342  -5.833
   67   1HA   GLY  12          1HA       GLY  12  11.475   3.535  -3.226
   68   2HA   GLY  12          2HA       GLY  12  11.944   4.972  -4.115
   69    H    ALA  13           H        ALA  13   8.600   4.109  -3.394
   70    HA   ALA  13           HA       ALA  13   8.474   6.522  -1.712
   71   1HB   ALA  13          1HB       ALA  13   6.802   5.553  -3.804
   72   2HB   ALA  13          2HB       ALA  13   5.874   5.550  -2.305
   73   3HB   ALA  13          3HB       ALA  13   6.642   7.035  -2.863
   74    HA   PRO  14           HA       PRO  14   7.610   3.799   1.697
   75   1HB   PRO  14          1HB       PRO  14   7.056   5.646   3.566
   76   2HB   PRO  14          2HB       PRO  14   8.683   5.462   2.902
   77   1HG   PRO  14          1HG       PRO  14   6.644   7.553   2.366
   78   2HG   PRO  14          2HG       PRO  14   8.410   7.677   2.357
   79   1HD   PRO  14          1HD       PRO  14   6.717   7.395   0.111
   80   2HD   PRO  14          2HD       PRO  14   8.481   7.269   0.126
   81    H    CYS  15           H        CYS  15   5.866   3.293   3.293
   82    HA   CYS  15           HA       CYS  15   3.252   3.533   2.041
   83   1HB   CYS  15          1HB       CYS  15   3.699   2.332   4.769
   84   2HB   CYS  15          2HB       CYS  15   2.535   1.860   3.542
   85    H    VAL  16           H        VAL  16   1.699   4.989   2.679
   86    HA   VAL  16           HA       VAL  16   2.314   6.726   4.966
   87    HB   VAL  16           HB       VAL  16   0.272   7.036   2.759
   88   1HG1  VAL  16          1HG1      VAL  16  -0.507   8.029   4.862
   89   2HG1  VAL  16          2HG1      VAL  16   0.988   8.962   4.969
   90   3HG1  VAL  16          3HG1      VAL  16  -0.145   9.259   3.650
   91   1HG2  VAL  16          1HG2      VAL  16   3.051   7.702   2.944
   92   2HG2  VAL  16          2HG2      VAL  16   1.942   7.909   1.588
   93   3HG2  VAL  16          3HG2      VAL  16   2.091   9.176   2.808
   94    H    PHE  17           H        PHE  17   1.484   6.086   6.852
   95    HA   PHE  17           HA       PHE  17  -1.105   4.707   6.865
   96   1HB   PHE  17          1HB       PHE  17   1.142   4.750   8.892
   97   2HB   PHE  17          2HB       PHE  17  -0.414   3.993   9.168
   98    HD1  PHE  17           1HD      PHE  17  -0.145   3.334   5.915
   99    HD2  PHE  17           2HD      PHE  17   1.861   2.357   9.532
  100    HE1  PHE  17           1HE      PHE  17   0.725   1.293   4.874
  101    HE2  PHE  17           2HE      PHE  17   2.736   0.300   8.501
  102    HZ   PHE  17           HZ       PHE  17   2.180  -0.251   6.146
  103    HA   PRO  18           HA       PRO  18  -2.619   4.242   7.972
  104   1HB   PRO  18          1HB       PRO  18  -5.257   5.142   8.258
  105   2HB   PRO  18          2HB       PRO  18  -4.298   4.317   9.483
  106   1HG   PRO  18          1HG       PRO  18  -5.203   7.001   9.536
  107   2HG   PRO  18          2HG       PRO  18  -4.100   6.218  10.681
  108   1HD   PRO  18          1HD       PRO  18  -3.504   8.033   8.416
  109   2HD   PRO  18          2HD       PRO  18  -2.576   7.727   9.897
  110    H    PHE  19           H        PHE  19  -3.055   3.533   5.953
  111    HA   PHE  19           HA       PHE  19  -4.031   5.559   4.055
  112   1HB   PHE  19          1HB       PHE  19  -3.270   4.147   2.249
  113   2HB   PHE  19          2HB       PHE  19  -1.944   4.436   3.368
  114    HD1  PHE  19           1HD      PHE  19  -1.517   2.563   5.116
  115    HD2  PHE  19           2HD      PHE  19  -3.752   2.016   1.545
  116    HE1  PHE  19           1HE      PHE  19  -1.112   0.135   5.228
  117    HE2  PHE  19           2HE      PHE  19  -3.345  -0.397   1.641
  118    HZ   PHE  19           HZ       PHE  19  -2.024  -1.343   3.486
  119    H    THR  20           H        THR  20  -6.022   5.449   3.329
  120    HA   THR  20           HA       THR  20  -7.643   3.184   4.175
  121    HB   THR  20           HB       THR  20  -8.434   5.841   2.921
  122    HG1  THR  20           1HG      THR  20  -8.503   6.591   4.897
  123   1HG2  THR  20          1HG2      THR  20 -10.641   5.161   4.178
  124   2HG2  THR  20          2HG2      THR  20 -10.333   4.655   2.515
  125   3HG2  THR  20          3HG2      THR  20 -10.052   3.533   3.848
  126    H    PHE  21           H        PHE  21  -8.135   1.577   2.894
  127    HA   PHE  21           HA       PHE  21  -7.937   1.995  -0.024
  128   1HB   PHE  21          1HB       PHE  21  -6.301   0.347   0.948
  129   2HB   PHE  21          2HB       PHE  21  -7.669  -0.595   1.493
  130    HD1  PHE  21           1HD      PHE  21  -5.923   0.609  -1.520
  131    HD2  PHE  21           2HD      PHE  21  -8.865  -2.049   0.017
  132    HE1  PHE  21           1HE      PHE  21  -5.904  -0.621  -3.640
  133    HE2  PHE  21           2HE      PHE  21  -8.851  -3.279  -2.098
  134    HZ   PHE  21           HZ       PHE  21  -7.381  -2.579  -3.935
  135    H    LEU  22           H        LEU  22  -9.652   1.650  -1.157
  136    HA   LEU  22           HA       LEU  22 -11.858   1.527  -1.595
  137   1HB   LEU  22          1HB       LEU  22 -10.619  -1.057  -0.928
  138   2HB   LEU  22          2HB       LEU  22 -12.277  -1.032  -1.496
  139    HG   LEU  22           HG       LEU  22 -10.602  -1.430  -3.282
  140   1HD1  LEU  22          1HD1      LEU  22 -12.811  -0.383  -3.617
  141   2HD1  LEU  22          2HD1      LEU  22 -11.990   1.180  -3.570
  142   3HD1  LEU  22          3HD1      LEU  22 -11.600   0.010  -4.835
  143   1HD2  LEU  22          1HD2      LEU  22  -8.819   0.021  -2.462
  144   2HD2  LEU  22          2HD2      LEU  22  -9.276   0.383  -4.126
  145   3HD2  LEU  22          3HD2      LEU  22  -9.832   1.424  -2.814
  146    H    GLY  23           H        GLY  23 -11.753   2.584   0.886
  147   1HA   GLY  23          1HA       GLY  23 -13.676   3.051   2.240
  148   2HA   GLY  23          2HA       GLY  23 -14.129   1.367   2.117
  149    H    ASN  24           H        ASN  24 -11.173   0.616   2.957
  150    HA   ASN  24           HA       ASN  24 -11.752   1.108   5.803
  151   1HB   ASN  24          1HB       ASN  24 -10.241  -1.145   4.494
  152   2HB   ASN  24          2HB       ASN  24 -10.485  -0.956   6.225
  153   1HD2  ASN  24          1HD2      ASN  24 -13.274  -2.636   3.920
  154   2HD2  ASN  24          2HD2      ASN  24 -11.717  -2.167   3.348
  155    H    LYS  25           H        LYS  25 -10.308   2.082   7.092
  156    HA   LYS  25           HA       LYS  25  -7.944   3.234   5.988
  157   1HB   LYS  25          1HB       LYS  25  -8.947   3.113   8.830
  158   2HB   LYS  25          2HB       LYS  25  -7.768   4.221   8.179
  159   1HG   LYS  25          1HG       LYS  25  -9.464   5.236   6.753
  160   2HG   LYS  25          2HG       LYS  25 -10.662   4.110   7.399
  161   1HD   LYS  25          1HD       LYS  25 -10.880   6.222   8.537
  162   2HD   LYS  25          2HD       LYS  25 -10.229   5.028   9.661
  163   1HE   LYS  25          1HE       LYS  25  -7.923   5.916   8.992
  164   2HE   LYS  25          2HE       LYS  25  -8.789   7.270   8.269
  165   1HZ   LYS  25          1HZ       LYS  25  -9.853   7.562  10.526
  166   2HZ   LYS  25          2HZ       LYS  25  -8.690   6.476  11.123
  167   3HZ   LYS  25          3HZ       LYS  25  -8.198   7.944  10.423
  168    H    TYR  26           H        TYR  26  -5.937   2.298   6.043
  169    HA   TYR  26           HA       TYR  26  -5.634  -0.023   7.799
  170   1HB   TYR  26          1HB       TYR  26  -4.151   0.636   5.259
  171   2HB   TYR  26          2HB       TYR  26  -3.936  -0.807   6.238
  172    HD1  TYR  26           1HD      TYR  26  -6.925  -1.251   6.820
  173    HD2  TYR  26           2HD      TYR  26  -4.796  -0.407   3.242
  174    HE1  TYR  26           1HE      TYR  26  -8.635  -2.429   5.521
  175    HE2  TYR  26           2HE      TYR  26  -6.500  -1.580   1.941
  176    HH   TYR  26           HH       TYR  26  -8.544  -3.698   3.079
  177    H    GLU  27           H        GLU  27  -4.453   0.210   9.449
  178    HA   GLU  27           HA       GLU  27  -2.579   2.404   9.742
  179   1HB   GLU  27          1HB       GLU  27  -3.428   0.257  11.673
  180   2HB   GLU  27          2HB       GLU  27  -2.568   1.724  12.061
  181   1HG   GLU  27          1HG       GLU  27  -5.229   1.914  10.763
  182   2HG   GLU  27          2HG       GLU  27  -5.125   1.538  12.478
  183    H    SER  28           H        SER  28  -2.551  -0.814   8.811
  184    HA   SER  28           HA       SER  28   0.350  -0.944   9.086
  185   1HB   SER  28          1HB       SER  28   0.014  -3.422   9.520
  186   2HB   SER  28          2HB       SER  28  -0.432  -2.366  10.854
  187    HG   SER  28           HG       SER  28  -2.115  -3.718   9.019
  188    H    CYS  29           H        CYS  29   0.794  -3.288   7.715
  189    HA   CYS  29           HA       CYS  29   0.109  -2.512   5.058
  190   1HB   CYS  29          1HB       CYS  29   1.318  -5.087   6.060
  191   2HB   CYS  29          2HB       CYS  29   1.219  -4.602   4.383
  192    H    THR  30           H        THR  30  -0.901  -4.104   3.544
  193    HA   THR  30           HA       THR  30  -3.031  -5.692   4.775
  194    HB   THR  30           HB       THR  30  -3.909  -3.360   4.366
  195    HG1  THR  30           1HG      THR  30  -5.485  -4.828   4.297
  196   1HG2  THR  30          1HG2      THR  30  -4.273  -3.601   1.547
  197   2HG2  THR  30          2HG2      THR  30  -3.553  -2.282   2.469
  198   3HG2  THR  30          3HG2      THR  30  -2.550  -3.625   1.920
  199    H    SER  31           H        SER  31  -4.281  -6.821   3.003
  200    HA   SER  31           HA       SER  31  -2.555  -7.437   0.716
  201   1HB   SER  31          1HB       SER  31  -3.306  -9.809   0.858
  202   2HB   SER  31          2HB       SER  31  -2.378  -9.312   2.279
  203    HG   SER  31           HG       SER  31  -4.601 -10.491   2.413
  204    H    ALA  32           H        ALA  32  -4.835  -5.672   1.384
  205    HA   ALA  32           HA       ALA  32  -7.239  -6.531   0.252
  206   1HB   ALA  32          1HB       ALA  32  -6.205  -4.137   1.369
  207   2HB   ALA  32          2HB       ALA  32  -6.856  -3.719  -0.216
  208   3HB   ALA  32          3HB       ALA  32  -7.886  -4.506   0.980
  209    H    GLY  33           H        GLY  33  -7.970  -6.709  -1.766
  210   1HA   GLY  33          1HA       GLY  33  -8.061  -6.448  -4.067
  211   2HA   GLY  33          2HA       GLY  33  -6.731  -5.298  -3.951
  212    H    ARG  34           H        ARG  34  -5.545  -7.744  -2.278
  213    HA   ARG  34           HA       ARG  34  -4.332  -8.971  -4.649
  214   1HB   ARG  34          1HB       ARG  34  -3.246  -8.795  -1.840
  215   2HB   ARG  34          2HB       ARG  34  -2.452  -9.553  -3.197
  216   1HG   ARG  34          1HG       ARG  34  -2.860  -7.081  -4.196
  217   2HG   ARG  34          2HG       ARG  34  -2.666  -6.732  -2.475
  218   1HD   ARG  34          1HD       ARG  34  -0.525  -6.697  -3.722
  219   2HD   ARG  34          2HD       ARG  34  -0.550  -7.878  -2.409
  220    HE   ARG  34           HE       ARG  34  -0.289  -9.542  -3.940
  221   1HH1  ARG  34          1HH1      ARG  34  -1.343  -6.644  -5.599
  222   2HH1  ARG  34          2HH1      ARG  34  -1.230  -7.355  -7.179
  223   1HH2  ARG  34          1HH2      ARG  34  -0.153 -10.474  -6.011
  224   2HH2  ARG  34          2HH2      ARG  34  -0.557  -9.541  -7.418
  225    H    SER  35           H        SER  35  -4.421 -10.026  -1.293
  226    HA   SER  35           HA       SER  35  -4.808 -12.016  -0.319
  227   1HB   SER  35          1HB       SER  35  -6.984 -13.143  -0.895
  228   2HB   SER  35          2HB       SER  35  -7.120 -11.439  -0.467
  229    HG   SER  35           HG       SER  35  -6.758 -11.721  -3.130
  230    H    ASP  36           H        ASP  36  -3.009 -12.004  -2.535
  231    HA   ASP  36           HA       ASP  36  -3.342 -14.682  -3.649
  232   1HB   ASP  36          1HB       ASP  36  -2.006 -14.012  -5.438
  233   2HB   ASP  36          2HB       ASP  36  -2.932 -12.575  -5.077
  234    H    GLY  37           H        GLY  37  -1.245 -12.600  -1.861
  235   1HA   GLY  37          1HA       GLY  37  -0.176 -14.501  -0.202
  236   2HA   GLY  37          2HA       GLY  37   0.909 -14.441  -1.578
  237    H    LYS  38           H        LYS  38   1.510 -12.052  -2.183
  238    HA   LYS  38           HA       LYS  38   2.886 -11.007   0.057
  239   1HB   LYS  38          1HB       LYS  38   2.472  -9.473  -2.473
  240   2HB   LYS  38          2HB       LYS  38   3.889  -9.528  -1.429
  241   1HG   LYS  38          1HG       LYS  38   4.686 -10.829  -3.077
  242   2HG   LYS  38          2HG       LYS  38   3.833 -12.093  -2.208
  243   1HD   LYS  38          1HD       LYS  38   1.898 -11.781  -3.676
  244   2HD   LYS  38          2HD       LYS  38   2.771 -10.524  -4.550
  245   1HE   LYS  38          1HE       LYS  38   4.474 -12.146  -5.201
  246   2HE   LYS  38          2HE       LYS  38   3.608 -13.405  -4.317
  247   1HZ   LYS  38          1HZ       LYS  38   1.666 -12.883  -5.822
  248   2HZ   LYS  38          2HZ       LYS  38   2.739 -11.961  -6.766
  249   3HZ   LYS  38          3HZ       LYS  38   2.997 -13.634  -6.567
  250    H    MET  39           H        MET  39   2.496  -9.327   1.348
  251    HA   MET  39           HA       MET  39  -0.066  -7.963   1.068
  252   1HB   MET  39          1HB       MET  39   1.915  -7.937   3.364
  253   2HB   MET  39          2HB       MET  39   0.331  -7.184   3.355
  254   1HG   MET  39          1HG       MET  39  -0.715  -9.389   3.139
  255   2HG   MET  39          2HG       MET  39   0.885 -10.132   3.197
  256   1HE   MET  39          1HE       MET  39  -0.455 -11.519   4.803
  257   2HE   MET  39          2HE       MET  39  -0.283 -11.281   6.541
  258   3HE   MET  39          3HE       MET  39  -1.706 -10.658   5.703
  259    H    TRP  40           H        TRP  40  -0.120  -5.620   1.167
  260    HA   TRP  40           HA       TRP  40   2.435  -4.330   0.497
  261   1HB   TRP  40          1HB       TRP  40   1.256  -3.016  -1.252
  262   2HB   TRP  40          2HB       TRP  40   1.308  -4.740  -1.618
  263    HD1  TRP  40           HD1      TRP  40  -1.131  -6.085  -0.891
  264    HE1  TRP  40           1HE      TRP  40  -3.538  -5.216  -1.158
  265    HE3  TRP  40           3HE      TRP  40  -0.143  -1.108  -1.374
  266    HZ2  TRP  40           2HZ      TRP  40  -4.842  -2.748  -1.496
  267    HZ3  TRP  40           3HZ      TRP  40  -2.028   0.447  -1.636
  268    HH2  TRP  40           HH2      TRP  40  -4.322  -0.356  -1.704
  269    H    CYS  41           H        CYS  41   1.522  -1.812   0.025
  270    HA   CYS  41           HA       CYS  41  -0.176  -0.833   2.142
  271   1HB   CYS  41          1HB       CYS  41   1.675   0.613   3.092
  272   2HB   CYS  41          2HB       CYS  41   1.832  -1.103   3.466
  273    H    ALA  42           H        ALA  42  -0.856   1.315   1.648
  274    HA   ALA  42           HA       ALA  42  -0.264   2.128  -1.055
  275   1HB   ALA  42          1HB       ALA  42  -2.517   2.405   0.225
  276   2HB   ALA  42          2HB       ALA  42  -1.768   3.884   0.832
  277   3HB   ALA  42          3HB       ALA  42  -1.986   3.652  -0.903
  278    H    THR  43           H        THR  43   0.633   4.149  -1.647
  279    HA   THR  43           HA       THR  43   2.576   5.084   0.331
  280    HB   THR  43           HB       THR  43   3.865   5.870  -1.612
  281    HG1  THR  43           1HG      THR  43   2.202   6.275  -3.086
  282   1HG2  THR  43          1HG2      THR  43   3.555   3.319  -2.730
  283   2HG2  THR  43          2HG2      THR  43   4.745   3.836  -1.534
  284   3HG2  THR  43          3HG2      THR  43   3.206   3.151  -1.010
  285    H    THR  44           H        THR  44  -0.357   5.834  -0.375
  286    HA   THR  44           HA       THR  44   0.037   8.715  -0.020
  287    HB   THR  44           HB       THR  44  -2.058   9.064  -1.397
  288    HG1  THR  44           1HG      THR  44  -3.047   7.361  -2.070
  289   1HG2  THR  44          1HG2      THR  44   0.005   7.800  -3.147
  290   2HG2  THR  44          2HG2      THR  44  -0.982   9.233  -3.431
  291   3HG2  THR  44          3HG2      THR  44   0.351   9.295  -2.278
  292    H    ALA  45           H        ALA  45  -1.663   9.721   1.218
  293    HA   ALA  45           HA       ALA  45  -2.529   8.245   3.426
  294   1HB   ALA  45          1HB       ALA  45  -2.711  10.944   2.519
  295   2HB   ALA  45          2HB       ALA  45  -4.283  10.441   3.141
  296   3HB   ALA  45          3HB       ALA  45  -2.849  10.315   4.162
  297    H    ASN  46           H        ASN  46  -4.282   9.126   0.478
  298    HA   ASN  46           HA       ASN  46  -6.347   7.187   1.267
  299   1HB   ASN  46          1HB       ASN  46  -7.193   9.560   1.233
  300   2HB   ASN  46          2HB       ASN  46  -6.818   9.609  -0.491
  301   1HD2  ASN  46          1HD2      ASN  46 -10.248   8.068   0.799
  302   2HD2  ASN  46          2HD2      ASN  46  -9.138   8.909   1.810
  303    H    TYR  47           H        TYR  47  -6.042   5.436   0.114
  304    HA   TYR  47           HA       TYR  47  -4.626   5.461  -2.370
  305   1HB   TYR  47          1HB       TYR  47  -4.430   3.629  -0.710
  306   2HB   TYR  47          2HB       TYR  47  -6.092   3.169  -1.058
  307    HD1  TYR  47           1HD      TYR  47  -6.649   2.338  -3.404
  308    HD2  TYR  47           2HD      TYR  47  -2.663   2.911  -2.051
  309    HE1  TYR  47           1HE      TYR  47  -5.820   0.884  -5.210
  310    HE2  TYR  47           2HE      TYR  47  -1.837   1.462  -3.841
  311    HH   TYR  47           HH       TYR  47  -3.573  -0.628  -5.469
  312    H    ASP  48           H        ASP  48  -8.016   5.272  -1.462
  313    HA   ASP  48           HA       ASP  48  -9.138   4.235  -3.752
  314   1HB   ASP  48          1HB       ASP  48 -10.088   6.225  -1.739
  315   2HB   ASP  48          2HB       ASP  48 -11.064   5.924  -3.173
  316    H    ASP  49           H        ASP  49  -7.860   7.448  -3.246
  317    HA   ASP  49           HA       ASP  49  -8.870   8.395  -5.787
  318   1HB   ASP  49          1HB       ASP  49  -7.295   9.692  -3.573
  319   2HB   ASP  49          2HB       ASP  49  -7.621  10.505  -5.097
  320    H    ASP  50           H        ASP  50  -5.623   8.670  -4.367
  321    HA   ASP  50           HA       ASP  50  -4.345   8.982  -6.848
  322   1HB   ASP  50          1HB       ASP  50  -3.236   8.302  -4.127
  323   2HB   ASP  50          2HB       ASP  50  -2.234   8.655  -5.531
  324    H    ARG  51           H        ARG  51  -5.058   6.078  -5.054
  325    HA   ARG  51           HA       ARG  51  -4.504   3.919  -5.329
  326   1HB   ARG  51          1HB       ARG  51  -4.873   4.725  -8.184
  327   2HB   ARG  51          2HB       ARG  51  -5.009   3.087  -7.543
  328   1HG   ARG  51          1HG       ARG  51  -6.653   4.377  -5.873
  329   2HG   ARG  51          2HG       ARG  51  -6.860   5.363  -7.326
  330   1HD   ARG  51          1HD       ARG  51  -6.996   2.386  -7.397
  331   2HD   ARG  51          2HD       ARG  51  -8.401   3.360  -6.963
  332    HE   ARG  51           HE       ARG  51  -7.349   2.953  -9.587
  333   1HH1  ARG  51          1HH1      ARG  51  -9.022   5.250  -7.555
  334   2HH1  ARG  51          2HH1      ARG  51  -9.687   6.154  -8.884
  335   1HH2  ARG  51          1HH2      ARG  51  -8.211   4.126 -11.356
  336   2HH2  ARG  51          2HH2      ARG  51  -9.205   5.518 -11.052
  337    H    LYS  52           H        LYS  52  -2.208   5.045  -4.774
  338    HA   LYS  52           HA       LYS  52  -0.338   3.767  -6.631
  339   1HB   LYS  52          1HB       LYS  52   0.089   6.215  -4.907
  340   2HB   LYS  52          2HB       LYS  52   1.393   5.364  -5.731
  341   1HG   LYS  52          1HG       LYS  52   0.537   5.888  -7.867
  342   2HG   LYS  52          2HG       LYS  52  -0.996   6.433  -7.197
  343   1HD   LYS  52          1HD       LYS  52   0.234   8.293  -6.071
  344   2HD   LYS  52          2HD       LYS  52   1.696   7.773  -6.919
  345   1HE   LYS  52          1HE       LYS  52  -0.863   8.860  -8.095
  346   2HE   LYS  52          2HE       LYS  52   0.757   9.556  -8.175
  347   1HZ   LYS  52          1HZ       LYS  52   1.353   7.396  -9.412
  348   2HZ   LYS  52          2HZ       LYS  52  -0.329   7.228  -9.645
  349   3HZ   LYS  52          3HZ       LYS  52   0.485   8.590 -10.251
  350    H    TRP  53           H        TRP  53   0.483   1.997  -5.840
  351    HA   TRP  53           HA       TRP  53   0.651   1.689  -2.928
  352   1HB   TRP  53          1HB       TRP  53  -0.104  -0.582  -3.210
  353   2HB   TRP  53          2HB       TRP  53  -1.237   0.503  -3.911
  354    HD1  TRP  53           HD1      TRP  53  -0.797   0.774  -6.808
  355    HE1  TRP  53           1HE      TRP  53  -0.367  -1.189  -8.421
  356    HE3  TRP  53           3HE      TRP  53   0.673  -2.604  -3.398
  357    HZ2  TRP  53           2HZ      TRP  53   0.506  -3.912  -8.213
  358    HZ3  TRP  53           3HZ      TRP  53   1.308  -4.896  -4.124
  359    HH2  TRP  53           HH2      TRP  53   1.224  -5.528  -6.494
  360    H    GLY  54           H        GLY  54   1.854  -0.233  -2.288
  361   1HA   GLY  54          1HA       GLY  54   4.074  -1.138  -3.886
  362   2HA   GLY  54          2HA       GLY  54   4.539  -0.046  -2.579
  363    H    PHE  55           H        PHE  55   5.029  -3.011  -2.916
  364    HA   PHE  55           HA       PHE  55   3.390  -4.423  -1.133
  365   1HB   PHE  55          1HB       PHE  55   6.171  -4.870  -2.161
  366   2HB   PHE  55          2HB       PHE  55   5.487  -5.924  -0.939
  367    HD1  PHE  55           1HD      PHE  55   2.611  -5.566  -2.189
  368    HD2  PHE  55           2HD      PHE  55   6.406  -6.726  -3.714
  369    HE1  PHE  55           1HE      PHE  55   1.489  -6.964  -3.878
  370    HE2  PHE  55           2HE      PHE  55   5.295  -8.123  -5.416
  371    HZ   PHE  55           HZ       PHE  55   2.831  -8.238  -5.499
  372    H    CYS  56           H        CYS  56   3.955  -5.263   0.955
  373    HA   CYS  56           HA       CYS  56   4.593  -3.227   2.794
  374   1HB   CYS  56          1HB       CYS  56   3.116  -5.232   3.197
  375   2HB   CYS  56          2HB       CYS  56   4.575  -6.207   3.300
  376    HA   PRO  57           HA       PRO  57   9.026  -3.674   2.804
  377   1HB   PRO  57          1HB       PRO  57   9.628  -1.838   4.584
  378   2HB   PRO  57          2HB       PRO  57   8.862  -1.358   3.058
  379   1HG   PRO  57          1HG       PRO  57   7.565  -1.952   5.682
  380   2HG   PRO  57          2HG       PRO  57   7.415  -0.458   4.729
  381   1HD   PRO  57          1HD       PRO  57   5.578  -2.405   4.582
  382   2HD   PRO  57          2HD       PRO  57   6.064  -1.504   3.129
  383    H    ASP  58           H        ASP  58   7.043  -4.943   4.745
  384    HA   ASP  58           HA       ASP  58   9.014  -5.886   6.712
  385   1HB   ASP  58          1HB       ASP  58   7.175  -4.469   7.668
  386   2HB   ASP  58          2HB       ASP  58   6.030  -5.688   7.127
  387    H    GLN  59           H        GLN  59   9.201  -7.279   4.573
  388    HA   GLN  59           HA       GLN  59   7.584  -9.700   5.030
  389   1HB   GLN  59          1HB       GLN  59   8.569  -8.706   2.340
  390   2HB   GLN  59          2HB       GLN  59   7.642 -10.173   2.625
  391   1HG   GLN  59          1HG       GLN  59   6.645  -7.388   3.189
  392   2HG   GLN  59          2HG       GLN  59   6.321  -8.286   1.710
  393   1HE2  GLN  59          1HE2      GLN  59   4.676 -10.692   4.298
  394   2HE2  GLN  59          2HE2      GLN  59   6.311 -10.701   3.739
  395    H    GLY  60           H        GLY  60   9.161 -11.024   2.855
  396   1HA   GLY  60          1HA       GLY  60  11.875 -11.019   3.884
  397   2HA   GLY  60          2HA       GLY  60  10.964 -12.492   4.183
  Start of MODEL   20
    1    H    SER   1           1H       SER   1  15.977   7.629   7.583
    2    HA   SER   1           HA       SER   1  16.216   5.306   6.929
    3   1HB   SER   1          1HB       SER   1  13.693   5.088   6.543
    4   2HB   SER   1          2HB       SER   1  14.184   6.001   7.970
    5    HG   SER   1           HG       SER   1  12.963   6.874   5.614
    6    H    TRP   2           H        TRP   2  16.614   3.943   5.315
    7    HA   TRP   2           HA       TRP   2  16.221   4.904   2.563
    8   1HB   TRP   2          1HB       TRP   2  18.526   4.171   3.450
    9   2HB   TRP   2          2HB       TRP   2  17.889   2.534   3.402
   10    HD1  TRP   2           HD1      TRP   2  16.820   1.919   0.769
   11    HE1  TRP   2           1HE      TRP   2  18.040   2.317  -1.465
   12    HE3  TRP   2           3HE      TRP   2  20.163   5.466   2.304
   13    HZ2  TRP   2           2HZ      TRP   2  20.157   3.924  -2.437
   14    HZ3  TRP   2           3HZ      TRP   2  21.756   6.385   0.667
   15    HH2  TRP   2           HH2      TRP   2  21.751   5.629  -1.656
   16    H    MET   3           H        MET   3  13.908   4.343   2.765
   17    HA   MET   3           HA       MET   3  13.491   1.526   2.135
   18   1HB   MET   3          1HB       MET   3  11.286   1.770   3.399
   19   2HB   MET   3          2HB       MET   3  12.744   1.570   4.356
   20   1HG   MET   3          1HG       MET   3  12.788   3.937   4.828
   21   2HG   MET   3          2HG       MET   3  11.405   4.204   3.770
   22   1HE   MET   3          1HE       MET   3   9.287   2.950   4.001
   23   2HE   MET   3          2HE       MET   3   9.369   1.499   4.998
   24   3HE   MET   3          3HE       MET   3   8.424   2.887   5.538
   25    H    SER   4           H        SER   4  12.228   1.165   0.465
   26    HA   SER   4           HA       SER   4  10.465   3.270  -0.552
   27   1HB   SER   4          1HB       SER   4  12.696   3.302  -1.756
   28   2HB   SER   4          2HB       SER   4  12.346   1.667  -2.311
   29    HG   SER   4           HG       SER   4  11.559   2.855  -3.921
   30    H    THR   5           H        THR   5   9.454   1.986  -2.725
   31    HA   THR   5           HA       THR   5   8.175  -0.308  -1.453
   32    HB   THR   5           HB       THR   5   6.625   0.067  -3.570
   33    HG1  THR   5           1HG      THR   5   7.357   2.732  -3.123
   34   1HG2  THR   5          1HG2      THR   5   5.993   2.240  -1.816
   35   2HG2  THR   5          2HG2      THR   5   5.151   0.710  -2.062
   36   3HG2  THR   5          3HG2      THR   5   6.462   0.815  -0.888
   37    H    VAL   6           H        VAL   6   7.403  -2.003  -2.869
   38    HA   VAL   6           HA       VAL   6   9.245  -2.784  -4.994
   39    HB   VAL   6           HB       VAL   6  10.039  -4.334  -3.542
   40   1HG1  VAL   6          1HG1      VAL   6   8.355  -3.093  -1.761
   41   2HG1  VAL   6          2HG1      VAL   6   7.850  -4.781  -1.685
   42   3HG1  VAL   6          3HG1      VAL   6   9.531  -4.349  -1.367
   43   1HG2  VAL   6          1HG2      VAL   6   7.591  -5.417  -4.588
   44   2HG2  VAL   6          2HG2      VAL   6   9.158  -6.196  -4.361
   45   3HG2  VAL   6          3HG2      VAL   6   8.003  -6.131  -3.030
   46    H    GLY   7           H        GLY   7   8.015  -4.472  -6.434
   47   1HA   GLY   7          1HA       GLY   7   6.021  -5.033  -7.541
   48   2HA   GLY   7          2HA       GLY   7   5.232  -4.779  -6.013
   49    H    GLY   8           H        GLY   8   3.471  -3.726  -6.701
   50   1HA   GLY   8          1HA       GLY   8   2.145  -2.073  -7.594
   51   2HA   GLY   8          2HA       GLY   8   3.235  -1.067  -6.672
   52    H    ASN   9           H        ASN   9   3.342   0.679  -7.882
   53    HA   ASN   9           HA       ASN   9   4.865   0.566 -10.309
   54   1HB   ASN   9          1HB       ASN   9   3.242   1.711 -11.745
   55   2HB   ASN   9          2HB       ASN   9   2.659   0.137 -11.252
   56   1HD2  ASN   9          1HD2      ASN   9   0.700   2.583  -8.868
   57   2HD2  ASN   9          2HD2      ASN   9   2.313   2.004  -8.633
   58    H    SER  10           H        SER  10   4.998   1.698  -7.638
   59    HA   SER  10           HA       SER  10   4.688   4.544  -7.908
   60   1HB   SER  10          1HB       SER  10   6.180   4.195  -5.674
   61   2HB   SER  10          2HB       SER  10   4.428   4.070  -5.690
   62    HG   SER  10           HG       SER  10   6.088   2.220  -4.940
   63    H    GLY  11           H        GLY  11   7.433   2.321  -7.497
   64   1HA   GLY  11          1HA       GLY  11   9.460   2.514  -8.752
   65   2HA   GLY  11          2HA       GLY  11   9.118   4.228  -8.967
   66    H    GLY  12           H        GLY  12   9.038   5.499  -6.859
   67   1HA   GLY  12          1HA       GLY  12  10.952   4.429  -4.899
   68   2HA   GLY  12          2HA       GLY  12  11.290   5.972  -5.667
   69    H    ALA  13           H        ALA  13   8.061   4.917  -4.795
   70    HA   ALA  13           HA       ALA  13   7.989   7.129  -2.860
   71   1HB   ALA  13          1HB       ALA  13   6.379   7.244  -4.743
   72   2HB   ALA  13          2HB       ALA  13   5.642   5.750  -4.158
   73   3HB   ALA  13          3HB       ALA  13   5.605   7.201  -3.160
   74    HA   PRO  14           HA       PRO  14   7.461   4.079   0.319
   75   1HB   PRO  14          1HB       PRO  14   7.028   5.795   2.377
   76   2HB   PRO  14          2HB       PRO  14   8.622   5.538   1.665
   77   1HG   PRO  14          1HG       PRO  14   6.800   7.844   1.424
   78   2HG   PRO  14          2HG       PRO  14   8.555   7.775   1.225
   79   1HD   PRO  14          1HD       PRO  14   6.582   7.842  -0.821
   80   2HD   PRO  14          2HD       PRO  14   8.329   7.634  -1.018
   81    H    CYS  15           H        CYS  15   5.792   3.384   1.927
   82    HA   CYS  15           HA       CYS  15   3.155   3.666   0.840
   83   1HB   CYS  15          1HB       CYS  15   3.711   2.528   3.584
   84   2HB   CYS  15          2HB       CYS  15   2.458   2.079   2.437
   85    H    VAL  16           H        VAL  16   1.445   4.900   1.605
   86    HA   VAL  16           HA       VAL  16   2.101   6.818   3.743
   87    HB   VAL  16           HB       VAL  16   0.018   7.066   1.556
   88   1HG1  VAL  16          1HG1      VAL  16   0.624   8.660   3.963
   89   2HG1  VAL  16          2HG1      VAL  16   0.363   9.568   2.474
   90   3HG1  VAL  16          3HG1      VAL  16  -0.888   8.475   3.071
   91   1HG2  VAL  16          1HG2      VAL  16   2.785   7.420   1.401
   92   2HG2  VAL  16          2HG2      VAL  16   1.572   7.964   0.243
   93   3HG2  VAL  16          3HG2      VAL  16   2.111   9.046   1.530
   94    H    PHE  17           H        PHE  17   1.229   6.284   5.651
   95    HA   PHE  17           HA       PHE  17  -1.413   5.001   5.675
   96   1HB   PHE  17          1HB       PHE  17   0.860   4.780   7.658
   97   2HB   PHE  17          2HB       PHE  17  -0.736   4.100   7.890
   98    HD1  PHE  17           1HD      PHE  17  -0.727   3.466   4.687
   99    HD2  PHE  17           2HD      PHE  17   1.641   2.515   8.073
  100    HE1  PHE  17           1HE      PHE  17   0.033   1.413   3.574
  101    HE2  PHE  17           2HE      PHE  17   2.417   0.465   6.982
  102    HZ   PHE  17           HZ       PHE  17   1.627  -0.115   4.710
  103    HA   PRO  18           HA       PRO  18  -2.906   4.579   6.835
  104   1HB   PRO  18          1HB       PRO  18  -5.456   5.676   7.377
  105   2HB   PRO  18          2HB       PRO  18  -4.503   4.638   8.440
  106   1HG   PRO  18          1HG       PRO  18  -5.148   7.323   8.909
  107   2HG   PRO  18          2HG       PRO  18  -3.912   6.385   9.759
  108   1HD   PRO  18          1HD       PRO  18  -3.604   8.333   7.518
  109   2HD   PRO  18          2HD       PRO  18  -2.524   8.005   8.891
  110    H    PHE  19           H        PHE  19  -3.533   4.042   4.799
  111    HA   PHE  19           HA       PHE  19  -4.421   6.273   3.105
  112   1HB   PHE  19          1HB       PHE  19  -3.879   4.932   1.167
  113   2HB   PHE  19          2HB       PHE  19  -2.498   5.017   2.244
  114    HD1  PHE  19           1HD      PHE  19  -1.861   3.022   3.577
  115    HD2  PHE  19           2HD      PHE  19  -4.867   2.871   0.572
  116    HE1  PHE  19           1HE      PHE  19  -1.611   0.578   3.455
  117    HE2  PHE  19           2HE      PHE  19  -4.621   0.429   0.441
  118    HZ   PHE  19           HZ       PHE  19  -2.988  -0.720   1.878
  119    H    THR  20           H        THR  20  -5.867   5.126   1.173
  120    HA   THR  20           HA       THR  20  -7.958   3.582   2.525
  121    HB   THR  20           HB       THR  20  -8.527   6.068   0.874
  122    HG1  THR  20           1HG      THR  20  -7.541   6.603   2.872
  123   1HG2  THR  20          1HG2      THR  20 -10.632   5.545   2.612
  124   2HG2  THR  20          2HG2      THR  20 -10.613   5.363   0.857
  125   3HG2  THR  20          3HG2      THR  20 -10.220   3.988   1.893
  126    H    PHE  21           H        PHE  21  -8.404   1.883   1.345
  127    HA   PHE  21           HA       PHE  21  -8.157   2.069  -1.589
  128   1HB   PHE  21          1HB       PHE  21  -6.522   0.469  -0.495
  129   2HB   PHE  21          2HB       PHE  21  -7.899  -0.424   0.097
  130    HD1  PHE  21           1HD      PHE  21  -6.162   0.602  -2.975
  131    HD2  PHE  21           2HD      PHE  21  -9.064  -1.991  -1.275
  132    HE1  PHE  21           1HE      PHE  21  -6.123  -0.737  -5.015
  133    HE2  PHE  21           2HE      PHE  21  -9.032  -3.342  -3.323
  134    HZ   PHE  21           HZ       PHE  21  -7.570  -2.729  -5.204
  135    H    LEU  22           H        LEU  22  -9.859   1.529  -2.714
  136    HA   LEU  22           HA       LEU  22 -12.066   1.379  -3.137
  137   1HB   LEU  22          1HB       LEU  22 -10.807  -1.115  -2.216
  138   2HB   LEU  22          2HB       LEU  22 -12.477  -1.162  -2.746
  139    HG   LEU  22           HG       LEU  22 -10.796  -1.723  -4.505
  140   1HD1  LEU  22          1HD1      LEU  22 -13.115  -0.560  -4.713
  141   2HD1  LEU  22          2HD1      LEU  22 -12.117   0.765  -5.309
  142   3HD1  LEU  22          3HD1      LEU  22 -12.067  -0.805  -6.115
  143   1HD2  LEU  22          1HD2      LEU  22 -10.138   1.183  -4.261
  144   2HD2  LEU  22          2HD2      LEU  22  -9.043  -0.173  -3.991
  145   3HD2  LEU  22          3HD2      LEU  22  -9.673   0.146  -5.610
  146    H    GLY  23           H        GLY  23 -12.041   2.730  -0.858
  147   1HA   GLY  23          1HA       GLY  23 -13.824   3.414   0.504
  148   2HA   GLY  23          2HA       GLY  23 -14.508   1.810   0.398
  149    H    ASN  24           H        ASN  24 -11.437   1.065   1.360
  150    HA   ASN  24           HA       ASN  24 -12.269   1.306   4.180
  151   1HB   ASN  24          1HB       ASN  24 -10.339  -0.659   2.940
  152   2HB   ASN  24          2HB       ASN  24 -10.923  -0.668   4.597
  153   1HD2  ASN  24          1HD2      ASN  24 -12.935  -2.533   1.734
  154   2HD2  ASN  24          2HD2      ASN  24 -11.347  -1.878   1.548
  155    H    LYS  25           H        LYS  25 -10.744   1.832   5.795
  156    HA   LYS  25           HA       LYS  25  -8.560   3.493   4.875
  157   1HB   LYS  25          1HB       LYS  25  -9.644   2.981   7.653
  158   2HB   LYS  25          2HB       LYS  25  -8.536   4.237   7.182
  159   1HG   LYS  25          1HG       LYS  25 -11.355   4.005   6.197
  160   2HG   LYS  25          2HG       LYS  25 -10.826   5.063   7.505
  161   1HD   LYS  25          1HD       LYS  25  -9.759   5.194   4.683
  162   2HD   LYS  25          2HD       LYS  25 -11.080   6.194   5.285
  163   1HE   LYS  25          1HE       LYS  25  -8.280   6.132   6.407
  164   2HE   LYS  25          2HE       LYS  25  -8.921   7.371   5.322
  165   1HZ   LYS  25          1HZ       LYS  25 -10.722   7.206   7.409
  166   2HZ   LYS  25          2HZ       LYS  25  -9.187   7.143   8.150
  167   3HZ   LYS  25          3HZ       LYS  25  -9.585   8.440   7.132
  168    H    TYR  26           H        TYR  26  -6.469   2.733   4.890
  169    HA   TYR  26           HA       TYR  26  -5.975   0.282   6.419
  170   1HB   TYR  26          1HB       TYR  26  -4.698   1.254   3.871
  171   2HB   TYR  26          2HB       TYR  26  -4.256  -0.216   4.732
  172    HD1  TYR  26           1HD      TYR  26  -6.803   1.410   2.673
  173    HD2  TYR  26           2HD      TYR  26  -5.706  -2.158   4.684
  174    HE1  TYR  26           1HE      TYR  26  -8.548   0.202   1.465
  175    HE2  TYR  26           2HE      TYR  26  -7.453  -3.378   3.487
  176    HH   TYR  26           HH       TYR  26  -9.228  -3.223   2.123
  177    H    GLU  27           H        GLU  27  -4.839   0.613   8.109
  178    HA   GLU  27           HA       GLU  27  -2.987   2.845   8.322
  179   1HB   GLU  27          1HB       GLU  27  -4.023   0.860  10.332
  180   2HB   GLU  27          2HB       GLU  27  -2.958   2.185  10.715
  181   1HG   GLU  27          1HG       GLU  27  -4.614   3.798  10.166
  182   2HG   GLU  27          2HG       GLU  27  -5.667   2.560   9.486
  183    H    SER  28           H        SER  28  -2.995  -0.413   7.577
  184    HA   SER  28           HA       SER  28  -0.099  -0.572   7.889
  185   1HB   SER  28          1HB       SER  28  -0.556  -3.064   8.325
  186   2HB   SER  28          2HB       SER  28  -0.887  -1.959   9.653
  187    HG   SER  28           HG       SER  28  -2.549  -3.675   8.528
  188    H    CYS  29           H        CYS  29   0.205  -3.059   6.571
  189    HA   CYS  29           HA       CYS  29  -0.383  -2.230   3.885
  190   1HB   CYS  29          1HB       CYS  29   0.899  -4.723   4.978
  191   2HB   CYS  29          2HB       CYS  29   0.668  -4.427   3.270
  192    H    THR  30           H        THR  30  -1.293  -3.929   2.368
  193    HA   THR  30           HA       THR  30  -3.435  -5.507   3.561
  194    HB   THR  30           HB       THR  30  -4.412  -3.234   3.176
  195    HG1  THR  30           1HG      THR  30  -5.915  -4.754   2.984
  196   1HG2  THR  30          1HG2      THR  30  -4.656  -3.416   0.327
  197   2HG2  THR  30          2HG2      THR  30  -4.081  -2.078   1.320
  198   3HG2  THR  30          3HG2      THR  30  -2.955  -3.323   0.781
  199    H    SER  31           H        SER  31  -4.622  -6.701   1.798
  200    HA   SER  31           HA       SER  31  -2.852  -7.290  -0.468
  201   1HB   SER  31          1HB       SER  31  -3.682  -9.675  -0.310
  202   2HB   SER  31          2HB       SER  31  -2.646  -9.168   1.034
  203    HG   SER  31           HG       SER  31  -5.259  -9.970   1.037
  204    H    ALA  32           H        ALA  32  -5.160  -5.565   0.170
  205    HA   ALA  32           HA       ALA  32  -7.551  -6.420  -0.969
  206   1HB   ALA  32          1HB       ALA  32  -6.871  -4.276   0.417
  207   2HB   ALA  32          2HB       ALA  32  -6.710  -3.565  -1.189
  208   3HB   ALA  32          3HB       ALA  32  -8.256  -4.240  -0.674
  209    H    GLY  33           H        GLY  33  -8.312  -6.586  -2.940
  210   1HA   GLY  33          1HA       GLY  33  -8.489  -6.430  -5.226
  211   2HA   GLY  33          2HA       GLY  33  -7.273  -5.159  -5.185
  212    H    ARG  34           H        ARG  34  -5.948  -7.695  -3.547
  213    HA   ARG  34           HA       ARG  34  -4.596  -8.583  -5.996
  214   1HB   ARG  34          1HB       ARG  34  -3.651  -8.640  -3.135
  215   2HB   ARG  34          2HB       ARG  34  -2.770  -9.301  -4.489
  216   1HG   ARG  34          1HG       ARG  34  -3.120  -6.830  -5.411
  217   2HG   ARG  34          2HG       ARG  34  -3.154  -6.497  -3.680
  218   1HD   ARG  34          1HD       ARG  34  -0.883  -6.334  -4.644
  219   2HD   ARG  34          2HD       ARG  34  -1.003  -7.575  -3.389
  220    HE   ARG  34           HE       ARG  34  -0.503  -9.156  -4.949
  221   1HH1  ARG  34          1HH1      ARG  34  -1.584  -6.287  -6.648
  222   2HH1  ARG  34          2HH1      ARG  34  -1.117  -6.887  -8.205
  223   1HH2  ARG  34          1HH2      ARG  34   0.085  -9.942  -7.008
  224   2HH2  ARG  34          2HH2      ARG  34  -0.165  -8.948  -8.415
  225    H    SER  35           H        SER  35  -4.697 -10.146  -2.849
  226    HA   SER  35           HA       SER  35  -5.201 -12.253  -2.183
  227   1HB   SER  35          1HB       SER  35  -7.117 -12.118  -4.521
  228   2HB   SER  35          2HB       SER  35  -7.088 -13.429  -3.343
  229    HG   SER  35           HG       SER  35  -7.564 -10.673  -2.790
  230    H    ASP  36           H        ASP  36  -3.101 -11.667  -4.184
  231    HA   ASP  36           HA       ASP  36  -2.944 -14.161  -5.673
  232   1HB   ASP  36          1HB       ASP  36  -1.418 -13.095  -7.073
  233   2HB   ASP  36          2HB       ASP  36  -2.516 -11.807  -6.629
  234    H    GLY  37           H        GLY  37  -1.415 -12.336  -3.186
  235   1HA   GLY  37          1HA       GLY  37  -0.487 -14.209  -1.550
  236   2HA   GLY  37          2HA       GLY  37   0.702 -14.314  -2.837
  237    H    LYS  38           H        LYS  38   0.923 -11.560  -3.474
  238    HA   LYS  38           HA       LYS  38   2.597 -10.726  -1.273
  239   1HB   LYS  38          1HB       LYS  38   2.011  -9.109  -3.720
  240   2HB   LYS  38          2HB       LYS  38   3.480  -9.160  -2.751
  241   1HG   LYS  38          1HG       LYS  38   2.498 -11.417  -4.463
  242   2HG   LYS  38          2HG       LYS  38   3.681 -10.236  -4.963
  243   1HD   LYS  38          1HD       LYS  38   3.954 -12.154  -2.652
  244   2HD   LYS  38          2HD       LYS  38   4.798 -12.254  -4.198
  245   1HE   LYS  38          1HE       LYS  38   5.888 -10.094  -3.723
  246   2HE   LYS  38          2HE       LYS  38   5.073 -10.047  -2.160
  247   1HZ   LYS  38          1HZ       LYS  38   6.219 -12.145  -1.592
  248   2HZ   LYS  38          2HZ       LYS  38   7.077 -12.050  -3.054
  249   3HZ   LYS  38          3HZ       LYS  38   7.289 -10.849  -1.868
  250    H    MET  39           H        MET  39   2.169  -9.192   0.192
  251    HA   MET  39           HA       MET  39  -0.380  -7.787   0.017
  252   1HB   MET  39          1HB       MET  39   1.687  -7.724   2.227
  253   2HB   MET  39          2HB       MET  39   0.056  -7.092   2.297
  254   1HG   MET  39          1HG       MET  39  -0.058  -9.064   3.501
  255   2HG   MET  39          2HG       MET  39  -0.716  -9.489   1.922
  256   1HE   MET  39          1HE       MET  39  -0.291 -11.422   3.717
  257   2HE   MET  39          2HE       MET  39   0.397 -12.650   2.656
  258   3HE   MET  39          3HE       MET  39   1.293 -12.107   4.076
  259    H    TRP  40           H        TRP  40  -0.448  -5.496  -0.034
  260    HA   TRP  40           HA       TRP  40   2.123  -4.221  -0.678
  261   1HB   TRP  40          1HB       TRP  40   0.939  -2.888  -2.400
  262   2HB   TRP  40          2HB       TRP  40   0.927  -4.613  -2.765
  263    HD1  TRP  40           HD1      TRP  40  -1.519  -5.892  -1.999
  264    HE1  TRP  40           1HE      TRP  40  -3.909  -4.952  -2.197
  265    HE3  TRP  40           3HE      TRP  40  -0.407  -0.939  -2.440
  266    HZ2  TRP  40           2HZ      TRP  40  -5.143  -2.442  -2.459
  267    HZ3  TRP  40           3HZ      TRP  40  -2.245   0.672  -2.632
  268    HH2  TRP  40           HH2      TRP  40  -4.562  -0.064  -2.652
  269    H    CYS  41           H        CYS  41   1.339  -1.705  -1.087
  270    HA   CYS  41           HA       CYS  41  -0.313  -0.706   1.081
  271   1HB   CYS  41          1HB       CYS  41   1.524   0.688   2.006
  272   2HB   CYS  41          2HB       CYS  41   1.849  -1.032   2.210
  273    H    ALA  42           H        ALA  42  -1.065   1.402   0.566
  274    HA   ALA  42           HA       ALA  42  -0.605   2.196  -2.164
  275   1HB   ALA  42          1HB       ALA  42  -2.808   2.468  -1.014
  276   2HB   ALA  42          2HB       ALA  42  -2.086   3.765  -0.066
  277   3HB   ALA  42          3HB       ALA  42  -2.209   3.918  -1.819
  278    H    THR  43           H        THR  43   0.479   3.972  -2.888
  279    HA   THR  43           HA       THR  43   2.396   5.061  -0.981
  280    HB   THR  43           HB       THR  43   3.684   5.676  -2.998
  281    HG1  THR  43           1HG      THR  43   2.626   5.796  -4.809
  282   1HG2  THR  43          1HG2      THR  43   3.562   3.120  -3.925
  283   2HG2  THR  43          2HG2      THR  43   4.491   3.649  -2.521
  284   3HG2  THR  43          3HG2      THR  43   2.883   2.957  -2.305
  285    H    THR  44           H        THR  44  -0.504   5.778  -1.750
  286    HA   THR  44           HA       THR  44  -0.103   8.665  -1.612
  287    HB   THR  44           HB       THR  44  -2.147   8.906  -3.095
  288    HG1  THR  44           1HG      THR  44  -3.033   7.189  -3.900
  289   1HG2  THR  44          1HG2      THR  44  -0.992   8.662  -5.195
  290   2HG2  THR  44          2HG2      THR  44   0.100   9.331  -3.984
  291   3HG2  THR  44          3HG2      THR  44   0.227   7.632  -4.441
  292    H    ALA  45           H        ALA  45  -1.694   9.730  -0.353
  293    HA   ALA  45           HA       ALA  45  -2.744   8.277   1.781
  294   1HB   ALA  45          1HB       ALA  45  -3.412  11.020   0.744
  295   2HB   ALA  45          2HB       ALA  45  -4.112  10.355   2.222
  296   3HB   ALA  45          3HB       ALA  45  -2.367  10.582   2.096
  297    H    ASN  46           H        ASN  46  -4.430   9.513  -1.106
  298    HA   ASN  46           HA       ASN  46  -6.650   7.729  -0.393
  299   1HB   ASN  46          1HB       ASN  46  -7.224  10.165  -0.628
  300   2HB   ASN  46          2HB       ASN  46  -6.766  10.052  -2.332
  301   1HD2  ASN  46          1HD2      ASN  46 -10.330   8.757  -1.025
  302   2HD2  ASN  46          2HD2      ASN  46  -9.139   9.402   0.040
  303    H    TYR  47           H        TYR  47  -6.105   5.846  -1.309
  304    HA   TYR  47           HA       TYR  47  -4.794   5.641  -3.829
  305   1HB   TYR  47          1HB       TYR  47  -4.658   3.930  -2.000
  306   2HB   TYR  47          2HB       TYR  47  -6.322   3.486  -2.362
  307    HD1  TYR  47           1HD      TYR  47  -6.877   2.355  -4.455
  308    HD2  TYR  47           2HD      TYR  47  -2.852   3.285  -3.465
  309    HE1  TYR  47           1HE      TYR  47  -6.096   0.773  -6.165
  310    HE2  TYR  47           2HE      TYR  47  -2.065   1.711  -5.176
  311    HH   TYR  47           HH       TYR  47  -3.253  -0.519  -6.322
  312    H    ASP  48           H        ASP  48  -8.117   5.557  -2.746
  313    HA   ASP  48           HA       ASP  48  -9.515   4.415  -4.778
  314   1HB   ASP  48          1HB       ASP  48 -10.177   6.951  -3.277
  315   2HB   ASP  48          2HB       ASP  48 -11.325   6.072  -4.283
  316    H    ASP  49           H        ASP  49  -8.138   7.651  -4.754
  317    HA   ASP  49           HA       ASP  49  -9.106   8.151  -7.454
  318   1HB   ASP  49          1HB       ASP  49  -7.893   9.865  -5.316
  319   2HB   ASP  49          2HB       ASP  49  -7.930  10.418  -6.988
  320    H    ASP  50           H        ASP  50  -5.962   8.401  -5.757
  321    HA   ASP  50           HA       ASP  50  -4.479   8.800  -8.138
  322   1HB   ASP  50          1HB       ASP  50  -3.677   8.065  -5.334
  323   2HB   ASP  50          2HB       ASP  50  -2.497   8.253  -6.627
  324    H    ARG  51           H        ARG  51  -5.240   5.869  -6.347
  325    HA   ARG  51           HA       ARG  51  -4.793   3.691  -6.679
  326   1HB   ARG  51          1HB       ARG  51  -5.025   4.601  -9.524
  327   2HB   ARG  51          2HB       ARG  51  -5.045   2.921  -9.009
  328   1HG   ARG  51          1HG       ARG  51  -6.849   4.475  -7.455
  329   2HG   ARG  51          2HG       ARG  51  -7.219   4.646  -9.172
  330   1HD   ARG  51          1HD       ARG  51  -7.032   2.139  -7.529
  331   2HD   ARG  51          2HD       ARG  51  -8.471   2.813  -8.293
  332    HE   ARG  51           HE       ARG  51  -6.460   2.239 -10.231
  333   1HH1  ARG  51          1HH1      ARG  51  -9.012   0.813  -8.320
  334   2HH1  ARG  51          2HH1      ARG  51  -9.153  -0.605  -9.315
  335   1HH2  ARG  51          1HH2      ARG  51  -6.651   0.415 -11.568
  336   2HH2  ARG  51          2HH2      ARG  51  -7.761  -0.860 -11.155
  337    H    LYS  52           H        LYS  52  -2.444   5.139  -6.198
  338    HA   LYS  52           HA       LYS  52  -0.543   3.671  -7.873
  339   1HB   LYS  52          1HB       LYS  52  -0.139   6.202  -6.265
  340   2HB   LYS  52          2HB       LYS  52   1.182   5.286  -6.988
  341   1HG   LYS  52          1HG       LYS  52   0.136   5.579  -9.197
  342   2HG   LYS  52          2HG       LYS  52  -1.110   6.570  -8.455
  343   1HD   LYS  52          1HD       LYS  52   0.447   8.089  -9.368
  344   2HD   LYS  52          2HD       LYS  52   0.787   8.068  -7.634
  345   1HE   LYS  52          1HE       LYS  52   2.670   6.601  -7.964
  346   2HE   LYS  52          2HE       LYS  52   2.266   6.397  -9.672
  347   1HZ   LYS  52          1HZ       LYS  52   2.540   8.991  -9.657
  348   2HZ   LYS  52          2HZ       LYS  52   3.526   8.664  -8.306
  349   3HZ   LYS  52          3HZ       LYS  52   3.889   7.966  -9.807
  350    H    TRP  53           H        TRP  53   0.244   1.958  -7.021
  351    HA   TRP  53           HA       TRP  53   0.370   1.747  -4.093
  352   1HB   TRP  53          1HB       TRP  53  -0.415  -0.534  -4.331
  353   2HB   TRP  53          2HB       TRP  53  -1.533   0.564  -5.049
  354    HD1  TRP  53           HD1      TRP  53  -1.142   0.803  -7.932
  355    HE1  TRP  53           1HE      TRP  53  -0.693  -1.157  -9.549
  356    HE3  TRP  53           3HE      TRP  53   0.394  -2.538  -4.527
  357    HZ2  TRP  53           2HZ      TRP  53   0.200  -3.867  -9.340
  358    HZ3  TRP  53           3HZ      TRP  53   1.030  -4.833  -5.254
  359    HH2  TRP  53           HH2      TRP  53   0.929  -5.469  -7.620
  360    H    GLY  54           H        GLY  54   1.551  -0.233  -3.437
  361   1HA   GLY  54          1HA       GLY  54   3.728  -1.207  -5.023
  362   2HA   GLY  54          2HA       GLY  54   4.249  -0.054  -3.796
  363    H    PHE  55           H        PHE  55   4.555  -3.062  -4.112
  364    HA   PHE  55           HA       PHE  55   3.050  -4.394  -2.192
  365   1HB   PHE  55          1HB       PHE  55   5.787  -4.873  -3.336
  366   2HB   PHE  55          2HB       PHE  55   5.108  -5.931  -2.117
  367    HD1  PHE  55           1HD      PHE  55   2.204  -5.611  -3.253
  368    HD2  PHE  55           2HD      PHE  55   5.955  -6.615  -4.994
  369    HE1  PHE  55           1HE      PHE  55   1.057  -6.994  -4.939
  370    HE2  PHE  55           2HE      PHE  55   4.812  -7.982  -6.680
  371    HZ   PHE  55           HZ       PHE  55   2.359  -8.163  -6.659
  372    H    CYS  56           H        CYS  56   3.605  -5.124  -0.118
  373    HA   CYS  56           HA       CYS  56   4.574  -3.126   1.648
  374   1HB   CYS  56          1HB       CYS  56   2.854  -5.077   2.019
  375   2HB   CYS  56          2HB       CYS  56   4.282  -6.043   2.357
  376    HA   PRO  57           HA       PRO  57   8.928  -3.957   1.639
  377   1HB   PRO  57          1HB       PRO  57   9.638  -3.620   4.208
  378   2HB   PRO  57          2HB       PRO  57   9.168  -2.272   3.156
  379   1HG   PRO  57          1HG       PRO  57   7.473  -3.873   5.018
  380   2HG   PRO  57          2HG       PRO  57   7.670  -2.108   4.989
  381   1HD   PRO  57          1HD       PRO  57   5.570  -3.184   3.814
  382   2HD   PRO  57          2HD       PRO  57   6.496  -1.939   2.941
  383    H    ASP  58           H        ASP  58  10.253  -4.949   4.028
  384    HA   ASP  58           HA       ASP  58  10.472  -7.642   3.317
  385   1HB   ASP  58          1HB       ASP  58  12.272  -6.468   4.468
  386   2HB   ASP  58          2HB       ASP  58  11.274  -6.318   5.911
  387    H    GLN  59           H        GLN  59   9.067  -9.190   3.560
  388    HA   GLN  59           HA       GLN  59   7.551  -9.400   6.079
  389   1HB   GLN  59          1HB       GLN  59   6.445 -10.232   3.394
  390   2HB   GLN  59          2HB       GLN  59   5.585 -10.138   4.918
  391   1HG   GLN  59          1HG       GLN  59   5.818  -7.692   4.864
  392   2HG   GLN  59          2HG       GLN  59   6.614  -7.834   3.294
  393   1HE2  GLN  59          1HE2      GLN  59   3.699  -8.137   1.487
  394   2HE2  GLN  59          2HE2      GLN  59   5.423  -8.012   1.514
  395    H    GLY  60           H        GLY  60   8.398 -11.104   3.093
  396   1HA   GLY  60          1HA       GLY  60   9.918 -13.147   4.199
  397   2HA   GLY  60          2HA       GLY  60   8.253 -13.719   4.174
  Start of MODEL   21
    1    H    SER   1           1H       SER   1  13.138   6.695  10.508
    2    HA   SER   1           HA       SER   1  13.508   7.609   8.535
    3   1HB   SER   1          1HB       SER   1  15.013   5.099   7.740
    4   2HB   SER   1          2HB       SER   1  14.938   6.607   6.828
    5    HG   SER   1           HG       SER   1  16.725   6.992   7.916
    6    H    TRP   2           H        TRP   2  12.573   7.273   6.325
    7    HA   TRP   2           HA       TRP   2  10.212   5.617   6.537
    8   1HB   TRP   2          1HB       TRP   2  11.148   7.520   4.378
    9   2HB   TRP   2          2HB       TRP   2   9.635   6.626   4.313
   10    HD1  TRP   2           HD1      TRP   2   8.225   7.073   6.895
   11    HE1  TRP   2           1HE      TRP   2   7.591   9.407   7.786
   12    HE3  TRP   2           3HE      TRP   2  11.583   9.873   4.265
   13    HZ2  TRP   2           2HZ      TRP   2   8.418  12.080   7.423
   14    HZ3  TRP   2           3HZ      TRP   2  11.601  12.313   4.590
   15    HH2  TRP   2           HH2      TRP   2  10.051  13.388   6.133
   16    H    MET   3           H        MET   3  10.014   3.625   5.750
   17    HA   MET   3           HA       MET   3  12.201   2.469   4.251
   18   1HB   MET   3          1HB       MET   3   9.614   1.257   5.238
   19   2HB   MET   3          2HB       MET   3  10.942   0.361   4.513
   20   1HG   MET   3          1HG       MET   3  12.403   1.004   6.343
   21   2HG   MET   3          2HG       MET   3  11.103   1.949   7.063
   22   1HE   MET   3          1HE       MET   3   8.585   0.287   6.653
   23   2HE   MET   3          2HE       MET   3   8.519  -0.814   8.032
   24   3HE   MET   3          3HE       MET   3   8.964   0.875   8.271
   25    H    SER   4           H        SER   4  12.240   1.960   2.144
   26    HA   SER   4           HA       SER   4  10.260   3.050   0.399
   27   1HB   SER   4          1HB       SER   4  12.487   1.136  -0.325
   28   2HB   SER   4          2HB       SER   4  11.669   2.283  -1.389
   29    HG   SER   4           HG       SER   4  13.227   3.593  -0.848
   30    H    THR   5           H        THR   5   9.130   1.765  -1.277
   31    HA   THR   5           HA       THR   5   8.064  -0.664  -0.070
   32    HB   THR   5           HB       THR   5   6.349  -0.362  -1.957
   33    HG1  THR   5           1HG      THR   5   7.226   2.310  -1.941
   34   1HG2  THR   5          1HG2      THR   5   5.184   1.501  -0.779
   35   2HG2  THR   5          2HG2      THR   5   5.666   0.147   0.243
   36   3HG2  THR   5          3HG2      THR   5   6.604   1.640   0.256
   37    H    VAL   6           H        VAL   6   7.454  -2.425  -1.456
   38    HA   VAL   6           HA       VAL   6   9.429  -2.985  -3.585
   39    HB   VAL   6           HB       VAL   6   7.909  -5.276  -2.622
   40   1HG1  VAL   6          1HG1      VAL   6  10.318  -4.829  -3.847
   41   2HG1  VAL   6          2HG1      VAL   6  10.787  -5.338  -2.223
   42   3HG1  VAL   6          3HG1      VAL   6   9.750  -6.370  -3.204
   43   1HG2  VAL   6          1HG2      VAL   6   9.039  -3.525  -0.595
   44   2HG2  VAL   6          2HG2      VAL   6   7.926  -4.880  -0.430
   45   3HG2  VAL   6          3HG2      VAL   6   9.662  -5.176  -0.510
   46    H    GLY   7           H        GLY   7   8.043  -5.124  -4.647
   47   1HA   GLY   7          1HA       GLY   7   6.533  -5.385  -6.423
   48   2HA   GLY   7          2HA       GLY   7   5.419  -5.176  -5.105
   49    H    GLY   8           H        GLY   8   3.881  -3.860  -5.540
   50   1HA   GLY   8          1HA       GLY   8   2.646  -2.254  -6.693
   51   2HA   GLY   8          2HA       GLY   8   3.724  -1.275  -5.734
   52    H    ASN   9           H        ASN   9   4.065   0.421  -6.913
   53    HA   ASN   9           HA       ASN   9   5.491   0.104  -9.436
   54   1HB   ASN   9          1HB       ASN   9   4.092   1.667 -10.629
   55   2HB   ASN   9          2HB       ASN   9   3.069   0.388 -10.007
   56   1HD2  ASN   9          1HD2      ASN   9   1.170   2.412  -7.988
   57   2HD2  ASN   9          2HD2      ASN   9   1.687   0.821  -8.393
   58    H    SER  10           H        SER  10   4.464   2.000  -6.692
   59    HA   SER  10           HA       SER  10   5.867   4.373  -7.121
   60   1HB   SER  10          1HB       SER  10   5.552   3.062  -4.414
   61   2HB   SER  10          2HB       SER  10   5.616   4.780  -4.784
   62    HG   SER  10           HG       SER  10   3.480   4.249  -4.470
   63    H    GLY  11           H        GLY  11   6.926   1.744  -4.949
   64   1HA   GLY  11          1HA       GLY  11   9.004   0.828  -4.602
   65   2HA   GLY  11          2HA       GLY  11   9.556   1.644  -6.058
   66    H    GLY  12           H        GLY  12   9.872   4.064  -5.796
   67   1HA   GLY  12          1HA       GLY  12  11.730   4.474  -3.680
   68   2HA   GLY  12          2HA       GLY  12  11.211   5.678  -4.846
   69    H    ALA  13           H        ALA  13   8.345   4.831  -3.767
   70    HA   ALA  13           HA       ALA  13   8.407   6.893  -1.693
   71   1HB   ALA  13          1HB       ALA  13   6.066   5.648  -3.123
   72   2HB   ALA  13          2HB       ALA  13   5.970   6.947  -1.934
   73   3HB   ALA  13          3HB       ALA  13   6.792   7.220  -3.472
   74    HA   PRO  14           HA       PRO  14   7.810   3.807   1.428
   75   1HB   PRO  14          1HB       PRO  14   7.430   5.509   3.513
   76   2HB   PRO  14          2HB       PRO  14   9.010   5.199   2.786
   77   1HG   PRO  14          1HG       PRO  14   7.291   7.587   2.616
   78   2HG   PRO  14          2HG       PRO  14   9.031   7.430   2.341
   79   1HD   PRO  14          1HD       PRO  14   6.957   7.593   0.382
   80   2HD   PRO  14          2HD       PRO  14   8.694   7.374   0.108
   81    H    CYS  15           H        CYS  15   6.239   3.127   3.093
   82    HA   CYS  15           HA       CYS  15   3.548   3.380   2.139
   83   1HB   CYS  15          1HB       CYS  15   4.290   2.295   4.861
   84   2HB   CYS  15          2HB       CYS  15   2.934   1.845   3.836
   85    H    VAL  16           H        VAL  16   2.053   4.870   2.752
   86    HA   VAL  16           HA       VAL  16   2.779   6.645   4.968
   87    HB   VAL  16           HB       VAL  16   0.694   7.118   2.833
   88   1HG1  VAL  16          1HG1      VAL  16   1.747   8.728   5.114
   89   2HG1  VAL  16          2HG1      VAL  16   1.207   9.545   3.645
   90   3HG1  VAL  16          3HG1      VAL  16   0.088   8.528   4.548
   91   1HG2  VAL  16          1HG2      VAL  16   3.393   7.034   2.426
   92   2HG2  VAL  16          2HG2      VAL  16   2.255   7.982   1.468
   93   3HG2  VAL  16          3HG2      VAL  16   3.132   8.738   2.797
   94    H    PHE  17           H        PHE  17   1.988   5.790   6.817
   95    HA   PHE  17           HA       PHE  17  -0.778   4.844   6.826
   96   1HB   PHE  17          1HB       PHE  17   1.381   4.504   8.909
   97   2HB   PHE  17          2HB       PHE  17  -0.234   3.839   8.993
   98    HD1  PHE  17           1HD      PHE  17  -0.838   2.460   6.683
   99    HD2  PHE  17           2HD      PHE  17   2.980   3.048   8.441
  100    HE1  PHE  17           1HE      PHE  17  -0.004   0.437   5.558
  101    HE2  PHE  17           2HE      PHE  17   3.836   1.035   7.332
  102    HZ   PHE  17           HZ       PHE  17   2.344  -0.302   5.866
  103    HA   PRO  18           HA       PRO  18  -2.246   4.434   8.113
  104   1HB   PRO  18          1HB       PRO  18  -4.741   5.315   8.609
  105   2HB   PRO  18          2HB       PRO  18  -3.641   4.799   9.886
  106   1HG   PRO  18          1HG       PRO  18  -4.496   7.526   9.119
  107   2HG   PRO  18          2HG       PRO  18  -3.965   6.915  10.692
  108   1HD   PRO  18          1HD       PRO  18  -2.431   8.400   8.830
  109   2HD   PRO  18          2HD       PRO  18  -1.849   7.607  10.308
  110    H    PHE  19           H        PHE  19  -2.979   3.811   6.151
  111    HA   PHE  19           HA       PHE  19  -3.855   5.999   4.394
  112   1HB   PHE  19          1HB       PHE  19  -3.311   4.677   2.455
  113   2HB   PHE  19          2HB       PHE  19  -1.915   4.784   3.508
  114    HD1  PHE  19           1HD      PHE  19  -1.379   2.754   4.961
  115    HD2  PHE  19           2HD      PHE  19  -4.086   2.654   1.684
  116    HE1  PHE  19           1HE      PHE  19  -1.076   0.317   4.782
  117    HE2  PHE  19           2HE      PHE  19  -3.792   0.225   1.504
  118    HZ   PHE  19           HZ       PHE  19  -2.280  -0.949   3.047
  119    H    THR  20           H        THR  20  -5.308   4.675   2.496
  120    HA   THR  20           HA       THR  20  -7.348   3.215   3.990
  121    HB   THR  20           HB       THR  20  -7.828   5.825   2.535
  122    HG1  THR  20           1HG      THR  20  -7.248   5.319   5.033
  123   1HG2  THR  20          1HG2      THR  20 -10.175   5.379   3.708
  124   2HG2  THR  20          2HG2      THR  20  -9.826   4.937   2.036
  125   3HG2  THR  20          3HG2      THR  20  -9.732   3.719   3.308
  126    H    PHE  21           H        PHE  21  -8.147   1.616   2.899
  127    HA   PHE  21           HA       PHE  21  -8.224   1.737  -0.040
  128   1HB   PHE  21          1HB       PHE  21  -6.240   0.390   0.943
  129   2HB   PHE  21          2HB       PHE  21  -7.459  -0.759   1.445
  130    HD1  PHE  21           1HD      PHE  21  -8.115   0.932  -1.701
  131    HD2  PHE  21           2HD      PHE  21  -6.260  -2.433   0.120
  132    HE1  PHE  21           1HE      PHE  21  -7.984  -0.198  -3.872
  133    HE2  PHE  21           2HE      PHE  21  -6.137  -3.561  -2.039
  134    HZ   PHE  21           HZ       PHE  21  -6.990  -2.429  -4.063
  135    H    LEU  22           H        LEU  22  -9.992   0.673  -0.897
  136    HA   LEU  22           HA       LEU  22 -12.172   0.234  -1.002
  137   1HB   LEU  22          1HB       LEU  22 -10.985  -1.842   0.725
  138   2HB   LEU  22          2HB       LEU  22 -12.547  -2.039  -0.054
  139    HG   LEU  22           HG       LEU  22 -11.404  -2.901  -1.772
  140   1HD1  LEU  22          1HD1      LEU  22 -11.282  -0.256  -2.260
  141   2HD1  LEU  22          2HD1      LEU  22  -9.634  -0.826  -2.527
  142   3HD1  LEU  22          3HD1      LEU  22 -10.976  -1.557  -3.409
  143   1HD2  LEU  22          1HD2      LEU  22  -9.332  -2.494   0.085
  144   2HD2  LEU  22          2HD2      LEU  22  -9.622  -3.841  -1.017
  145   3HD2  LEU  22          3HD2      LEU  22  -8.755  -2.412  -1.580
  146    H    GLY  23           H        GLY  23 -11.683   2.188   1.063
  147   1HA   GLY  23          1HA       GLY  23 -13.256   3.264   2.430
  148   2HA   GLY  23          2HA       GLY  23 -14.127   1.755   2.579
  149    H    ASN  24           H        ASN  24 -11.141   0.724   3.338
  150    HA   ASN  24           HA       ASN  24 -11.612   1.303   6.180
  151   1HB   ASN  24          1HB       ASN  24 -10.205  -0.979   4.806
  152   2HB   ASN  24          2HB       ASN  24 -10.271  -0.777   6.548
  153   1HD2  ASN  24          1HD2      ASN  24 -13.273  -2.460   4.545
  154   2HD2  ASN  24          2HD2      ASN  24 -11.760  -2.033   3.841
  155    H    LYS  25           H        LYS  25 -10.045   2.152   7.472
  156    HA   LYS  25           HA       LYS  25  -7.775   3.380   6.236
  157   1HB   LYS  25          1HB       LYS  25  -8.652   3.178   9.120
  158   2HB   LYS  25          2HB       LYS  25  -7.423   4.239   8.493
  159   1HG   LYS  25          1HG       LYS  25  -9.045   5.489   7.228
  160   2HG   LYS  25          2HG       LYS  25 -10.310   4.346   7.691
  161   1HD   LYS  25          1HD       LYS  25 -10.543   6.257   9.080
  162   2HD   LYS  25          2HD       LYS  25  -9.881   4.955  10.073
  163   1HE   LYS  25          1HE       LYS  25  -7.592   5.936   9.593
  164   2HE   LYS  25          2HE       LYS  25  -8.433   7.335   8.923
  165   1HZ   LYS  25          1HZ       LYS  25  -9.647   7.269  11.227
  166   2HZ   LYS  25          2HZ       LYS  25  -8.259   6.421  11.718
  167   3HZ   LYS  25          3HZ       LYS  25  -8.116   7.996  11.086
  168    H    TYR  26           H        TYR  26  -5.806   2.385   6.050
  169    HA   TYR  26           HA       TYR  26  -5.375  -0.005   7.699
  170   1HB   TYR  26          1HB       TYR  26  -4.094   0.834   5.099
  171   2HB   TYR  26          2HB       TYR  26  -3.716  -0.633   5.988
  172    HD1  TYR  26           1HD      TYR  26  -7.002  -0.542   6.635
  173    HD2  TYR  26           2HD      TYR  26  -4.472  -0.915   3.247
  174    HE1  TYR  26           1HE      TYR  26  -8.783  -1.709   5.434
  175    HE2  TYR  26           2HE      TYR  26  -6.249  -2.084   2.040
  176    HH   TYR  26           HH       TYR  26  -9.231  -1.965   2.615
  177    H    GLU  27           H        GLU  27  -4.208   0.261   9.348
  178    HA   GLU  27           HA       GLU  27  -2.311   2.431   9.649
  179   1HB   GLU  27          1HB       GLU  27  -3.082   0.199  11.521
  180   2HB   GLU  27          2HB       GLU  27  -2.226   1.661  11.940
  181   1HG   GLU  27          1HG       GLU  27  -4.955   1.785  10.751
  182   2HG   GLU  27          2HG       GLU  27  -4.722   1.514  12.474
  183    H    SER  28           H        SER  28  -2.409  -0.913   8.978
  184    HA   SER  28           HA       SER  28   0.521  -1.029   9.011
  185   1HB   SER  28          1HB       SER  28   0.054  -3.567   9.315
  186   2HB   SER  28          2HB       SER  28  -0.111  -2.525  10.725
  187    HG   SER  28           HG       SER  28  -1.884  -3.978  10.462
  188    H    CYS  29           H        CYS  29   0.927  -3.296   7.554
  189    HA   CYS  29           HA       CYS  29   0.163  -2.415   4.953
  190   1HB   CYS  29          1HB       CYS  29   1.511  -4.969   5.815
  191   2HB   CYS  29          2HB       CYS  29   1.376  -4.400   4.164
  192    H    THR  30           H        THR  30  -0.788  -3.985   3.380
  193    HA   THR  30           HA       THR  30  -2.852  -5.677   4.598
  194    HB   THR  30           HB       THR  30  -3.836  -3.402   4.195
  195    HG1  THR  30           1HG      THR  30  -5.340  -4.944   4.026
  196   1HG2  THR  30          1HG2      THR  30  -3.500  -3.972   1.268
  197   2HG2  THR  30          2HG2      THR  30  -4.082  -2.497   2.042
  198   3HG2  THR  30          3HG2      THR  30  -2.380  -2.948   2.164
  199    H    SER  31           H        SER  31  -3.966  -6.963   2.920
  200    HA   SER  31           HA       SER  31  -2.256  -7.469   0.592
  201   1HB   SER  31          1HB       SER  31  -3.072  -9.881   0.788
  202   2HB   SER  31          2HB       SER  31  -1.916  -9.354   2.019
  203    HG   SER  31           HG       SER  31  -3.639  -9.086   3.458
  204    H    ALA  32           H        ALA  32  -4.623  -5.829   1.331
  205    HA   ALA  32           HA       ALA  32  -7.002  -6.754   0.199
  206   1HB   ALA  32          1HB       ALA  32  -5.955  -4.266   1.235
  207   2HB   ALA  32          2HB       ALA  32  -6.917  -3.968  -0.212
  208   3HB   ALA  32          3HB       ALA  32  -7.627  -4.820   1.158
  209    H    GLY  33           H        GLY  33  -7.862  -6.715  -1.800
  210   1HA   GLY  33          1HA       GLY  33  -8.012  -6.354  -4.081
  211   2HA   GLY  33          2HA       GLY  33  -6.626  -5.279  -3.963
  212    H    ARG  34           H        ARG  34  -5.684  -8.022  -2.453
  213    HA   ARG  34           HA       ARG  34  -4.572  -9.157  -4.925
  214   1HB   ARG  34          1HB       ARG  34  -3.373  -9.325  -2.162
  215   2HB   ARG  34          2HB       ARG  34  -2.629  -9.765  -3.683
  216   1HG   ARG  34          1HG       ARG  34  -2.962  -7.252  -4.276
  217   2HG   ARG  34          2HG       ARG  34  -3.094  -7.066  -2.531
  218   1HD   ARG  34          1HD       ARG  34  -0.801  -6.722  -3.409
  219   2HD   ARG  34          2HD       ARG  34  -0.919  -7.999  -2.201
  220    HE   ARG  34           HE       ARG  34  -0.206  -9.494  -3.775
  221   1HH1  ARG  34          1HH1      ARG  34  -1.299  -6.612  -5.429
  222   2HH1  ARG  34          2HH1      ARG  34  -0.822  -7.190  -6.997
  223   1HH2  ARG  34          1HH2      ARG  34   0.371 -10.257  -5.833
  224   2HH2  ARG  34          2HH2      ARG  34   0.135  -9.252  -7.226
  225    H    SER  35           H        SER  35  -4.443 -11.436  -5.071
  226    HA   SER  35           HA       SER  35  -6.110 -12.866  -3.111
  227   1HB   SER  35          1HB       SER  35  -6.673 -14.413  -5.033
  228   2HB   SER  35          2HB       SER  35  -7.332 -12.781  -5.162
  229    HG   SER  35           HG       SER  35  -6.031 -12.353  -6.805
  230    H    ASP  36           H        ASP  36  -3.049 -12.440  -3.986
  231    HA   ASP  36           HA       ASP  36  -2.180 -15.208  -4.001
  232   1HB   ASP  36          1HB       ASP  36   0.134 -13.952  -4.044
  233   2HB   ASP  36          2HB       ASP  36  -0.866 -14.034  -5.486
  234    H    GLY  37           H        GLY  37  -0.640 -12.565  -2.351
  235   1HA   GLY  37          1HA       GLY  37  -1.277 -13.089   0.260
  236   2HA   GLY  37          2HA       GLY  37   0.047 -14.180  -0.108
  237    H    LYS  38           H        LYS  38   0.865 -11.882  -2.090
  238    HA   LYS  38           HA       LYS  38   2.908 -10.787  -0.486
  239   1HB   LYS  38          1HB       LYS  38   1.789  -9.677  -3.068
  240   2HB   LYS  38          2HB       LYS  38   3.394  -9.399  -2.412
  241   1HG   LYS  38          1HG       LYS  38   4.143 -11.479  -2.986
  242   2HG   LYS  38          2HG       LYS  38   2.526 -12.173  -3.034
  243   1HD   LYS  38          1HD       LYS  38   2.073 -10.799  -5.061
  244   2HD   LYS  38          2HD       LYS  38   3.762 -10.281  -5.039
  245   1HE   LYS  38          1HE       LYS  38   4.494 -12.570  -5.325
  246   2HE   LYS  38          2HE       LYS  38   2.827 -13.143  -5.236
  247   1HZ   LYS  38          1HZ       LYS  38   2.388 -11.721  -7.238
  248   2HZ   LYS  38          2HZ       LYS  38   4.068 -11.506  -7.375
  249   3HZ   LYS  38          3HZ       LYS  38   3.393 -13.060  -7.504
  250    H    MET  39           H        MET  39   2.294  -9.549   1.288
  251    HA   MET  39           HA       MET  39   0.092  -7.729   1.133
  252   1HB   MET  39          1HB       MET  39   2.245  -7.827   3.251
  253   2HB   MET  39          2HB       MET  39   0.630  -7.149   3.396
  254   1HG   MET  39          1HG       MET  39  -0.323  -9.400   3.121
  255   2HG   MET  39          2HG       MET  39   1.312 -10.058   3.066
  256   1HE   MET  39          1HE       MET  39   0.289 -11.614   4.617
  257   2HE   MET  39          2HE       MET  39   0.754 -11.494   6.314
  258   3HE   MET  39          3HE       MET  39  -0.876 -11.042   5.812
  259    H    TRP  40           H        TRP  40   0.105  -5.526   1.005
  260    HA   TRP  40           HA       TRP  40   2.679  -4.249   0.373
  261   1HB   TRP  40          1HB       TRP  40   1.527  -2.964  -1.411
  262   2HB   TRP  40          2HB       TRP  40   1.567  -4.693  -1.748
  263    HD1  TRP  40           HD1      TRP  40  -0.910  -6.007  -1.096
  264    HE1  TRP  40           1HE      TRP  40  -3.294  -5.102  -1.407
  265    HE3  TRP  40           3HE      TRP  40   0.146  -1.032  -1.526
  266    HZ2  TRP  40           2HZ      TRP  40  -4.549  -2.619  -1.746
  267    HZ3  TRP  40           3HZ      TRP  40  -1.708   0.544  -1.820
  268    HH2  TRP  40           HH2      TRP  40  -4.016  -0.240  -1.939
  269    H    CYS  41           H        CYS  41   1.796  -1.713  -0.111
  270    HA   CYS  41           HA       CYS  41   0.057  -0.772   1.995
  271   1HB   CYS  41          1HB       CYS  41   1.850   0.700   2.980
  272   2HB   CYS  41          2HB       CYS  41   2.100  -1.021   3.287
  273    H    ALA  42           H        ALA  42  -0.549   1.469   1.659
  274    HA   ALA  42           HA       ALA  42  -0.083   2.343  -1.069
  275   1HB   ALA  42          1HB       ALA  42  -2.309   2.547   0.216
  276   2HB   ALA  42          2HB       ALA  42  -1.567   3.952   0.979
  277   3HB   ALA  42          3HB       ALA  42  -1.783   3.912  -0.771
  278    H    THR  43           H        THR  43   0.801   4.358  -1.639
  279    HA   THR  43           HA       THR  43   2.706   5.377   0.362
  280    HB   THR  43           HB       THR  43   4.231   5.788  -1.473
  281    HG1  THR  43           1HG      THR  43   3.169   6.288  -3.256
  282   1HG2  THR  43          1HG2      THR  43   3.499   3.191  -2.490
  283   2HG2  THR  43          2HG2      THR  43   4.906   3.673  -1.540
  284   3HG2  THR  43          3HG2      THR  43   3.404   3.235  -0.729
  285    H    THR  44           H        THR  44  -0.135   6.168  -0.786
  286    HA   THR  44           HA       THR  44   0.503   9.022  -1.203
  287    HB   THR  44           HB       THR  44  -1.551   9.040  -2.587
  288    HG1  THR  44           1HG      THR  44  -2.828   7.375  -2.475
  289   1HG2  THR  44          1HG2      THR  44  -0.564   7.099  -4.169
  290   2HG2  THR  44          2HG2      THR  44   0.087   8.738  -4.082
  291   3HG2  THR  44          3HG2      THR  44   0.832   7.439  -3.146
  292    H    ALA  45           H        ALA  45  -0.534   7.241   1.187
  293    HA   ALA  45           HA       ALA  45  -1.723   7.573   3.081
  294   1HB   ALA  45          1HB       ALA  45  -1.993  10.256   1.823
  295   2HB   ALA  45          2HB       ALA  45  -2.875   9.852   3.298
  296   3HB   ALA  45          3HB       ALA  45  -1.111   9.777   3.275
  297    H    ASN  46           H        ASN  46  -3.320   8.377   0.043
  298    HA   ASN  46           HA       ASN  46  -5.694   6.924   0.998
  299   1HB   ASN  46          1HB       ASN  46  -6.191   9.396   0.897
  300   2HB   ASN  46          2HB       ASN  46  -5.828   9.345  -0.831
  301   1HD2  ASN  46          1HD2      ASN  46  -9.436   8.394   0.491
  302   2HD2  ASN  46          2HD2      ASN  46  -8.205   9.091   1.477
  303    H    TYR  47           H        TYR  47  -5.644   5.094  -0.126
  304    HA   TYR  47           HA       TYR  47  -4.353   5.037  -2.709
  305   1HB   TYR  47          1HB       TYR  47  -3.991   3.287  -0.956
  306   2HB   TYR  47          2HB       TYR  47  -5.647   2.750  -1.239
  307    HD1  TYR  47           1HD      TYR  47  -2.327   3.120  -2.794
  308    HD2  TYR  47           2HD      TYR  47  -6.205   1.424  -3.123
  309    HE1  TYR  47           1HE      TYR  47  -1.556   1.737  -4.659
  310    HE2  TYR  47           2HE      TYR  47  -5.441   0.036  -4.996
  311    HH   TYR  47           HH       TYR  47  -3.633  -0.717  -6.109
  312    H    ASP  48           H        ASP  48  -7.607   4.911  -1.466
  313    HA   ASP  48           HA       ASP  48  -8.889   3.737  -3.626
  314   1HB   ASP  48          1HB       ASP  48  -9.778   5.689  -1.539
  315   2HB   ASP  48          2HB       ASP  48 -10.861   5.256  -2.855
  316    H    ASP  49           H        ASP  49  -7.794   7.029  -3.181
  317    HA   ASP  49           HA       ASP  49  -9.025   7.892  -5.669
  318   1HB   ASP  49          1HB       ASP  49  -7.560   9.298  -3.454
  319   2HB   ASP  49          2HB       ASP  49  -7.854  10.096  -4.993
  320    H    ASP  50           H        ASP  50  -5.746   7.868  -4.274
  321    HA   ASP  50           HA       ASP  50  -4.504   8.640  -6.717
  322   1HB   ASP  50          1HB       ASP  50  -3.420   7.617  -4.112
  323   2HB   ASP  50          2HB       ASP  50  -2.380   8.016  -5.475
  324    H    ARG  51           H        ARG  51  -4.726   5.505  -5.057
  325    HA   ARG  51           HA       ARG  51  -4.328   3.415  -5.699
  326   1HB   ARG  51          1HB       ARG  51  -4.801   4.555  -8.431
  327   2HB   ARG  51          2HB       ARG  51  -4.779   2.838  -8.039
  328   1HG   ARG  51          1HG       ARG  51  -6.435   4.137  -6.186
  329   2HG   ARG  51          2HG       ARG  51  -6.918   4.672  -7.799
  330   1HD   ARG  51          1HD       ARG  51  -6.407   1.807  -7.569
  331   2HD   ARG  51          2HD       ARG  51  -7.715   2.391  -6.539
  332    HE   ARG  51           HE       ARG  51  -8.999   2.742  -8.412
  333   1HH1  ARG  51          1HH1      ARG  51  -5.700   2.137  -9.445
  334   2HH1  ARG  51          2HH1      ARG  51  -6.095   2.214 -11.132
  335   1HH2  ARG  51          1HH2      ARG  51  -9.499   2.862 -10.613
  336   2HH2  ARG  51          2HH2      ARG  51  -8.245   2.626 -11.794
  337    H    LYS  52           H        LYS  52  -2.042   4.870  -5.196
  338    HA   LYS  52           HA       LYS  52  -0.138   3.589  -7.007
  339   1HB   LYS  52          1HB       LYS  52   0.121   6.165  -5.447
  340   2HB   LYS  52          2HB       LYS  52   1.533   5.310  -6.068
  341   1HG   LYS  52          1HG       LYS  52   1.246   6.437  -7.969
  342   2HG   LYS  52          2HG       LYS  52  -0.178   5.426  -8.226
  343   1HD   LYS  52          1HD       LYS  52  -0.883   7.662  -8.511
  344   2HD   LYS  52          2HD       LYS  52  -1.499   7.128  -6.947
  345   1HE   LYS  52          1HE       LYS  52   0.276   8.301  -5.802
  346   2HE   LYS  52          2HE       LYS  52   1.023   8.742  -7.335
  347   1HZ   LYS  52          1HZ       LYS  52  -1.407   9.757  -7.681
  348   2HZ   LYS  52          2HZ       LYS  52  -1.296   9.891  -5.990
  349   3HZ   LYS  52          3HZ       LYS  52  -0.129  10.631  -6.976
  350    H    TRP  53           H        TRP  53   0.769   1.873  -6.137
  351    HA   TRP  53           HA       TRP  53   0.942   1.687  -3.204
  352   1HB   TRP  53          1HB       TRP  53   0.180  -0.590  -3.384
  353   2HB   TRP  53          2HB       TRP  53  -0.959   0.473  -4.123
  354    HD1  TRP  53           HD1      TRP  53  -0.503   0.636  -7.039
  355    HE1  TRP  53           1HE      TRP  53  -0.111  -1.403  -8.574
  356    HE3  TRP  53           3HE      TRP  53   0.932  -2.622  -3.508
  357    HZ2  TRP  53           2HZ      TRP  53   0.720  -4.117  -8.265
  358    HZ3  TRP  53           3HZ      TRP  53   1.533  -4.946  -4.147
  359    HH2  TRP  53           HH2      TRP  53   1.430  -5.672  -6.489
  360    H    GLY  54           H        GLY  54   2.108  -0.282  -2.541
  361   1HA   GLY  54          1HA       GLY  54   4.275  -1.295  -4.107
  362   2HA   GLY  54          2HA       GLY  54   4.806  -0.122  -2.901
  363    H    PHE  55           H        PHE  55   5.245  -3.063  -3.062
  364    HA   PHE  55           HA       PHE  55   3.673  -4.433  -1.211
  365   1HB   PHE  55          1HB       PHE  55   6.426  -4.839  -2.313
  366   2HB   PHE  55          2HB       PHE  55   5.851  -5.863  -1.011
  367    HD1  PHE  55           1HD      PHE  55   2.956  -5.200  -2.557
  368    HD2  PHE  55           2HD      PHE  55   6.613  -7.212  -3.350
  369    HE1  PHE  55           1HE      PHE  55   1.794  -6.665  -4.160
  370    HE2  PHE  55           2HE      PHE  55   5.462  -8.689  -4.955
  371    HZ   PHE  55           HZ       PHE  55   3.049  -8.391  -5.377
  372    H    CYS  56           H        CYS  56   4.230  -5.214   0.872
  373    HA   CYS  56           HA       CYS  56   4.903  -3.100   2.633
  374   1HB   CYS  56          1HB       CYS  56   3.271  -4.962   3.101
  375   2HB   CYS  56          2HB       CYS  56   4.650  -6.036   3.291
  376    HA   PRO  57           HA       PRO  57   9.269  -3.973   2.831
  377   1HB   PRO  57          1HB       PRO  57  10.035  -1.940   4.305
  378   2HB   PRO  57          2HB       PRO  57   9.389  -1.643   2.679
  379   1HG   PRO  57          1HG       PRO  57   7.968  -1.570   5.305
  380   2HG   PRO  57          2HG       PRO  57   7.990  -0.308   4.059
  381   1HD   PRO  57          1HD       PRO  57   5.963  -2.095   4.280
  382   2HD   PRO  57          2HD       PRO  57   6.505  -1.480   2.698
  383    H    ASP  58           H        ASP  58   7.036  -4.507   4.910
  384    HA   ASP  58           HA       ASP  58   8.811  -5.617   6.968
  385   1HB   ASP  58          1HB       ASP  58   7.661  -3.530   7.785
  386   2HB   ASP  58          2HB       ASP  58   6.123  -4.351   7.539
  387    H    GLN  59           H        GLN  59   8.424  -7.413   5.338
  388    HA   GLN  59           HA       GLN  59   5.827  -8.669   5.386
  389   1HB   GLN  59          1HB       GLN  59   8.481  -9.658   4.316
  390   2HB   GLN  59          2HB       GLN  59   6.930 -10.449   4.065
  391   1HG   GLN  59          1HG       GLN  59   7.512  -7.639   3.166
  392   2HG   GLN  59          2HG       GLN  59   7.784  -9.060   2.154
  393   1HE2  GLN  59          1HE2      GLN  59   4.524  -9.096   1.034
  394   2HE2  GLN  59          2HE2      GLN  59   6.196  -9.457   0.787
  395    H    GLY  60           H        GLY  60   5.593 -10.969   6.063
  396   1HA   GLY  60          1HA       GLY  60   6.669 -12.763   7.420
  397   2HA   GLY  60          2HA       GLY  60   7.207 -11.472   8.489
  Start of MODEL   22
    1    H    SER   1           1H       SER   1  15.953  -5.571   5.840
    2    HA   SER   1           HA       SER   1  13.428  -5.356   4.359
    3   1HB   SER   1          1HB       SER   1  14.101  -4.395   7.155
    4   2HB   SER   1          2HB       SER   1  12.573  -4.143   6.300
    5    HG   SER   1           HG       SER   1  12.581  -6.587   6.197
    6    H    TRP   2           H        TRP   2  13.377  -3.567   3.164
    7    HA   TRP   2           HA       TRP   2  15.358  -1.444   3.697
    8   1HB   TRP   2          1HB       TRP   2  15.853  -2.957   1.686
    9   2HB   TRP   2          2HB       TRP   2  14.421  -2.265   0.940
   10    HD1  TRP   2           HD1      TRP   2  14.565   0.603   0.796
   11    HE1  TRP   2           1HE      TRP   2  16.581   1.982  -0.023
   12    HE3  TRP   2           3HE      TRP   2  18.239  -2.872   1.465
   13    HZ2  TRP   2           2HZ      TRP   2  19.360   1.643  -0.335
   14    HZ3  TRP   2           3HZ      TRP   2  20.553  -2.273   0.879
   15    HH2  TRP   2           HH2      TRP   2  21.102  -0.060  -0.005
   16    H    MET   3           H        MET   3  14.618   0.660   3.428
   17    HA   MET   3           HA       MET   3  11.822   1.034   3.720
   18   1HB   MET   3          1HB       MET   3  12.383   3.461   3.700
   19   2HB   MET   3          2HB       MET   3  13.273   2.525   4.880
   20   1HG   MET   3          1HG       MET   3  14.859   3.964   4.022
   21   2HG   MET   3          2HG       MET   3  15.153   2.479   3.127
   22   1HE   MET   3          1HE       MET   3  16.521   4.555   2.341
   23   2HE   MET   3          2HE       MET   3  16.352   4.204   0.620
   24   3HE   MET   3          3HE       MET   3  15.925   5.799   1.240
   25    H    SER   4           H        SER   4  11.033   3.178   2.353
   26    HA   SER   4           HA       SER   4  10.148   3.920   0.402
   27   1HB   SER   4          1HB       SER   4  12.580   3.979  -0.307
   28   2HB   SER   4          2HB       SER   4  12.338   2.387  -1.023
   29    HG   SER   4           HG       SER   4  11.249   4.875  -1.793
   30    H    THR   5           H        THR   5   9.682   2.711  -2.031
   31    HA   THR   5           HA       THR   5   8.095   0.433  -1.126
   32    HB   THR   5           HB       THR   5   7.010   0.865  -3.490
   33    HG1  THR   5           1HG      THR   5   7.552   3.527  -2.960
   34   1HG2  THR   5          1HG2      THR   5   5.410   2.406  -2.532
   35   2HG2  THR   5          2HG2      THR   5   5.794   1.113  -1.392
   36   3HG2  THR   5          3HG2      THR   5   6.496   2.718  -1.179
   37    H    VAL   6           H        VAL   6   7.717  -1.304  -2.469
   38    HA   VAL   6           HA       VAL   6   9.678  -2.048  -4.479
   39    HB   VAL   6           HB       VAL   6  10.640  -3.262  -2.779
   40   1HG1  VAL   6          1HG1      VAL   6   7.971  -3.146  -1.440
   41   2HG1  VAL   6          2HG1      VAL   6   9.182  -4.308  -0.894
   42   3HG1  VAL   6          3HG1      VAL   6   9.535  -2.580  -0.856
   43   1HG2  VAL   6          1HG2      VAL   6   8.346  -4.951  -3.660
   44   2HG2  VAL   6          2HG2      VAL   6  10.034  -5.024  -4.169
   45   3HG2  VAL   6          3HG2      VAL   6   9.577  -5.559  -2.553
   46    H    GLY   7           H        GLY   7   8.602  -3.897  -5.792
   47   1HA   GLY   7          1HA       GLY   7   6.657  -4.749  -6.798
   48   2HA   GLY   7          2HA       GLY   7   5.893  -4.544  -5.247
   49    H    GLY   8           H        GLY   8   3.963  -3.798  -6.105
   50   1HA   GLY   8          1HA       GLY   8   2.465  -2.255  -6.919
   51   2HA   GLY   8          2HA       GLY   8   3.547  -1.093  -6.177
   52    H    ASN   9           H        ASN   9   3.194   0.487  -7.724
   53    HA   ASN   9           HA       ASN   9   4.589  -0.043 -10.237
   54   1HB   ASN   9          1HB       ASN   9   2.980   1.194 -11.571
   55   2HB   ASN   9          2HB       ASN   9   2.231  -0.190 -10.811
   56   1HD2  ASN   9          1HD2      ASN   9   1.027   2.811  -8.569
   57   2HD2  ASN   9          2HD2      ASN   9   2.541   1.991  -8.441
   58    H    SER  10           H        SER  10   4.210   1.906  -7.540
   59    HA   SER  10           HA       SER  10   5.028   4.393  -8.683
   60   1HB   SER  10          1HB       SER  10   5.236   3.516  -5.795
   61   2HB   SER  10          2HB       SER  10   5.167   5.162  -6.409
   62    HG   SER  10           HG       SER  10   3.128   4.520  -5.663
   63    H    GLY  11           H        GLY  11   6.682   1.977  -6.632
   64   1HA   GLY  11          1HA       GLY  11   8.898   1.443  -6.383
   65   2HA   GLY  11          2HA       GLY  11   9.043   1.848  -8.082
   66    H    GLY  12           H        GLY  12   8.886   3.415  -4.881
   67   1HA   GLY  12          1HA       GLY  12  11.168   4.636  -4.579
   68   2HA   GLY  12          2HA       GLY  12  10.582   5.572  -5.947
   69    H    ALA  13           H        ALA  13   7.806   5.475  -5.049
   70    HA   ALA  13           HA       ALA  13   7.922   7.734  -3.275
   71   1HB   ALA  13          1HB       ALA  13   6.283   7.536  -5.141
   72   2HB   ALA  13          2HB       ALA  13   5.488   6.243  -4.243
   73   3HB   ALA  13          3HB       ALA  13   5.545   7.875  -3.576
   74    HA   PRO  14           HA       PRO  14   7.362   5.383   0.433
   75   1HB   PRO  14          1HB       PRO  14   6.420   7.568   1.946
   76   2HB   PRO  14          2HB       PRO  14   8.091   7.036   1.778
   77   1HG   PRO  14          1HG       PRO  14   6.961   9.435   0.801
   78   2HG   PRO  14          2HG       PRO  14   8.580   8.803   0.467
   79   1HD   PRO  14          1HD       PRO  14   6.152   8.760  -1.221
   80   2HD   PRO  14          2HD       PRO  14   7.865   8.669  -1.684
   81    H    CYS  15           H        CYS  15   5.744   4.431   1.717
   82    HA   CYS  15           HA       CYS  15   3.073   4.656   0.662
   83   1HB   CYS  15          1HB       CYS  15   4.136   3.029   2.998
   84   2HB   CYS  15          2HB       CYS  15   2.499   2.931   2.363
   85    H    VAL  16           H        VAL  16   1.508   5.947   1.406
   86    HA   VAL  16           HA       VAL  16   2.014   7.538   3.801
   87    HB   VAL  16           HB       VAL  16  -0.145   7.863   1.710
   88   1HG1  VAL  16          1HG1      VAL  16   0.735   9.574   4.013
   89   2HG1  VAL  16          2HG1      VAL  16  -0.116  10.249   2.623
   90   3HG1  VAL  16          3HG1      VAL  16  -0.885   9.005   3.611
   91   1HG2  VAL  16          1HG2      VAL  16   2.573   8.242   1.358
   92   2HG2  VAL  16          2HG2      VAL  16   1.281   8.922   0.369
   93   3HG2  VAL  16          3HG2      VAL  16   1.959   9.860   1.700
   94    H    PHE  17           H        PHE  17   1.095   7.037   5.665
   95    HA   PHE  17           HA       PHE  17  -1.367   5.449   5.635
   96   1HB   PHE  17          1HB       PHE  17   0.887   5.501   7.640
   97   2HB   PHE  17          2HB       PHE  17  -0.640   4.690   7.910
   98    HD1  PHE  17           1HD      PHE  17  -1.313   3.101   5.780
   99    HD2  PHE  17           2HD      PHE  17   2.590   4.203   7.039
  100    HE1  PHE  17           1HE      PHE  17  -0.392   1.125   4.651
  101    HE2  PHE  17           2HE      PHE  17   3.528   2.232   5.924
  102    HZ   PHE  17           HZ       PHE  17   2.050   0.666   4.705
  103    HA   PRO  18           HA       PRO  18  -2.798   4.857   6.722
  104   1HB   PRO  18          1HB       PRO  18  -5.454   5.375   7.113
  105   2HB   PRO  18          2HB       PRO  18  -4.355   4.828   8.378
  106   1HG   PRO  18          1HG       PRO  18  -5.610   7.431   8.036
  107   2HG   PRO  18          2HG       PRO  18  -4.740   6.789   9.437
  108   1HD   PRO  18          1HD       PRO  18  -3.815   8.634   7.396
  109   2HD   PRO  18          2HD       PRO  18  -3.006   8.143   8.892
  110    H    PHE  19           H        PHE  19  -3.383   4.158   4.736
  111    HA   PHE  19           HA       PHE  19  -4.438   6.210   2.910
  112   1HB   PHE  19          1HB       PHE  19  -3.569   4.959   1.067
  113   2HB   PHE  19          2HB       PHE  19  -2.279   5.132   2.248
  114    HD1  PHE  19           1HD      PHE  19  -1.461   3.203   3.482
  115    HD2  PHE  19           2HD      PHE  19  -4.528   2.812   0.559
  116    HE1  PHE  19           1HE      PHE  19  -1.100   0.771   3.423
  117    HE2  PHE  19           2HE      PHE  19  -4.166   0.383   0.498
  118    HZ   PHE  19           HZ       PHE  19  -2.448  -0.642   1.933
  119    H    THR  20           H        THR  20  -6.429   6.009   2.128
  120    HA   THR  20           HA       THR  20  -7.978   3.748   3.098
  121    HB   THR  20           HB       THR  20  -9.001   6.165   1.598
  122    HG1  THR  20           1HG      THR  20  -9.199   7.172   3.595
  123   1HG2  THR  20          1HG2      THR  20 -10.602   5.289   3.795
  124   2HG2  THR  20          2HG2      THR  20 -11.027   5.464   2.092
  125   3HG2  THR  20          3HG2      THR  20 -10.319   3.956   2.674
  126    H    PHE  21           H        PHE  21  -8.657   2.131   1.963
  127    HA   PHE  21           HA       PHE  21  -8.781   2.335  -0.979
  128   1HB   PHE  21          1HB       PHE  21  -6.790   0.974   0.021
  129   2HB   PHE  21          2HB       PHE  21  -8.015  -0.186   0.465
  130    HD1  PHE  21           1HD      PHE  21  -8.878   1.438  -2.605
  131    HD2  PHE  21           2HD      PHE  21  -6.525  -1.670  -0.907
  132    HE1  PHE  21           1HE      PHE  21  -8.713   0.353  -4.790
  133    HE2  PHE  21           2HE      PHE  21  -6.363  -2.764  -3.085
  134    HZ   PHE  21           HZ       PHE  21  -7.436  -1.739  -5.061
  135    H    LEU  22           H        LEU  22 -10.552   1.182  -1.857
  136    HA   LEU  22           HA       LEU  22 -12.737   0.663  -1.920
  137   1HB   LEU  22          1HB       LEU  22 -11.422  -1.365  -0.221
  138   2HB   LEU  22          2HB       LEU  22 -12.985  -1.636  -0.976
  139    HG   LEU  22           HG       LEU  22 -11.808  -2.463  -2.684
  140   1HD1  LEU  22          1HD1      LEU  22 -11.451   0.351  -3.034
  141   2HD1  LEU  22          2HD1      LEU  22 -10.269  -0.649  -3.880
  142   3HD1  LEU  22          3HD1      LEU  22 -11.993  -0.881  -4.172
  143   1HD2  LEU  22          1HD2      LEU  22  -9.767  -1.965  -0.865
  144   2HD2  LEU  22          2HD2      LEU  22  -9.891  -3.223  -2.097
  145   3HD2  LEU  22          3HD2      LEU  22  -9.191  -1.657  -2.505
  146    H    GLY  23           H        GLY  23 -12.303   2.616   0.137
  147   1HA   GLY  23          1HA       GLY  23 -13.875   3.608   1.557
  148   2HA   GLY  23          2HA       GLY  23 -14.678   2.057   1.711
  149    H    ASN  24           H        ASN  24 -11.639   1.142   2.366
  150    HA   ASN  24           HA       ASN  24 -11.979   1.803   5.212
  151   1HB   ASN  24          1HB       ASN  24 -10.714  -0.594   3.877
  152   2HB   ASN  24          2HB       ASN  24 -10.729  -0.312   5.611
  153   1HD2  ASN  24          1HD2      ASN  24 -13.900  -1.875   3.730
  154   2HD2  ASN  24          2HD2      ASN  24 -12.412  -1.514   2.941
  155    H    LYS  25           H        LYS  25 -10.428   2.731   6.302
  156    HA   LYS  25           HA       LYS  25  -8.167   3.759   4.904
  157   1HB   LYS  25          1HB       LYS  25  -8.889   4.027   7.825
  158   2HB   LYS  25          2HB       LYS  25  -7.908   5.094   6.852
  159   1HG   LYS  25          1HG       LYS  25  -9.813   6.303   6.810
  160   2HG   LYS  25          2HG       LYS  25 -10.139   5.253   5.432
  161   1HD   LYS  25          1HD       LYS  25 -11.345   3.716   6.985
  162   2HD   LYS  25          2HD       LYS  25 -11.148   4.924   8.257
  163   1HE   LYS  25          1HE       LYS  25 -12.416   6.532   6.973
  164   2HE   LYS  25          2HE       LYS  25 -12.528   5.408   5.619
  165   1HZ   LYS  25          1HZ       LYS  25 -13.566   3.954   7.625
  166   2HZ   LYS  25          2HZ       LYS  25 -14.062   5.520   8.069
  167   3HZ   LYS  25          3HZ       LYS  25 -14.484   4.897   6.549
  168    H    TYR  26           H        TYR  26  -6.238   2.797   4.839
  169    HA   TYR  26           HA       TYR  26  -5.757   0.616   6.724
  170   1HB   TYR  26          1HB       TYR  26  -4.416   1.198   4.091
  171   2HB   TYR  26          2HB       TYR  26  -4.171  -0.223   5.097
  172    HD1  TYR  26           1HD      TYR  26  -7.194  -0.492   5.816
  173    HD2  TYR  26           2HD      TYR  26  -5.121  -0.012   2.144
  174    HE1  TYR  26           1HE      TYR  26  -8.991  -1.673   4.653
  175    HE2  TYR  26           2HE      TYR  26  -6.911  -1.192   0.975
  176    HH   TYR  26           HH       TYR  26  -9.723  -1.518   1.783
  177    H    GLU  27           H        GLU  27  -4.652   1.148   8.347
  178    HA   GLU  27           HA       GLU  27  -2.766   3.334   8.363
  179   1HB   GLU  27          1HB       GLU  27  -3.642   1.431  10.521
  180   2HB   GLU  27          2HB       GLU  27  -2.631   2.834  10.761
  181   1HG   GLU  27          1HG       GLU  27  -4.471   4.267   9.968
  182   2HG   GLU  27          2HG       GLU  27  -5.486   2.832   9.825
  183    H    SER  28           H        SER  28  -2.715   0.024   7.857
  184    HA   SER  28           HA       SER  28   0.198  -0.020   8.005
  185   1HB   SER  28          1HB       SER  28  -0.165  -2.515   8.579
  186   2HB   SER  28          2HB       SER  28  -0.408  -1.350   9.874
  187    HG   SER  28           HG       SER  28  -2.240  -2.435  10.022
  188    H    CYS  29           H        CYS  29   0.742  -2.326   6.710
  189    HA   CYS  29           HA       CYS  29  -0.101  -1.746   4.067
  190   1HB   CYS  29          1HB       CYS  29   1.229  -4.246   5.102
  191   2HB   CYS  29          2HB       CYS  29   1.096  -3.769   3.425
  192    H    THR  30           H        THR  30  -1.121  -3.324   2.648
  193    HA   THR  30           HA       THR  30  -3.116  -5.049   3.942
  194    HB   THR  30           HB       THR  30  -4.213  -2.822   3.467
  195    HG1  THR  30           1HG      THR  30  -5.615  -4.485   3.344
  196   1HG2  THR  30          1HG2      THR  30  -4.498  -3.045   0.659
  197   2HG2  THR  30          2HG2      THR  30  -3.811  -1.719   1.597
  198   3HG2  THR  30          3HG2      THR  30  -2.774  -3.029   1.030
  199    H    SER  31           H        SER  31  -4.386  -6.075   1.904
  200    HA   SER  31           HA       SER  31  -2.469  -6.709  -0.201
  201   1HB   SER  31          1HB       SER  31  -3.225  -9.143   0.003
  202   2HB   SER  31          2HB       SER  31  -2.164  -8.540   1.293
  203    HG   SER  31           HG       SER  31  -4.855  -9.282   1.373
  204    H    ALA  32           H        ALA  32  -4.883  -5.084   0.275
  205    HA   ALA  32           HA       ALA  32  -7.162  -6.163  -0.988
  206   1HB   ALA  32          1HB       ALA  32  -6.820  -4.058   0.554
  207   2HB   ALA  32          2HB       ALA  32  -6.562  -3.221  -0.976
  208   3HB   ALA  32          3HB       ALA  32  -8.090  -4.044  -0.672
  209    H    GLY  33           H        GLY  33  -8.083  -5.768  -2.951
  210   1HA   GLY  33          1HA       GLY  33  -8.202  -5.419  -5.204
  211   2HA   GLY  33          2HA       GLY  33  -6.894  -4.268  -5.021
  212    H    ARG  34           H        ARG  34  -5.910  -7.304  -3.864
  213    HA   ARG  34           HA       ARG  34  -4.505  -7.679  -6.413
  214   1HB   ARG  34          1HB       ARG  34  -3.787  -9.075  -3.858
  215   2HB   ARG  34          2HB       ARG  34  -2.836  -8.824  -5.286
  216   1HG   ARG  34          1HG       ARG  34  -2.831  -6.388  -4.774
  217   2HG   ARG  34          2HG       ARG  34  -3.582  -6.793  -3.222
  218   1HD   ARG  34          1HD       ARG  34  -1.038  -6.608  -3.264
  219   2HD   ARG  34          2HD       ARG  34  -1.693  -8.054  -2.531
  220    HE   ARG  34           HE       ARG  34  -0.243  -7.807  -5.003
  221   1HH1  ARG  34          1HH1      ARG  34  -2.042  -9.803  -2.870
  222   2HH1  ARG  34          2HH1      ARG  34  -1.619 -11.263  -3.698
  223   1HH2  ARG  34          1HH2      ARG  34   0.392  -9.575  -6.066
  224   2HH2  ARG  34          2HH2      ARG  34  -0.134 -11.145  -5.538
  225    H    SER  35           H        SER  35  -3.669 -10.359  -5.902
  226    HA   SER  35           HA       SER  35  -6.194 -11.824  -6.179
  227   1HB   SER  35          1HB       SER  35  -5.042 -13.129  -8.038
  228   2HB   SER  35          2HB       SER  35  -5.514 -11.466  -8.410
  229    HG   SER  35           HG       SER  35  -3.248 -12.288  -8.924
  230    H    ASP  36           H        ASP  36  -2.666 -12.158  -5.534
  231    HA   ASP  36           HA       ASP  36  -3.209 -14.843  -4.535
  232   1HB   ASP  36          1HB       ASP  36  -0.646 -14.890  -4.317
  233   2HB   ASP  36          2HB       ASP  36  -1.363 -15.000  -5.916
  234    H    GLY  37           H        GLY  37  -0.601 -12.923  -3.292
  235   1HA   GLY  37          1HA       GLY  37  -1.971 -12.364  -0.845
  236   2HA   GLY  37          2HA       GLY  37  -0.864 -13.704  -0.699
  237    H    LYS  38           H        LYS  38   0.094 -11.008  -2.783
  238    HA   LYS  38           HA       LYS  38   2.288 -10.466  -1.003
  239   1HB   LYS  38          1HB       LYS  38   1.377  -9.093  -3.546
  240   2HB   LYS  38          2HB       LYS  38   2.929  -8.862  -2.750
  241   1HG   LYS  38          1HG       LYS  38   3.627 -11.030  -3.245
  242   2HG   LYS  38          2HG       LYS  38   2.027 -11.541  -3.729
  243   1HD   LYS  38          1HD       LYS  38   2.152 -10.164  -5.706
  244   2HD   LYS  38          2HD       LYS  38   3.688  -9.477  -5.170
  245   1HE   LYS  38          1HE       LYS  38   3.896 -11.243  -6.925
  246   2HE   LYS  38          2HE       LYS  38   4.803 -11.570  -5.446
  247   1HZ   LYS  38          1HZ       LYS  38   2.096 -12.649  -5.546
  248   2HZ   LYS  38          2HZ       LYS  38   3.212 -13.355  -6.617
  249   3HZ   LYS  38          3HZ       LYS  38   3.527 -13.341  -4.947
  250    H    MET  39           H        MET  39   2.429  -8.681   0.397
  251    HA   MET  39           HA       MET  39  -0.047  -7.156   0.584
  252   1HB   MET  39          1HB       MET  39   2.213  -7.196   2.594
  253   2HB   MET  39          2HB       MET  39   0.587  -6.583   2.809
  254   1HG   MET  39          1HG       MET  39   0.541  -8.569   3.960
  255   2HG   MET  39          2HG       MET  39  -0.186  -8.982   2.408
  256   1HE   MET  39          1HE       MET  39   0.127 -11.339   3.373
  257   2HE   MET  39          2HE       MET  39   1.631 -12.262   3.298
  258   3HE   MET  39          3HE       MET  39   1.332 -11.164   4.648
  259    H    TRP  40           H        TRP  40  -0.046  -4.920   0.558
  260    HA   TRP  40           HA       TRP  40   2.465  -3.580  -0.175
  261   1HB   TRP  40          1HB       TRP  40   1.287  -2.409  -2.009
  262   2HB   TRP  40          2HB       TRP  40   1.349  -4.149  -2.281
  263    HD1  TRP  40           HD1      TRP  40  -1.047  -5.485  -1.540
  264    HE1  TRP  40           1HE      TRP  40  -3.468  -4.680  -1.851
  265    HE3  TRP  40           3HE      TRP  40  -0.171  -0.501  -2.154
  266    HZ2  TRP  40           2HZ      TRP  40  -4.817  -2.263  -2.262
  267    HZ3  TRP  40           3HZ      TRP  40  -2.091   1.000  -2.470
  268    HH2  TRP  40           HH2      TRP  40  -4.368   0.131  -2.531
  269    H    CYS  41           H        CYS  41   1.632  -1.131  -0.688
  270    HA   CYS  41           HA       CYS  41  -0.313  -0.128   1.171
  271   1HB   CYS  41          1HB       CYS  41   1.496   1.459   2.174
  272   2HB   CYS  41          2HB       CYS  41   1.327  -0.162   2.829
  273    H    ALA  42           H        ALA  42  -1.060   1.875   0.507
  274    HA   ALA  42           HA       ALA  42  -0.321   2.671  -2.134
  275   1HB   ALA  42          1HB       ALA  42  -2.197   3.850  -0.112
  276   2HB   ALA  42          2HB       ALA  42  -1.901   4.599  -1.682
  277   3HB   ALA  42          3HB       ALA  42  -2.589   2.975  -1.590
  278    H    THR  43           H        THR  43   0.499   4.671  -2.798
  279    HA   THR  43           HA       THR  43   2.380   5.795  -0.858
  280    HB   THR  43           HB       THR  43   3.584   6.618  -2.829
  281    HG1  THR  43           1HG      THR  43   2.296   6.952  -4.479
  282   1HG2  THR  43          1HG2      THR  43   3.648   4.199  -4.022
  283   2HG2  THR  43          2HG2      THR  43   4.503   4.591  -2.529
  284   3HG2  THR  43          3HG2      THR  43   2.940   3.777  -2.462
  285    H    THR  44           H        THR  44  -0.581   6.315  -1.342
  286    HA   THR  44           HA       THR  44  -0.396   9.236  -1.268
  287    HB   THR  44           HB       THR  44  -2.516   9.381  -2.557
  288    HG1  THR  44           1HG      THR  44  -3.607   7.642  -2.924
  289   1HG2  THR  44          1HG2      THR  44  -0.558   7.777  -4.156
  290   2HG2  THR  44          2HG2      THR  44  -1.676   9.020  -4.718
  291   3HG2  THR  44          3HG2      THR  44  -0.289   9.464  -3.721
  292    H    ALA  45           H        ALA  45  -2.136  10.215  -0.002
  293    HA   ALA  45           HA       ALA  45  -2.768   8.784   2.339
  294   1HB   ALA  45          1HB       ALA  45  -3.541  11.429   1.224
  295   2HB   ALA  45          2HB       ALA  45  -4.515  10.768   2.541
  296   3HB   ALA  45          3HB       ALA  45  -2.784  11.026   2.766
  297    H    ASN  46           H        ASN  46  -4.523   9.343  -0.629
  298    HA   ASN  46           HA       ASN  46  -6.562   7.441   0.297
  299   1HB   ASN  46          1HB       ASN  46  -7.432   9.812   0.140
  300   2HB   ASN  46          2HB       ASN  46  -7.098   9.747  -1.589
  301   1HD2  ASN  46          1HD2      ASN  46 -10.463   8.265  -0.106
  302   2HD2  ASN  46          2HD2      ASN  46  -9.335   9.197   0.804
  303    H    TYR  47           H        TYR  47  -6.149   5.633  -0.771
  304    HA   TYR  47           HA       TYR  47  -4.724   5.623  -3.246
  305   1HB   TYR  47          1HB       TYR  47  -4.466   3.855  -1.524
  306   2HB   TYR  47          2HB       TYR  47  -6.109   3.318  -1.870
  307    HD1  TYR  47           1HD      TYR  47  -2.885   3.989  -3.627
  308    HD2  TYR  47           2HD      TYR  47  -6.418   1.639  -3.426
  309    HE1  TYR  47           1HE      TYR  47  -2.048   2.586  -5.461
  310    HE2  TYR  47           2HE      TYR  47  -5.583   0.227  -5.245
  311    HH   TYR  47           HH       TYR  47  -3.399  -0.404  -6.245
  312    H    ASP  48           H        ASP  48  -8.107   5.230  -2.357
  313    HA   ASP  48           HA       ASP  48  -9.094   4.064  -4.649
  314   1HB   ASP  48          1HB       ASP  48 -10.323   6.095  -2.801
  315   2HB   ASP  48          2HB       ASP  48 -11.216   5.364  -4.128
  316    H    ASP  49           H        ASP  49  -8.262   7.424  -4.112
  317    HA   ASP  49           HA       ASP  49  -9.349   8.295  -6.630
  318   1HB   ASP  49          1HB       ASP  49  -7.887   9.634  -4.386
  319   2HB   ASP  49          2HB       ASP  49  -8.074  10.461  -5.927
  320    H    ASP  50           H        ASP  50  -6.030   8.520  -5.325
  321    HA   ASP  50           HA       ASP  50  -4.921   9.053  -7.886
  322   1HB   ASP  50          1HB       ASP  50  -3.696   8.437  -5.212
  323   2HB   ASP  50          2HB       ASP  50  -2.711   8.670  -6.655
  324    H    ARG  51           H        ARG  51  -5.147   6.104  -5.976
  325    HA   ARG  51           HA       ARG  51  -4.616   3.967  -6.385
  326   1HB   ARG  51          1HB       ARG  51  -5.211   4.828  -9.189
  327   2HB   ARG  51          2HB       ARG  51  -5.079   3.155  -8.656
  328   1HG   ARG  51          1HG       ARG  51  -6.764   4.592  -6.896
  329   2HG   ARG  51          2HG       ARG  51  -7.340   4.805  -8.552
  330   1HD   ARG  51          1HD       ARG  51  -6.738   2.182  -7.196
  331   2HD   ARG  51          2HD       ARG  51  -8.347   2.885  -7.384
  332    HE   ARG  51           HE       ARG  51  -7.055   2.653  -9.899
  333   1HH1  ARG  51          1HH1      ARG  51  -8.642   0.737  -7.443
  334   2HH1  ARG  51          2HH1      ARG  51  -9.164  -0.490  -8.554
  335   1HH2  ARG  51          1HH2      ARG  51  -7.750   1.059 -11.360
  336   2HH2  ARG  51          2HH2      ARG  51  -8.648  -0.309 -10.776
  337    H    LYS  52           H        LYS  52  -2.392   5.224  -5.877
  338    HA   LYS  52           HA       LYS  52  -0.475   3.998  -7.726
  339   1HB   LYS  52          1HB       LYS  52  -0.194   6.606  -6.222
  340   2HB   LYS  52          2HB       LYS  52   1.185   5.749  -6.903
  341   1HG   LYS  52          1HG       LYS  52   0.351   5.998  -9.119
  342   2HG   LYS  52          2HG       LYS  52  -1.196   6.598  -8.533
  343   1HD   LYS  52          1HD       LYS  52   0.035   8.469  -9.326
  344   2HD   LYS  52          2HD       LYS  52   0.046   8.553  -7.559
  345   1HE   LYS  52          1HE       LYS  52   2.279   7.617  -7.501
  346   2HE   LYS  52          2HE       LYS  52   2.267   7.400  -9.254
  347   1HZ   LYS  52          1HZ       LYS  52   1.797  10.106  -8.227
  348   2HZ   LYS  52          2HZ       LYS  52   3.370   9.491  -8.086
  349   3HZ   LYS  52          3HZ       LYS  52   2.640   9.594  -9.613
  350    H    TRP  53           H        TRP  53   0.388   2.297  -6.809
  351    HA   TRP  53           HA       TRP  53   0.625   2.237  -3.879
  352   1HB   TRP  53          1HB       TRP  53  -0.140  -0.037  -3.965
  353   2HB   TRP  53          2HB       TRP  53  -1.288   1.004  -4.729
  354    HD1  TRP  53           HD1      TRP  53  -0.821   1.082  -7.670
  355    HE1  TRP  53           1HE      TRP  53  -0.449  -1.003  -9.141
  356    HE3  TRP  53           3HE      TRP  53   0.535  -2.114  -4.026
  357    HZ2  TRP  53           2HZ      TRP  53   0.311  -3.728  -8.747
  358    HZ3  TRP  53           3HZ      TRP  53   1.073  -4.485  -4.610
  359    HH2  TRP  53           HH2      TRP  53   0.961  -5.258  -6.926
  360    H    GLY  54           H        GLY  54   1.838   0.354  -3.106
  361   1HA   GLY  54          1HA       GLY  54   3.979  -0.725  -4.701
  362   2HA   GLY  54          2HA       GLY  54   4.519   0.447  -3.500
  363    H    PHE  55           H        PHE  55   4.928  -2.491  -3.689
  364    HA   PHE  55           HA       PHE  55   3.402  -3.877  -1.813
  365   1HB   PHE  55          1HB       PHE  55   6.104  -4.249  -3.022
  366   2HB   PHE  55          2HB       PHE  55   5.619  -5.270  -1.680
  367    HD1  PHE  55           1HD      PHE  55   2.610  -4.781  -2.971
  368    HD2  PHE  55           2HD      PHE  55   6.304  -6.539  -4.141
  369    HE1  PHE  55           1HE      PHE  55   1.395  -6.306  -4.479
  370    HE2  PHE  55           2HE      PHE  55   5.091  -8.079  -5.644
  371    HZ   PHE  55           HZ       PHE  55   2.637  -7.926  -5.836
  372    H    CYS  56           H        CYS  56   4.166  -4.793   0.203
  373    HA   CYS  56           HA       CYS  56   5.066  -2.706   1.995
  374   1HB   CYS  56          1HB       CYS  56   3.158  -4.430   2.390
  375   2HB   CYS  56          2HB       CYS  56   4.454  -5.563   2.751
  376    HA   PRO  57           HA       PRO  57   9.297  -4.090   1.898
  377   1HB   PRO  57          1HB       PRO  57  10.290  -2.708   3.926
  378   2HB   PRO  57          2HB       PRO  57   9.728  -1.886   2.459
  379   1HG   PRO  57          1HG       PRO  57   8.204  -2.441   4.969
  380   2HG   PRO  57          2HG       PRO  57   8.469  -0.854   4.210
  381   1HD   PRO  57          1HD       PRO  57   6.215  -2.177   3.784
  382   2HD   PRO  57          2HD       PRO  57   7.034  -1.381   2.416
  383    H    ASP  58           H        ASP  58   7.161  -5.200   3.820
  384    HA   ASP  58           HA       ASP  58   8.848  -6.437   5.829
  385   1HB   ASP  58          1HB       ASP  58   6.505  -5.531   6.315
  386   2HB   ASP  58          2HB       ASP  58   5.900  -6.924   5.427
  387    H    GLN  59           H        GLN  59   8.411  -7.016   2.769
  388    HA   GLN  59           HA       GLN  59   8.180  -9.931   3.021
  389   1HB   GLN  59          1HB       GLN  59   7.895  -8.160   0.588
  390   2HB   GLN  59          2HB       GLN  59   7.847  -9.916   0.536
  391   1HG   GLN  59          1HG       GLN  59   5.903  -9.825   2.099
  392   2HG   GLN  59          2HG       GLN  59   5.913  -8.073   1.907
  393   1HE2  GLN  59          1HE2      GLN  59   5.415  -9.095  -1.802
  394   2HE2  GLN  59          2HE2      GLN  59   6.909  -8.854  -0.967
  395    H    GLY  60           H        GLY  60   9.458  -9.769   0.157
  396   1HA   GLY  60          1HA       GLY  60  12.236  -9.315   0.912
  397   2HA   GLY  60          2HA       GLY  60  11.796 -10.953   0.454
  Start of MODEL   23
    1    H    SER   1           1H       SER   1   8.314   5.932   5.219
    2    HA   SER   1           HA       SER   1   9.332   4.490   7.104
    3   1HB   SER   1          1HB       SER   1   8.710   2.517   5.587
    4   2HB   SER   1          2HB       SER   1   7.478   3.758   5.809
    5    HG   SER   1           HG       SER   1   9.225   3.473   3.574
    6    H    TRP   2           H        TRP   2  11.684   5.768   6.122
    7    HA   TRP   2           HA       TRP   2  13.898   5.384   5.848
    8   1HB   TRP   2          1HB       TRP   2  13.159   2.503   6.401
    9   2HB   TRP   2          2HB       TRP   2  14.804   3.122   6.323
   10    HD1  TRP   2           HD1      TRP   2  15.042   5.430   8.150
   11    HE1  TRP   2           1HE      TRP   2  14.414   5.376  10.652
   12    HE3  TRP   2           3HE      TRP   2  11.861   1.420   8.105
   13    HZ2  TRP   2           2HZ      TRP   2  12.787   3.838  12.365
   14    HZ3  TRP   2           3HZ      TRP   2  10.812   0.725  10.218
   15    HH2  TRP   2           HH2      TRP   2  11.268   1.914  12.306
   16    H    MET   3           H        MET   3  13.032   2.217   4.567
   17    HA   MET   3           HA       MET   3  14.391   2.819   2.110
   18   1HB   MET   3          1HB       MET   3  13.864   0.478   1.521
   19   2HB   MET   3          2HB       MET   3  14.700   0.629   3.052
   20   1HG   MET   3          1HG       MET   3  11.715   0.391   2.898
   21   2HG   MET   3          2HG       MET   3  12.769  -1.027   2.894
   22   1HE   MET   3          1HE       MET   3  15.135  -0.129   4.768
   23   2HE   MET   3          2HE       MET   3  14.596  -0.656   6.363
   24   3HE   MET   3          3HE       MET   3  14.368  -1.704   4.962
   25    H    SER   4           H        SER   4  13.248   1.854   0.050
   26    HA   SER   4           HA       SER   4  10.762   3.374  -0.222
   27   1HB   SER   4          1HB       SER   4  12.476   2.039  -2.346
   28   2HB   SER   4          2HB       SER   4  11.125   3.143  -2.638
   29    HG   SER   4           HG       SER   4  13.424   3.848  -1.121
   30    H    THR   5           H        THR   5   9.415   2.143  -2.197
   31    HA   THR   5           HA       THR   5   8.347  -0.167  -0.837
   32    HB   THR   5           HB       THR   5   6.711   0.031  -2.830
   33    HG1  THR   5           1HG      THR   5   6.822   2.216  -3.714
   34   1HG2  THR   5          1HG2      THR   5   5.624   2.069  -1.902
   35   2HG2  THR   5          2HG2      THR   5   5.988   0.822  -0.709
   36   3HG2  THR   5          3HG2      THR   5   7.014   2.250  -0.829
   37    H    VAL   6           H        VAL   6   7.403  -1.804  -2.467
   38    HA   VAL   6           HA       VAL   6   9.426  -2.747  -4.397
   39    HB   VAL   6           HB       VAL   6   7.845  -4.904  -3.307
   40   1HG1  VAL   6          1HG1      VAL   6  10.525  -4.369  -4.175
   41   2HG1  VAL   6          2HG1      VAL   6  10.528  -5.332  -2.695
   42   3HG1  VAL   6          3HG1      VAL   6   9.642  -5.893  -4.113
   43   1HG2  VAL   6          1HG2      VAL   6   9.443  -3.330  -1.306
   44   2HG2  VAL   6          2HG2      VAL   6   7.749  -3.812  -1.216
   45   3HG2  VAL   6          3HG2      VAL   6   9.016  -5.027  -1.084
   46    H    GLY   7           H        GLY   7   8.001  -4.782  -5.480
   47   1HA   GLY   7          1HA       GLY   7   6.408  -5.019  -7.174
   48   2HA   GLY   7          2HA       GLY   7   5.339  -4.776  -5.827
   49    H    GLY   8           H        GLY   8   3.841  -3.411  -6.172
   50   1HA   GLY   8          1HA       GLY   8   2.588  -1.821  -7.334
   51   2HA   GLY   8          2HA       GLY   8   3.665  -0.848  -6.372
   52    H    ASN   9           H        ASN   9   3.960   0.863  -7.533
   53    HA   ASN   9           HA       ASN   9   5.572   0.734  -9.891
   54   1HB   ASN   9          1HB       ASN   9   4.051   1.998 -11.353
   55   2HB   ASN   9          2HB       ASN   9   3.436   0.408 -10.977
   56   1HD2  ASN   9          1HD2      ASN   9   1.334   2.716  -8.580
   57   2HD2  ASN   9          2HD2      ASN   9   2.922   2.096  -8.275
   58    H    SER  10           H        SER  10   6.033   1.722  -7.385
   59    HA   SER  10           HA       SER  10   5.856   4.641  -7.676
   60   1HB   SER  10          1HB       SER  10   6.933   4.020  -5.157
   61   2HB   SER  10          2HB       SER  10   5.295   4.570  -5.500
   62    HG   SER  10           HG       SER  10   4.574   2.521  -5.402
   63    H    GLY  11           H        GLY  11   8.095   1.991  -7.014
   64   1HA   GLY  11          1HA       GLY  11  10.319   1.817  -7.666
   65   2HA   GLY  11          2HA       GLY  11  10.255   3.476  -8.241
   66    H    GLY  12           H        GLY  12  10.361   5.193  -6.609
   67   1HA   GLY  12          1HA       GLY  12  11.876   4.302  -4.234
   68   2HA   GLY  12          2HA       GLY  12  12.299   5.740  -5.150
   69    H    ALA  13           H        ALA  13   8.985   4.830  -4.355
   70    HA   ALA  13           HA       ALA  13   8.860   7.232  -2.651
   71   1HB   ALA  13          1HB       ALA  13   7.050   6.116  -4.670
   72   2HB   ALA  13          2HB       ALA  13   6.253   6.619  -3.180
   73   3HB   ALA  13          3HB       ALA  13   7.223   7.773  -4.094
   74    HA   PRO  14           HA       PRO  14   7.883   4.425   0.650
   75   1HB   PRO  14          1HB       PRO  14   7.187   6.236   2.535
   76   2HB   PRO  14          2HB       PRO  14   8.858   5.998   2.011
   77   1HG   PRO  14          1HG       PRO  14   6.997   8.214   1.432
   78   2HG   PRO  14          2HG       PRO  14   8.768   8.202   1.442
   79   1HD   PRO  14          1HD       PRO  14   7.043   8.081  -0.814
   80   2HD   PRO  14          2HD       PRO  14   8.810   7.925  -0.797
   81    H    CYS  15           H        CYS  15   6.088   3.872   2.184
   82    HA   CYS  15           HA       CYS  15   3.535   4.199   0.835
   83   1HB   CYS  15          1HB       CYS  15   4.323   2.509   3.227
   84   2HB   CYS  15          2HB       CYS  15   2.719   2.524   2.504
   85    H    VAL  16           H        VAL  16   1.874   5.414   1.546
   86    HA   VAL  16           HA       VAL  16   2.331   7.088   3.907
   87    HB   VAL  16           HB       VAL  16   0.238   7.313   1.728
   88   1HG1  VAL  16          1HG1      VAL  16   0.647   8.796   4.255
   89   2HG1  VAL  16          2HG1      VAL  16   0.287   9.755   2.819
   90   3HG1  VAL  16          3HG1      VAL  16  -0.830   8.494   3.341
   91   1HG2  VAL  16          1HG2      VAL  16   2.882   7.861   1.492
   92   2HG2  VAL  16          2HG2      VAL  16   1.607   8.683   0.595
   93   3HG2  VAL  16          3HG2      VAL  16   2.261   9.414   2.061
   94    H    PHE  17           H        PHE  17   1.309   6.731   5.763
   95    HA   PHE  17           HA       PHE  17  -1.110   5.080   5.746
   96   1HB   PHE  17          1HB       PHE  17   1.158   5.118   7.741
   97   2HB   PHE  17          2HB       PHE  17  -0.383   4.333   8.027
   98    HD1  PHE  17           1HD      PHE  17  -1.087   2.745   5.884
   99    HD2  PHE  17           2HD      PHE  17   2.836   3.759   7.172
  100    HE1  PHE  17           1HE      PHE  17  -0.202   0.727   4.798
  101    HE2  PHE  17           2HE      PHE  17   3.731   1.749   6.093
  102    HZ   PHE  17           HZ       PHE  17   2.222   0.210   4.880
  103    HA   PRO  18           HA       PRO  18  -2.602   4.536   6.866
  104   1HB   PRO  18          1HB       PRO  18  -5.258   5.390   7.269
  105   2HB   PRO  18          2HB       PRO  18  -4.262   4.476   8.401
  106   1HG   PRO  18          1HG       PRO  18  -5.182   7.101   8.745
  107   2HG   PRO  18          2HG       PRO  18  -3.931   6.295   9.705
  108   1HD   PRO  18          1HD       PRO  18  -3.646   8.234   7.453
  109   2HD   PRO  18          2HD       PRO  18  -2.618   7.994   8.880
  110    H    PHE  19           H        PHE  19  -3.109   3.883   4.825
  111    HA   PHE  19           HA       PHE  19  -4.178   5.949   3.025
  112   1HB   PHE  19          1HB       PHE  19  -3.410   4.652   1.153
  113   2HB   PHE  19          2HB       PHE  19  -2.078   4.863   2.277
  114    HD1  PHE  19           1HD      PHE  19  -1.525   2.889   3.829
  115    HD2  PHE  19           2HD      PHE  19  -4.024   2.559   0.394
  116    HE1  PHE  19           1HE      PHE  19  -1.140   0.460   3.779
  117    HE2  PHE  19           2HE      PHE  19  -3.645   0.132   0.349
  118    HZ   PHE  19           HZ       PHE  19  -2.202  -0.920   2.041
  119    H    THR  20           H        THR  20  -6.159   5.793   2.226
  120    HA   THR  20           HA       THR  20  -7.753   3.567   3.207
  121    HB   THR  20           HB       THR  20  -8.707   6.026   1.710
  122    HG1  THR  20           1HG      THR  20  -7.453   6.159   3.905
  123   1HG2  THR  20          1HG2      THR  20 -10.150   4.315   3.720
  124   2HG2  THR  20          2HG2      THR  20 -10.796   5.697   2.834
  125   3HG2  THR  20          3HG2      THR  20 -10.364   4.222   1.972
  126    H    PHE  21           H        PHE  21  -8.378   1.934   2.071
  127    HA   PHE  21           HA       PHE  21  -8.491   2.126  -0.868
  128   1HB   PHE  21          1HB       PHE  21  -6.457   0.864   0.097
  129   2HB   PHE  21          2HB       PHE  21  -7.614  -0.328   0.636
  130    HD1  PHE  21           1HD      PHE  21  -8.270   1.287  -2.583
  131    HD2  PHE  21           2HD      PHE  21  -6.439  -2.003  -0.608
  132    HE1  PHE  21           1HE      PHE  21  -8.065   0.104  -4.718
  133    HE2  PHE  21           2HE      PHE  21  -6.241  -3.192  -2.730
  134    HZ   PHE  21           HZ       PHE  21  -7.041  -2.133  -4.812
  135    H    LEU  22           H        LEU  22 -10.231   1.039  -1.751
  136    HA   LEU  22           HA       LEU  22 -12.390   0.478  -1.863
  137   1HB   LEU  22          1HB       LEU  22 -11.038  -1.571  -0.228
  138   2HB   LEU  22          2HB       LEU  22 -12.622  -1.845  -0.931
  139    HG   LEU  22           HG       LEU  22 -11.570  -2.533  -2.773
  140   1HD1  LEU  22          1HD1      LEU  22 -10.260   0.090  -2.913
  141   2HD1  LEU  22          2HD1      LEU  22 -10.230  -1.132  -4.187
  142   3HD1  LEU  22          3HD1      LEU  22 -11.759  -0.394  -3.706
  143   1HD2  LEU  22          1HD2      LEU  22  -9.666  -2.656  -0.891
  144   2HD2  LEU  22          2HD2      LEU  22  -9.644  -3.452  -2.467
  145   3HD2  LEU  22          3HD2      LEU  22  -8.875  -1.875  -2.256
  146    H    GLY  23           H        GLY  23 -12.034   2.397   0.241
  147   1HA   GLY  23          1HA       GLY  23 -13.633   3.321   1.674
  148   2HA   GLY  23          2HA       GLY  23 -14.424   1.760   1.756
  149    H    ASN  24           H        ASN  24 -11.318   0.950   2.437
  150    HA   ASN  24           HA       ASN  24 -11.797   1.375   5.313
  151   1HB   ASN  24          1HB       ASN  24 -10.275  -0.805   3.875
  152   2HB   ASN  24          2HB       ASN  24 -10.417  -0.660   5.616
  153   1HD2  ASN  24          1HD2      ASN  24 -13.270  -2.424   3.471
  154   2HD2  ASN  24          2HD2      ASN  24 -11.744  -1.941   2.838
  155    H    LYS  25           H        LYS  25 -10.245   2.302   6.571
  156    HA   LYS  25           HA       LYS  25  -8.029   3.587   5.295
  157   1HB   LYS  25          1HB       LYS  25  -8.909   3.434   8.186
  158   2HB   LYS  25          2HB       LYS  25  -7.710   4.522   7.535
  159   1HG   LYS  25          1HG       LYS  25  -9.319   5.711   6.258
  160   2HG   LYS  25          2HG       LYS  25 -10.555   4.493   6.593
  161   1HD   LYS  25          1HD       LYS  25 -10.487   5.084   8.965
  162   2HD   LYS  25          2HD       LYS  25  -9.268   6.316   8.627
  163   1HE   LYS  25          1HE       LYS  25 -10.850   7.489   7.172
  164   2HE   LYS  25          2HE       LYS  25 -12.058   6.241   7.478
  165   1HZ   LYS  25          1HZ       LYS  25 -11.707   6.906   9.938
  166   2HZ   LYS  25          2HZ       LYS  25 -11.060   8.343   9.300
  167   3HZ   LYS  25          3HZ       LYS  25 -12.658   7.898   8.938
  168    H    TYR  26           H        TYR  26  -6.045   2.654   5.079
  169    HA   TYR  26           HA       TYR  26  -5.515   0.291   6.729
  170   1HB   TYR  26          1HB       TYR  26  -4.277   1.180   4.123
  171   2HB   TYR  26          2HB       TYR  26  -3.858  -0.285   5.000
  172    HD1  TYR  26           1HD      TYR  26  -7.131  -0.303   5.671
  173    HD2  TYR  26           2HD      TYR  26  -4.612  -0.524   2.265
  174    HE1  TYR  26           1HE      TYR  26  -8.883  -1.509   4.458
  175    HE2  TYR  26           2HE      TYR  26  -6.353  -1.731   1.046
  176    HH   TYR  26           HH       TYR  26  -9.308  -1.734   1.589
  177    H    GLU  27           H        GLU  27  -4.397   0.660   8.397
  178    HA   GLU  27           HA       GLU  27  -2.483   2.832   8.577
  179   1HB   GLU  27          1HB       GLU  27  -3.476   0.841  10.613
  180   2HB   GLU  27          2HB       GLU  27  -2.450   2.214  10.953
  181   1HG   GLU  27          1HG       GLU  27  -4.192   3.749  10.311
  182   2HG   GLU  27          2HG       GLU  27  -5.209   2.411   9.786
  183    H    SER  28           H        SER  28  -2.560  -0.507   8.013
  184    HA   SER  28           HA       SER  28   0.359  -0.622   8.175
  185   1HB   SER  28          1HB       SER  28  -0.031  -3.118   8.638
  186   2HB   SER  28          2HB       SER  28  -0.328  -2.010   9.970
  187    HG   SER  28           HG       SER  28  -2.615  -2.104   8.927
  188    H    CYS  29           H        CYS  29   0.942  -2.810   6.791
  189    HA   CYS  29           HA       CYS  29   0.120  -2.162   4.161
  190   1HB   CYS  29          1HB       CYS  29   1.446  -4.712   5.062
  191   2HB   CYS  29          2HB       CYS  29   1.417  -4.060   3.439
  192    H    THR  30           H        THR  30  -0.965  -3.542   2.707
  193    HA   THR  30           HA       THR  30  -2.953  -5.334   3.935
  194    HB   THR  30           HB       THR  30  -3.952  -3.072   3.417
  195    HG1  THR  30           1HG      THR  30  -5.419  -4.695   3.316
  196   1HG2  THR  30          1HG2      THR  30  -3.682  -3.747   0.518
  197   2HG2  THR  30          2HG2      THR  30  -4.082  -2.210   1.285
  198   3HG2  THR  30          3HG2      THR  30  -2.429  -2.819   1.342
  199    H    SER  31           H        SER  31  -4.117  -6.536   2.115
  200    HA   SER  31           HA       SER  31  -2.278  -7.159  -0.077
  201   1HB   SER  31          1HB       SER  31  -3.026  -9.572   0.150
  202   2HB   SER  31          2HB       SER  31  -1.996  -8.977   1.468
  203    HG   SER  31           HG       SER  31  -4.692  -9.710   1.477
  204    H    ALA  32           H        ALA  32  -4.695  -5.523   0.530
  205    HA   ALA  32           HA       ALA  32  -6.994  -6.527  -0.742
  206   1HB   ALA  32          1HB       ALA  32  -6.067  -3.957   0.314
  207   2HB   ALA  32          2HB       ALA  32  -7.095  -3.781  -1.106
  208   3HB   ALA  32          3HB       ALA  32  -7.691  -4.648   0.309
  209    H    GLY  33           H        GLY  33  -7.871  -6.066  -2.776
  210   1HA   GLY  33          1HA       GLY  33  -7.864  -5.570  -5.030
  211   2HA   GLY  33          2HA       GLY  33  -6.366  -4.688  -4.781
  212    H    ARG  34           H        ARG  34  -5.793  -7.667  -3.506
  213    HA   ARG  34           HA       ARG  34  -4.771  -8.625  -6.092
  214   1HB   ARG  34          1HB       ARG  34  -3.543  -9.576  -3.573
  215   2HB   ARG  34          2HB       ARG  34  -2.852  -9.292  -5.133
  216   1HG   ARG  34          1HG       ARG  34  -2.916  -6.876  -4.694
  217   2HG   ARG  34          2HG       ARG  34  -3.508  -7.239  -3.063
  218   1HD   ARG  34          1HD       ARG  34  -1.031  -6.938  -3.179
  219   2HD   ARG  34          2HD       ARG  34  -1.500  -8.503  -2.562
  220    HE   ARG  34           HE       ARG  34  -0.228  -7.892  -5.051
  221   1HH1  ARG  34          1HH1      ARG  34  -1.720 -10.251  -3.066
  222   2HH1  ARG  34          2HH1      ARG  34  -1.160 -11.575  -4.035
  223   1HH2  ARG  34          1HH2      ARG  34   0.531  -9.497  -6.307
  224   2HH2  ARG  34          2HH2      ARG  34   0.158 -11.145  -5.897
  225    H    SER  35           H        SER  35  -4.040 -11.135  -5.560
  226    HA   SER  35           HA       SER  35  -6.437 -12.425  -4.455
  227   1HB   SER  35          1HB       SER  35  -6.534 -12.322  -6.937
  228   2HB   SER  35          2HB       SER  35  -5.044 -13.262  -7.004
  229    HG   SER  35           HG       SER  35  -7.465 -14.122  -5.779
  230    H    ASP  36           H        ASP  36  -2.919 -12.631  -4.960
  231    HA   ASP  36           HA       ASP  36  -2.891 -15.240  -3.697
  232   1HB   ASP  36          1HB       ASP  36  -0.349 -14.973  -4.014
  233   2HB   ASP  36          2HB       ASP  36  -1.348 -15.246  -5.426
  234    H    GLY  37           H        GLY  37  -0.403 -12.891  -3.079
  235   1HA   GLY  37          1HA       GLY  37  -1.372 -12.179  -0.525
  236   2HA   GLY  37          2HA       GLY  37  -0.249 -13.504  -0.386
  237    H    LYS  38           H        LYS  38   0.321 -10.934  -2.786
  238    HA   LYS  38           HA       LYS  38   2.769 -10.296  -1.385
  239   1HB   LYS  38          1HB       LYS  38   1.551  -9.206  -3.925
  240   2HB   LYS  38          2HB       LYS  38   3.184  -8.874  -3.354
  241   1HG   LYS  38          1HG       LYS  38   3.789 -11.159  -3.568
  242   2HG   LYS  38          2HG       LYS  38   2.151 -11.614  -3.986
  243   1HD   LYS  38          1HD       LYS  38   2.304 -10.370  -6.058
  244   2HD   LYS  38          2HD       LYS  38   3.916  -9.793  -5.619
  245   1HE   LYS  38          1HE       LYS  38   3.749 -11.778  -7.237
  246   2HE   LYS  38          2HE       LYS  38   4.875 -11.911  -5.881
  247   1HZ   LYS  38          1HZ       LYS  38   2.103 -12.989  -5.826
  248   2HZ   LYS  38          2HZ       LYS  38   3.463 -13.904  -6.274
  249   3HZ   LYS  38          3HZ       LYS  38   3.344 -13.271  -4.703
  250    H    MET  39           H        MET  39   1.905  -9.341   0.517
  251    HA   MET  39           HA       MET  39   0.011  -7.306   0.526
  252   1HB   MET  39          1HB       MET  39   2.257  -7.607   2.527
  253   2HB   MET  39          2HB       MET  39   0.704  -6.824   2.765
  254   1HG   MET  39          1HG       MET  39  -0.415  -8.997   2.486
  255   2HG   MET  39          2HG       MET  39   1.171  -9.763   2.359
  256   1HE   MET  39          1HE       MET  39   2.982  -9.270   3.952
  257   2HE   MET  39          2HE       MET  39   2.758  -8.009   5.165
  258   3HE   MET  39          3HE       MET  39   2.730  -9.707   5.642
  259    H    TRP  40           H        TRP  40   0.076  -5.179   0.331
  260    HA   TRP  40           HA       TRP  40   2.649  -3.859  -0.220
  261   1HB   TRP  40          1HB       TRP  40   1.496  -2.611  -2.036
  262   2HB   TRP  40          2HB       TRP  40   1.594  -4.339  -2.366
  263    HD1  TRP  40           HD1      TRP  40  -0.806  -5.739  -1.725
  264    HE1  TRP  40           1HE      TRP  40  -3.231  -4.964  -2.083
  265    HE3  TRP  40           3HE      TRP  40   0.011  -0.729  -2.183
  266    HZ2  TRP  40           2HZ      TRP  40  -4.602  -2.556  -2.465
  267    HZ3  TRP  40           3HZ      TRP  40  -1.925   0.747  -2.520
  268    HH2  TRP  40           HH2      TRP  40  -4.183  -0.148  -2.668
  269    H    CYS  41           H        CYS  41   1.796  -1.377  -0.710
  270    HA   CYS  41           HA       CYS  41  -0.184  -0.420   1.107
  271   1HB   CYS  41          1HB       CYS  41   1.609   1.118   2.244
  272   2HB   CYS  41          2HB       CYS  41   1.304  -0.498   2.869
  273    H    ALA  42           H        ALA  42  -0.901   1.594   0.463
  274    HA   ALA  42           HA       ALA  42  -0.055   2.453  -2.107
  275   1HB   ALA  42          1HB       ALA  42  -2.224   3.021  -0.343
  276   2HB   ALA  42          2HB       ALA  42  -1.530   4.537  -0.922
  277   3HB   ALA  42          3HB       ALA  42  -2.092   3.325  -2.075
  278    H    THR  43           H        THR  43   0.774   4.501  -2.696
  279    HA   THR  43           HA       THR  43   2.664   5.537  -0.707
  280    HB   THR  43           HB       THR  43   3.949   6.337  -2.636
  281    HG1  THR  43           1HG      THR  43   2.681   6.757  -4.307
  282   1HG2  THR  43          1HG2      THR  43   3.606   3.784  -3.804
  283   2HG2  THR  43          2HG2      THR  43   4.874   4.327  -2.703
  284   3HG2  THR  43          3HG2      THR  43   3.393   3.617  -2.060
  285    H    THR  44           H        THR  44  -0.275   6.102  -1.343
  286    HA   THR  44           HA       THR  44  -0.078   9.020  -1.170
  287    HB   THR  44           HB       THR  44  -2.171   9.181  -2.523
  288    HG1  THR  44           1HG      THR  44  -3.206   7.432  -2.994
  289   1HG2  THR  44          1HG2      THR  44  -1.132   8.281  -4.734
  290   2HG2  THR  44          2HG2      THR  44  -0.409   9.660  -3.906
  291   3HG2  THR  44          3HG2      THR  44   0.304   8.056  -3.735
  292    H    ALA  45           H        ALA  45  -1.813   9.975   0.076
  293    HA   ALA  45           HA       ALA  45  -2.527   8.511   2.359
  294   1HB   ALA  45          1HB       ALA  45  -2.398  11.031   2.112
  295   2HB   ALA  45          2HB       ALA  45  -4.014  10.944   1.409
  296   3HB   ALA  45          3HB       ALA  45  -3.742  10.402   3.064
  297    H    ASN  46           H        ASN  46  -4.276   9.133  -0.624
  298    HA   ASN  46           HA       ASN  46  -6.298   7.185   0.246
  299   1HB   ASN  46          1HB       ASN  46  -7.212   9.534   0.085
  300   2HB   ASN  46          2HB       ASN  46  -6.824   9.505  -1.633
  301   1HD2  ASN  46          1HD2      ASN  46 -10.242   7.993  -0.321
  302   2HD2  ASN  46          2HD2      ASN  46  -9.185   8.980   0.616
  303    H    TYR  47           H        TYR  47  -5.869   5.383  -0.825
  304    HA   TYR  47           HA       TYR  47  -4.405   5.391  -3.278
  305   1HB   TYR  47          1HB       TYR  47  -4.133   3.599  -1.599
  306   2HB   TYR  47          2HB       TYR  47  -5.785   3.067  -1.922
  307    HD1  TYR  47           1HD      TYR  47  -2.601   3.765  -3.736
  308    HD2  TYR  47           2HD      TYR  47  -6.113   1.399  -3.468
  309    HE1  TYR  47           1HE      TYR  47  -1.800   2.378  -5.594
  310    HE2  TYR  47           2HE      TYR  47  -5.318   0.000  -5.314
  311    HH   TYR  47           HH       TYR  47  -3.448  -0.568  -6.513
  312    H    ASP  48           H        ASP  48  -7.784   5.006  -2.432
  313    HA   ASP  48           HA       ASP  48  -8.748   3.872  -4.766
  314   1HB   ASP  48          1HB       ASP  48  -9.972   5.673  -2.712
  315   2HB   ASP  48          2HB       ASP  48 -10.884   5.219  -4.147
  316    H    ASP  49           H        ASP  49  -7.864   7.183  -4.103
  317    HA   ASP  49           HA       ASP  49  -9.014   8.116  -6.588
  318   1HB   ASP  49          1HB       ASP  49  -7.622   9.467  -4.297
  319   2HB   ASP  49          2HB       ASP  49  -7.907  10.320  -5.815
  320    H    ASP  50           H        ASP  50  -5.736   8.360  -5.190
  321    HA   ASP  50           HA       ASP  50  -4.586   9.034  -7.706
  322   1HB   ASP  50          1HB       ASP  50  -3.296   8.268  -5.088
  323   2HB   ASP  50          2HB       ASP  50  -2.407   8.810  -6.505
  324    H    ARG  51           H        ARG  51  -5.026   5.984  -6.074
  325    HA   ARG  51           HA       ARG  51  -4.372   3.889  -6.501
  326   1HB   ARG  51          1HB       ARG  51  -4.926   4.971  -9.220
  327   2HB   ARG  51          2HB       ARG  51  -4.572   3.272  -8.941
  328   1HG   ARG  51          1HG       ARG  51  -6.502   4.310  -7.090
  329   2HG   ARG  51          2HG       ARG  51  -7.040   4.460  -8.763
  330   1HD   ARG  51          1HD       ARG  51  -6.067   1.958  -7.396
  331   2HD   ARG  51          2HD       ARG  51  -7.747   2.353  -7.735
  332    HE   ARG  51           HE       ARG  51  -7.347   1.988 -10.041
  333   1HH1  ARG  51          1HH1      ARG  51  -4.566   1.253  -8.037
  334   2HH1  ARG  51          2HH1      ARG  51  -3.790   0.301  -9.261
  335   1HH2  ARG  51          1HH2      ARG  51  -6.322   0.741 -11.629
  336   2HH2  ARG  51          2HH2      ARG  51  -4.773   0.027 -11.305
  337    H    LYS  52           H        LYS  52  -2.158   5.144  -5.823
  338    HA   LYS  52           HA       LYS  52  -0.180   3.952  -7.626
  339   1HB   LYS  52          1HB       LYS  52   0.022   6.525  -6.069
  340   2HB   LYS  52          2HB       LYS  52   1.454   5.661  -6.608
  341   1HG   LYS  52          1HG       LYS  52   0.786   5.867  -8.909
  342   2HG   LYS  52          2HG       LYS  52  -0.739   6.611  -8.442
  343   1HD   LYS  52          1HD       LYS  52   0.530   8.504  -7.471
  344   2HD   LYS  52          2HD       LYS  52   2.025   7.748  -8.025
  345   1HE   LYS  52          1HE       LYS  52   1.050   7.809 -10.353
  346   2HE   LYS  52          2HE       LYS  52  -0.247   8.814  -9.700
  347   1HZ   LYS  52          1HZ       LYS  52   2.210   9.912  -8.889
  348   2HZ   LYS  52          2HZ       LYS  52   2.301   9.605 -10.562
  349   3HZ   LYS  52          3HZ       LYS  52   1.050  10.574  -9.943
  350    H    TRP  53           H        TRP  53   0.670   2.234  -6.751
  351    HA   TRP  53           HA       TRP  53   0.814   2.061  -3.816
  352   1HB   TRP  53          1HB       TRP  53   0.075  -0.216  -3.997
  353   2HB   TRP  53          2HB       TRP  53  -1.065   0.830  -4.766
  354    HD1  TRP  53           HD1      TRP  53  -0.520   0.980  -7.678
  355    HE1  TRP  53           1HE      TRP  53  -0.100  -1.075  -9.185
  356    HE3  TRP  53           3HE      TRP  53   0.810  -2.259  -4.078
  357    HZ2  TRP  53           2HZ      TRP  53   0.702  -3.787  -8.831
  358    HZ3  TRP  53           3HZ      TRP  53   1.406  -4.599  -4.692
  359    HH2  TRP  53           HH2      TRP  53   1.350  -5.337  -7.028
  360    H    GLY  54           H        GLY  54   1.995   0.030  -3.187
  361   1HA   GLY  54          1HA       GLY  54   4.206  -0.885  -4.749
  362   2HA   GLY  54          2HA       GLY  54   4.698   0.274  -3.514
  363    H    PHE  55           H        PHE  55   5.193  -2.687  -3.735
  364    HA   PHE  55           HA       PHE  55   3.617  -4.064  -1.876
  365   1HB   PHE  55          1HB       PHE  55   6.364  -4.498  -2.979
  366   2HB   PHE  55          2HB       PHE  55   5.763  -5.518  -1.691
  367    HD1  PHE  55           1HD      PHE  55   2.829  -5.053  -3.017
  368    HD2  PHE  55           2HD      PHE  55   6.581  -6.626  -4.272
  369    HE1  PHE  55           1HE      PHE  55   1.670  -6.529  -4.616
  370    HE2  PHE  55           2HE      PHE  55   5.424  -8.092  -5.882
  371    HZ   PHE  55           HZ       PHE  55   2.976  -8.022  -6.070
  372    H    CYS  56           H        CYS  56   4.187  -4.871   0.191
  373    HA   CYS  56           HA       CYS  56   5.045  -2.806   1.980
  374   1HB   CYS  56          1HB       CYS  56   3.244  -4.532   2.438
  375   2HB   CYS  56          2HB       CYS  56   4.527  -5.727   2.582
  376    HA   PRO  57           HA       PRO  57   9.317  -3.999   1.976
  377   1HB   PRO  57          1HB       PRO  57  10.250  -2.490   3.934
  378   2HB   PRO  57          2HB       PRO  57   9.649  -1.762   2.433
  379   1HG   PRO  57          1HG       PRO  57   8.200  -2.228   4.999
  380   2HG   PRO  57          2HG       PRO  57   8.348  -0.697   4.113
  381   1HD   PRO  57          1HD       PRO  57   6.170  -2.250   3.887
  382   2HD   PRO  57          2HD       PRO  57   6.830  -1.394   2.474
  383    H    ASP  58           H        ASP  58   7.193  -5.033   4.007
  384    HA   ASP  58           HA       ASP  58   8.991  -6.912   5.282
  385   1HB   ASP  58          1HB       ASP  58   8.678  -4.858   6.808
  386   2HB   ASP  58          2HB       ASP  58   7.029  -5.435   7.031
  387    H    GLN  59           H        GLN  59   8.022  -8.606   4.232
  388    HA   GLN  59           HA       GLN  59   5.141  -8.963   4.740
  389   1HB   GLN  59          1HB       GLN  59   6.828 -10.022   2.471
  390   2HB   GLN  59          2HB       GLN  59   5.158 -10.481   2.757
  391   1HG   GLN  59          1HG       GLN  59   4.589  -8.035   2.558
  392   2HG   GLN  59          2HG       GLN  59   6.240  -7.793   1.982
  393   1HE2  GLN  59          1HE2      GLN  59   5.356  -8.545  -1.254
  394   2HE2  GLN  59          2HE2      GLN  59   6.321  -7.650  -0.134
  395    H    GLY  60           H        GLY  60   6.416  -9.667   6.851
  396   1HA   GLY  60          1HA       GLY  60   6.592 -12.607   6.698
  397   2HA   GLY  60          2HA       GLY  60   7.801 -11.683   7.582
  Start of MODEL   24
    1    H    SER   1           1H       SER   1  13.682   3.470  11.241
    2    HA   SER   1           HA       SER   1  12.037   2.097  10.015
    3   1HB   SER   1          1HB       SER   1  12.096   3.799   8.090
    4   2HB   SER   1          2HB       SER   1  12.034   4.449   9.730
    5    HG   SER   1           HG       SER   1  13.614   5.547   8.583
    6    H    TRP   2           H        TRP   2  11.732   1.783   7.473
    7    HA   TRP   2           HA       TRP   2  13.956   0.072   6.582
    8   1HB   TRP   2          1HB       TRP   2  11.005  -0.290   6.024
    9   2HB   TRP   2          2HB       TRP   2  12.297  -1.371   5.509
   10    HD1  TRP   2           HD1      TRP   2  13.746  -2.456   7.742
   11    HE1  TRP   2           1HE      TRP   2  12.733  -3.420   9.905
   12    HE3  TRP   2           3HE      TRP   2   9.149  -0.215   7.546
   13    HZ2  TRP   2           2HZ      TRP   2  10.311  -3.227  11.349
   14    HZ3  TRP   2           3HZ      TRP   2   7.545  -0.649   9.362
   15    HH2  TRP   2           HH2      TRP   2   8.120  -2.128  11.225
   16    H    MET   3           H        MET   3  13.423  -0.432   4.043
   17    HA   MET   3           HA       MET   3  13.863   2.100   2.759
   18   1HB   MET   3          1HB       MET   3  14.197   0.788   0.734
   19   2HB   MET   3          2HB       MET   3  15.119   0.120   2.067
   20   1HG   MET   3          1HG       MET   3  13.574  -1.696   2.303
   21   2HG   MET   3          2HG       MET   3  12.452  -0.952   1.163
   22   1HE   MET   3          1HE       MET   3  16.072  -1.576   1.596
   23   2HE   MET   3          2HE       MET   3  16.381  -2.992   0.587
   24   3HE   MET   3          3HE       MET   3  16.600  -1.369  -0.071
   25    H    SER   4           H        SER   4  12.725   1.810   0.301
   26    HA   SER   4           HA       SER   4  10.028   2.645   0.823
   27   1HB   SER   4          1HB       SER   4  11.501   2.343  -1.805
   28   2HB   SER   4          2HB       SER   4   9.964   3.177  -1.572
   29    HG   SER   4           HG       SER   4  11.233   4.843  -1.291
   30    H    THR   5           H        THR   5   8.751   1.841  -1.504
   31    HA   THR   5           HA       THR   5   7.646  -0.600  -0.684
   32    HB   THR   5           HB       THR   5   6.334  -0.437  -2.769
   33    HG1  THR   5           1HG      THR   5   8.412   1.053  -3.561
   34   1HG2  THR   5          1HG2      THR   5   6.588   2.271  -1.493
   35   2HG2  THR   5          2HG2      THR   5   5.176   1.578  -2.294
   36   3HG2  THR   5          3HG2      THR   5   5.734   0.914  -0.759
   37    H    VAL   6           H        VAL   6   7.273  -2.457  -2.252
   38    HA   VAL   6           HA       VAL   6   9.790  -3.197  -3.609
   39    HB   VAL   6           HB       VAL   6   8.135  -5.359  -2.498
   40   1HG1  VAL   6          1HG1      VAL   6  11.056  -4.884  -2.874
   41   2HG1  VAL   6          2HG1      VAL   6  10.460  -6.221  -1.890
   42   3HG1  VAL   6          3HG1      VAL   6  10.020  -6.113  -3.596
   43   1HG2  VAL   6          1HG2      VAL   6   9.808  -3.646  -0.686
   44   2HG2  VAL   6          2HG2      VAL   6   8.055  -3.850  -0.637
   45   3HG2  VAL   6          3HG2      VAL   6   9.114  -5.210  -0.262
   46    H    GLY   7           H        GLY   7   6.873  -2.449  -4.073
   47   1HA   GLY   7          1HA       GLY   7   6.581  -3.969  -6.492
   48   2HA   GLY   7          2HA       GLY   7   5.322  -4.206  -5.308
   49    H    GLY   8           H        GLY   8   3.808  -3.363  -6.799
   50   1HA   GLY   8          1HA       GLY   8   2.398  -1.655  -7.383
   51   2HA   GLY   8          2HA       GLY   8   3.387  -0.575  -6.422
   52    H    ASN   9           H        ASN   9   2.774   0.851  -8.250
   53    HA   ASN   9           HA       ASN   9   4.586   0.464 -10.522
   54   1HB   ASN   9          1HB       ASN   9   3.197   2.280 -11.643
   55   2HB   ASN   9          2HB       ASN   9   2.440   0.719 -11.426
   56   1HD2  ASN   9          1HD2      ASN   9   0.965   2.917  -8.505
   57   2HD2  ASN   9          2HD2      ASN   9   2.556   2.254  -8.518
   58    H    SER  10           H        SER  10   4.524   1.934  -7.634
   59    HA   SER  10           HA       SER  10   5.763   4.424  -8.452
   60   1HB   SER  10          1HB       SER  10   5.466   3.313  -5.649
   61   2HB   SER  10          2HB       SER  10   5.722   4.987  -6.124
   62    HG   SER  10           HG       SER  10   3.489   4.376  -5.581
   63    H    GLY  11           H        GLY  11   6.659   1.713  -6.288
   64   1HA   GLY  11          1HA       GLY  11   8.629   0.498  -6.232
   65   2HA   GLY  11          2HA       GLY  11   9.243   1.481  -7.544
   66    H    GLY  12           H        GLY  12   9.611   3.885  -6.773
   67   1HA   GLY  12          1HA       GLY  12  11.452   3.606  -4.533
   68   2HA   GLY  12          2HA       GLY  12  11.403   4.938  -5.674
   69    H    ALA  13           H        ALA  13   8.335   4.988  -5.082
   70    HA   ALA  13           HA       ALA  13   8.597   6.985  -3.029
   71   1HB   ALA  13          1HB       ALA  13   7.005   7.046  -5.039
   72   2HB   ALA  13          2HB       ALA  13   5.971   5.993  -4.072
   73   3HB   ALA  13          3HB       ALA  13   6.400   7.597  -3.478
   74    HA   PRO  14           HA       PRO  14   7.666   4.397   0.425
   75   1HB   PRO  14          1HB       PRO  14   7.015   6.711   1.991
   76   2HB   PRO  14          2HB       PRO  14   8.511   5.774   2.002
   77   1HG   PRO  14          1HG       PRO  14   8.259   8.381   1.088
   78   2HG   PRO  14          2HG       PRO  14   9.583   7.277   0.680
   79   1HD   PRO  14          1HD       PRO  14   7.205   8.064  -0.937
   80   2HD   PRO  14          2HD       PRO  14   8.846   7.627  -1.455
   81    H    CYS  15           H        CYS  15   5.913   3.995   1.981
   82    HA   CYS  15           HA       CYS  15   3.340   4.475   0.732
   83   1HB   CYS  15          1HB       CYS  15   4.075   2.781   3.140
   84   2HB   CYS  15          2HB       CYS  15   2.485   2.842   2.386
   85    H    VAL  16           H        VAL  16   1.616   5.578   1.672
   86    HA   VAL  16           HA       VAL  16   2.346   7.305   3.949
   87    HB   VAL  16           HB       VAL  16   0.220   7.748   1.843
   88   1HG1  VAL  16          1HG1      VAL  16   0.122   8.749   4.307
   89   2HG1  VAL  16          2HG1      VAL  16   1.192   9.941   3.571
   90   3HG1  VAL  16          3HG1      VAL  16  -0.410   9.655   2.892
   91   1HG2  VAL  16          1HG2      VAL  16   2.961   8.060   1.600
   92   2HG2  VAL  16          2HG2      VAL  16   1.721   8.784   0.575
   93   3HG2  VAL  16          3HG2      VAL  16   2.366   9.684   1.949
   94    H    PHE  17           H        PHE  17   1.388   6.860   5.841
   95    HA   PHE  17           HA       PHE  17  -1.222   5.518   5.798
   96   1HB   PHE  17          1HB       PHE  17   1.015   5.277   7.809
   97   2HB   PHE  17          2HB       PHE  17  -0.583   4.588   8.008
   98    HD1  PHE  17           1HD      PHE  17  -1.363   3.085   5.902
   99    HD2  PHE  17           2HD      PHE  17   2.638   3.928   7.062
  100    HE1  PHE  17           1HE      PHE  17  -0.592   1.085   4.706
  101    HE2  PHE  17           2HE      PHE  17   3.429   1.933   5.869
  102    HZ   PHE  17           HZ       PHE  17   1.821   0.487   4.665
  103    HA   PRO  18           HA       PRO  18  -2.627   4.974   7.032
  104   1HB   PRO  18          1HB       PRO  18  -5.205   5.672   7.640
  105   2HB   PRO  18          2HB       PRO  18  -4.043   5.048   8.813
  106   1HG   PRO  18          1HG       PRO  18  -5.154   7.724   8.575
  107   2HG   PRO  18          2HG       PRO  18  -4.204   7.023   9.894
  108   1HD   PRO  18          1HD       PRO  18  -3.340   8.807   7.765
  109   2HD   PRO  18          2HD       PRO  18  -2.450   8.279   9.208
  110    H    PHE  19           H        PHE  19  -3.506   4.319   5.099
  111    HA   PHE  19           HA       PHE  19  -4.518   6.530   3.435
  112   1HB   PHE  19          1HB       PHE  19  -3.985   5.273   1.440
  113   2HB   PHE  19          2HB       PHE  19  -2.558   5.405   2.447
  114    HD1  PHE  19           1HD      PHE  19  -1.843   3.363   3.780
  115    HD2  PHE  19           2HD      PHE  19  -4.776   3.229   0.699
  116    HE1  PHE  19           1HE      PHE  19  -1.471   0.943   3.527
  117    HE2  PHE  19           2HE      PHE  19  -4.413   0.811   0.450
  118    HZ   PHE  19           HZ       PHE  19  -2.759  -0.338   1.865
  119    H    THR  20           H        THR  20  -6.041   5.232   1.593
  120    HA   THR  20           HA       THR  20  -7.906   3.598   3.143
  121    HB   THR  20           HB       THR  20  -8.690   6.137   1.662
  122    HG1  THR  20           1HG      THR  20  -7.897   6.669   3.667
  123   1HG2  THR  20          1HG2      THR  20 -10.921   5.674   2.841
  124   2HG2  THR  20          2HG2      THR  20 -10.551   4.779   1.361
  125   3HG2  THR  20          3HG2      THR  20 -10.360   4.006   2.935
  126    H    PHE  21           H        PHE  21  -8.622   1.942   2.044
  127    HA   PHE  21           HA       PHE  21  -8.708   2.063  -0.906
  128   1HB   PHE  21          1HB       PHE  21  -6.727   0.725   0.184
  129   2HB   PHE  21          2HB       PHE  21  -7.977  -0.443   0.563
  130    HD1  PHE  21           1HD      PHE  21  -8.709   1.238  -2.500
  131    HD2  PHE  21           2HD      PHE  21  -6.425  -1.909  -0.780
  132    HE1  PHE  21           1HE      PHE  21  -8.467   0.194  -4.698
  133    HE2  PHE  21           2HE      PHE  21  -6.182  -2.954  -2.967
  134    HZ   PHE  21           HZ       PHE  21  -7.191  -1.893  -4.960
  135    H    LEU  22           H        LEU  22 -10.430   0.885  -1.780
  136    HA   LEU  22           HA       LEU  22 -12.611   0.365  -1.885
  137   1HB   LEU  22          1HB       LEU  22 -11.284  -1.694  -0.233
  138   2HB   LEU  22          2HB       LEU  22 -12.831  -1.966  -1.019
  139    HG   LEU  22           HG       LEU  22 -11.621  -2.711  -2.752
  140   1HD1  LEU  22          1HD1      LEU  22 -12.001  -0.347  -3.494
  141   2HD1  LEU  22          2HD1      LEU  22 -10.279  -0.143  -3.174
  142   3HD1  LEU  22          3HD1      LEU  22 -10.819  -1.331  -4.359
  143   1HD2  LEU  22          1HD2      LEU  22  -9.658  -2.344  -0.861
  144   2HD2  LEU  22          2HD2      LEU  22  -9.692  -3.468  -2.221
  145   3HD2  LEU  22          3HD2      LEU  22  -9.012  -1.851  -2.423
  146    H    GLY  23           H        GLY  23 -12.239   2.250   0.262
  147   1HA   GLY  23          1HA       GLY  23 -13.850   3.180   1.674
  148   2HA   GLY  23          2HA       GLY  23 -14.666   1.630   1.731
  149    H    ASN  24           H        ASN  24 -11.530   0.854   2.452
  150    HA   ASN  24           HA       ASN  24 -12.068   1.145   5.330
  151   1HB   ASN  24          1HB       ASN  24 -10.321  -0.853   3.888
  152   2HB   ASN  24          2HB       ASN  24 -10.651  -0.829   5.609
  153   1HD2  ASN  24          1HD2      ASN  24 -13.074  -2.720   3.094
  154   2HD2  ASN  24          2HD2      ASN  24 -11.530  -2.072   2.669
  155    H    LYS  25           H        LYS  25 -10.563   2.043   6.664
  156    HA   LYS  25           HA       LYS  25  -8.465   3.589   5.495
  157   1HB   LYS  25          1HB       LYS  25  -9.339   3.098   8.352
  158   2HB   LYS  25          2HB       LYS  25  -8.185   4.304   7.840
  159   1HG   LYS  25          1HG       LYS  25  -9.810   5.583   6.729
  160   2HG   LYS  25          2HG       LYS  25 -10.969   4.250   6.757
  161   1HD   LYS  25          1HD       LYS  25 -11.518   6.031   8.379
  162   2HD   LYS  25          2HD       LYS  25 -11.223   4.479   9.157
  163   1HE   LYS  25          1HE       LYS  25 -10.187   6.347  10.369
  164   2HE   LYS  25          2HE       LYS  25  -8.995   5.173   9.794
  165   1HZ   LYS  25          1HZ       LYS  25  -9.659   7.646   8.279
  166   2HZ   LYS  25          2HZ       LYS  25  -8.440   7.600   9.466
  167   3HZ   LYS  25          3HZ       LYS  25  -8.318   6.622   8.081
  168    H    TYR  26           H        TYR  26  -6.409   2.830   5.179
  169    HA   TYR  26           HA       TYR  26  -5.649   0.435   6.689
  170   1HB   TYR  26          1HB       TYR  26  -4.666   1.487   4.040
  171   2HB   TYR  26          2HB       TYR  26  -4.008   0.079   4.861
  172    HD1  TYR  26           1HD      TYR  26  -7.225  -0.249   5.754
  173    HD2  TYR  26           2HD      TYR  26  -4.909  -0.336   2.201
  174    HE1  TYR  26           1HE      TYR  26  -8.920  -1.641   4.693
  175    HE2  TYR  26           2HE      TYR  26  -6.601  -1.736   1.126
  176    HH   TYR  26           HH       TYR  26  -8.670  -3.505   2.502
  177    H    GLU  27           H        GLU  27  -4.580   0.958   8.354
  178    HA   GLU  27           HA       GLU  27  -2.738   3.202   8.429
  179   1HB   GLU  27          1HB       GLU  27  -3.634   1.284  10.573
  180   2HB   GLU  27          2HB       GLU  27  -2.682   2.725  10.822
  181   1HG   GLU  27          1HG       GLU  27  -4.479   4.137  10.172
  182   2HG   GLU  27          2HG       GLU  27  -5.438   2.754   9.643
  183    H    SER  28           H        SER  28  -2.740  -0.112   7.908
  184    HA   SER  28           HA       SER  28   0.174  -0.224   8.151
  185   1HB   SER  28          1HB       SER  28  -0.211  -2.693   8.660
  186   2HB   SER  28          2HB       SER  28  -0.605  -1.575   9.961
  187    HG   SER  28           HG       SER  28  -2.608  -2.221   9.858
  188    H    CYS  29           H        CYS  29   0.759  -2.467   6.839
  189    HA   CYS  29           HA       CYS  29   0.055  -1.872   4.159
  190   1HB   CYS  29          1HB       CYS  29   1.331  -4.363   5.285
  191   2HB   CYS  29          2HB       CYS  29   1.279  -3.928   3.590
  192    H    THR  30           H        THR  30  -0.888  -3.503   2.693
  193    HA   THR  30           HA       THR  30  -2.966  -5.146   3.944
  194    HB   THR  30           HB       THR  30  -3.982  -2.897   3.436
  195    HG1  THR  30           1HG      THR  30  -5.447  -4.482   3.320
  196   1HG2  THR  30          1HG2      THR  30  -4.434  -2.588   0.908
  197   2HG2  THR  30          2HG2      THR  30  -2.909  -2.024   1.588
  198   3HG2  THR  30          3HG2      THR  30  -2.967  -3.547   0.699
  199    H    SER  31           H        SER  31  -4.176  -6.300   2.078
  200    HA   SER  31           HA       SER  31  -2.302  -6.991  -0.068
  201   1HB   SER  31          1HB       SER  31  -3.113  -9.382   0.177
  202   2HB   SER  31          2HB       SER  31  -2.095  -8.786   1.504
  203    HG   SER  31           HG       SER  31  -4.264  -9.949   1.909
  204    H    ALA  32           H        ALA  32  -4.747  -5.323   0.458
  205    HA   ALA  32           HA       ALA  32  -6.990  -6.356  -0.898
  206   1HB   ALA  32          1HB       ALA  32  -6.272  -3.957   0.453
  207   2HB   ALA  32          2HB       ALA  32  -6.865  -3.503  -1.145
  208   3HB   ALA  32          3HB       ALA  32  -7.878  -4.465  -0.071
  209    H    GLY  33           H        GLY  33  -7.848  -5.799  -2.917
  210   1HA   GLY  33          1HA       GLY  33  -7.817  -5.303  -5.153
  211   2HA   GLY  33          2HA       GLY  33  -6.363  -4.365  -4.866
  212    H    ARG  34           H        ARG  34  -5.687  -7.399  -3.695
  213    HA   ARG  34           HA       ARG  34  -4.558  -8.149  -6.304
  214   1HB   ARG  34          1HB       ARG  34  -3.438  -9.322  -3.823
  215   2HB   ARG  34          2HB       ARG  34  -2.680  -8.901  -5.322
  216   1HG   ARG  34          1HG       ARG  34  -2.822  -6.522  -4.690
  217   2HG   ARG  34          2HG       ARG  34  -3.429  -7.041  -3.110
  218   1HD   ARG  34          1HD       ARG  34  -0.952  -6.641  -3.199
  219   2HD   ARG  34          2HD       ARG  34  -1.380  -8.247  -2.658
  220    HE   ARG  34           HE       ARG  34  -0.160  -7.476  -5.132
  221   1HH1  ARG  34          1HH1      ARG  34  -1.599  -9.951  -3.247
  222   2HH1  ARG  34          2HH1      ARG  34  -0.904 -11.229  -4.197
  223   1HH2  ARG  34          1HH2      ARG  34   0.752  -9.015  -6.385
  224   2HH2  ARG  34          2HH2      ARG  34   0.469 -10.689  -6.008
  225    H    SER  35           H        SER  35  -3.859 -10.669  -6.061
  226    HA   SER  35           HA       SER  35  -6.269 -12.106  -5.200
  227   1HB   SER  35          1HB       SER  35  -5.939 -13.546  -7.282
  228   2HB   SER  35          2HB       SER  35  -6.546 -11.907  -7.539
  229    HG   SER  35           HG       SER  35  -4.465 -12.986  -8.671
  230    H    ASP  36           H        ASP  36  -2.809 -12.052  -5.183
  231    HA   ASP  36           HA       ASP  36  -2.771 -14.860  -4.384
  232   1HB   ASP  36          1HB       ASP  36  -0.253 -14.586  -4.712
  233   2HB   ASP  36          2HB       ASP  36  -1.263 -14.663  -6.142
  234    H    GLY  37           H        GLY  37  -0.199 -12.692  -3.540
  235   1HA   GLY  37          1HA       GLY  37  -1.176 -12.106  -0.961
  236   2HA   GLY  37          2HA       GLY  37  -0.141 -13.506  -0.887
  237    H    LYS  38           H        LYS  38   0.313 -10.518  -2.844
  238    HA   LYS  38           HA       LYS  38   2.873 -10.158  -1.474
  239   1HB   LYS  38          1HB       LYS  38   1.755  -8.856  -3.961
  240   2HB   LYS  38          2HB       LYS  38   3.400  -8.693  -3.354
  241   1HG   LYS  38          1HG       LYS  38   3.737 -11.079  -3.677
  242   2HG   LYS  38          2HG       LYS  38   2.130 -11.219  -4.358
  243   1HD   LYS  38          1HD       LYS  38   2.805  -9.666  -6.157
  244   2HD   LYS  38          2HD       LYS  38   4.429  -9.607  -5.470
  245   1HE   LYS  38          1HE       LYS  38   3.028 -12.026  -6.591
  246   2HE   LYS  38          2HE       LYS  38   4.379 -11.167  -7.321
  247   1HZ   LYS  38          1HZ       LYS  38   5.698 -11.774  -5.324
  248   2HZ   LYS  38          2HZ       LYS  38   4.405 -12.755  -4.813
  249   3HZ   LYS  38          3HZ       LYS  38   5.214 -13.104  -6.266
  250    H    MET  39           H        MET  39   1.924  -9.240   0.481
  251    HA   MET  39           HA       MET  39   0.054  -7.194   0.504
  252   1HB   MET  39          1HB       MET  39   2.260  -7.532   2.542
  253   2HB   MET  39          2HB       MET  39   0.712  -6.738   2.767
  254   1HG   MET  39          1HG       MET  39   0.464  -8.789   3.826
  255   2HG   MET  39          2HG       MET  39  -0.355  -8.988   2.280
  256   1HE   MET  39          1HE       MET  39  -0.402 -11.420   2.947
  257   2HE   MET  39          2HE       MET  39   0.936 -12.550   2.742
  258   3HE   MET  39          3HE       MET  39   0.806 -11.600   4.221
  259    H    TRP  40           H        TRP  40   0.091  -5.051   0.386
  260    HA   TRP  40           HA       TRP  40   2.646  -3.684  -0.116
  261   1HB   TRP  40          1HB       TRP  40   1.491  -2.419  -1.926
  262   2HB   TRP  40          2HB       TRP  40   1.611  -4.143  -2.283
  263    HD1  TRP  40           HD1      TRP  40  -0.775  -5.571  -1.626
  264    HE1  TRP  40           1HE      TRP  40  -3.209  -4.825  -1.979
  265    HE3  TRP  40           3HE      TRP  40  -0.026  -0.561  -2.067
  266    HZ2  TRP  40           2HZ      TRP  40  -4.621  -2.434  -2.350
  267    HZ3  TRP  40           3HZ      TRP  40  -1.976   0.901  -2.382
  268    HH2  TRP  40           HH2      TRP  40  -4.230  -0.019  -2.531
  269    H    CYS  41           H        CYS  41   1.643  -1.224  -0.651
  270    HA   CYS  41           HA       CYS  41  -0.314  -0.326   1.205
  271   1HB   CYS  41          1HB       CYS  41   1.424   1.253   2.349
  272   2HB   CYS  41          2HB       CYS  41   1.211  -0.388   2.948
  273    H    ALA  42           H        ALA  42  -0.966   1.799   0.723
  274    HA   ALA  42           HA       ALA  42  -0.335   2.643  -1.919
  275   1HB   ALA  42          1HB       ALA  42  -2.394   3.113  -0.114
  276   2HB   ALA  42          2HB       ALA  42  -1.639   4.687  -0.362
  277   3HB   ALA  42          3HB       ALA  42  -2.239   3.768  -1.745
  278    H    THR  43           H        THR  43   0.640   4.551  -2.613
  279    HA   THR  43           HA       THR  43   2.653   5.555  -0.745
  280    HB   THR  43           HB       THR  43   3.792   6.381  -2.783
  281    HG1  THR  43           1HG      THR  43   2.432   6.705  -4.381
  282   1HG2  THR  43          1HG2      THR  43   3.903   4.021  -3.951
  283   2HG2  THR  43          2HG2      THR  43   4.637   4.313  -2.372
  284   3HG2  THR  43          3HG2      THR  43   3.062   3.526  -2.482
  285    H    THR  44           H        THR  44  -0.344   6.257  -1.379
  286    HA   THR  44           HA       THR  44   0.013   9.162  -1.112
  287    HB   THR  44           HB       THR  44  -2.123   9.447  -2.382
  288    HG1  THR  44           1HG      THR  44  -3.255   7.765  -2.880
  289   1HG2  THR  44          1HG2      THR  44  -1.287   8.764  -4.645
  290   2HG2  THR  44          2HG2      THR  44  -0.206   9.796  -3.711
  291   3HG2  THR  44          3HG2      THR  44   0.113   8.065  -3.831
  292    H    ALA  45           H        ALA  45  -1.693  10.196   0.162
  293    HA   ALA  45           HA       ALA  45  -2.408   8.743   2.476
  294   1HB   ALA  45          1HB       ALA  45  -2.407  11.402   1.745
  295   2HB   ALA  45          2HB       ALA  45  -4.118  11.039   1.968
  296   3HB   ALA  45          3HB       ALA  45  -2.976  10.745   3.281
  297    H    ASN  46           H        ASN  46  -4.100   9.336  -0.520
  298    HA   ASN  46           HA       ASN  46  -6.209   7.532   0.433
  299   1HB   ASN  46          1HB       ASN  46  -7.085   9.876   0.297
  300   2HB   ASN  46          2HB       ASN  46  -6.681   9.895  -1.415
  301   1HD2  ASN  46          1HD2      ASN  46 -10.125   8.381  -0.133
  302   2HD2  ASN  46          2HD2      ASN  46  -9.012   9.231   0.875
  303    H    TYR  47           H        TYR  47  -5.916   5.711  -0.637
  304    HA   TYR  47           HA       TYR  47  -4.514   5.649  -3.129
  305   1HB   TYR  47          1HB       TYR  47  -4.266   3.894  -1.391
  306   2HB   TYR  47          2HB       TYR  47  -5.923   3.387  -1.712
  307    HD1  TYR  47           1HD      TYR  47  -2.551   3.664  -3.176
  308    HD2  TYR  47           2HD      TYR  47  -6.440   2.005  -3.590
  309    HE1  TYR  47           1HE      TYR  47  -1.740   2.232  -4.989
  310    HE2  TYR  47           2HE      TYR  47  -5.634   0.578  -5.418
  311    HH   TYR  47           HH       TYR  47  -3.245  -0.397  -6.059
  312    H    ASP  48           H        ASP  48  -7.878   5.309  -2.155
  313    HA   ASP  48           HA       ASP  48  -8.967   4.212  -4.436
  314   1HB   ASP  48          1HB       ASP  48 -10.017   6.160  -2.418
  315   2HB   ASP  48          2HB       ASP  48 -11.000   5.692  -3.798
  316    H    ASP  49           H        ASP  49  -7.834   7.451  -3.906
  317    HA   ASP  49           HA       ASP  49  -9.036   8.519  -6.305
  318   1HB   ASP  49          1HB       ASP  49  -7.274   9.632  -4.151
  319   2HB   ASP  49          2HB       ASP  49  -7.503  10.519  -5.652
  320    H    ASP  50           H        ASP  50  -5.653   8.636  -5.236
  321    HA   ASP  50           HA       ASP  50  -4.688   8.959  -7.887
  322   1HB   ASP  50          1HB       ASP  50  -3.285   8.469  -5.269
  323   2HB   ASP  50          2HB       ASP  50  -2.422   8.711  -6.785
  324    H    ARG  51           H        ARG  51  -5.046   6.141  -5.854
  325    HA   ARG  51           HA       ARG  51  -4.536   3.978  -6.112
  326   1HB   ARG  51          1HB       ARG  51  -5.097   4.699  -8.971
  327   2HB   ARG  51          2HB       ARG  51  -5.050   3.057  -8.336
  328   1HG   ARG  51          1HG       ARG  51  -6.672   4.562  -6.625
  329   2HG   ARG  51          2HG       ARG  51  -7.196   4.917  -8.276
  330   1HD   ARG  51          1HD       ARG  51  -6.651   2.098  -7.637
  331   2HD   ARG  51          2HD       ARG  51  -8.037   2.819  -6.815
  332    HE   ARG  51           HE       ARG  51  -8.261   3.507  -9.490
  333   1HH1  ARG  51          1HH1      ARG  51  -8.161   0.545  -7.647
  334   2HH1  ARG  51          2HH1      ARG  51  -9.263  -0.297  -8.690
  335   1HH2  ARG  51          1HH2      ARG  51  -9.674   2.424 -10.889
  336   2HH2  ARG  51          2HH2      ARG  51 -10.119   0.771 -10.566
  337    H    LYS  52           H        LYS  52  -2.283   5.296  -5.731
  338    HA   LYS  52           HA       LYS  52  -0.376   3.996  -7.550
  339   1HB   LYS  52          1HB       LYS  52  -0.080   6.554  -5.952
  340   2HB   LYS  52          2HB       LYS  52   1.280   5.733  -6.715
  341   1HG   LYS  52          1HG       LYS  52   0.335   6.040  -8.889
  342   2HG   LYS  52          2HG       LYS  52  -1.164   6.657  -8.207
  343   1HD   LYS  52          1HD       LYS  52  -0.020   8.634  -7.397
  344   2HD   LYS  52          2HD       LYS  52   1.524   8.000  -7.975
  345   1HE   LYS  52          1HE       LYS  52   0.818   8.135 -10.250
  346   2HE   LYS  52          2HE       LYS  52  -0.840   8.494  -9.772
  347   1HZ   LYS  52          1HZ       LYS  52   1.117  10.364  -8.758
  348   2HZ   LYS  52          2HZ       LYS  52   0.986  10.341 -10.453
  349   3HZ   LYS  52          3HZ       LYS  52  -0.386  10.647  -9.494
  350    H    TRP  53           H        TRP  53   0.520   2.289  -6.682
  351    HA   TRP  53           HA       TRP  53   0.736   2.121  -3.752
  352   1HB   TRP  53          1HB       TRP  53   0.005  -0.163  -3.923
  353   2HB   TRP  53          2HB       TRP  53  -1.153   0.886  -4.664
  354    HD1  TRP  53           HD1      TRP  53  -0.657   1.057  -7.591
  355    HE1  TRP  53           1HE      TRP  53  -0.258  -0.994  -9.109
  356    HE3  TRP  53           3HE      TRP  53   0.672  -2.193  -4.012
  357    HZ2  TRP  53           2HZ      TRP  53   0.533  -3.728  -8.758
  358    HZ3  TRP  53           3HZ      TRP  53   1.248  -4.531  -4.616
  359    HH2  TRP  53           HH2      TRP  53   1.185  -5.275  -6.951
  360    H    GLY  54           H        GLY  54   1.934   0.100  -3.125
  361   1HA   GLY  54          1HA       GLY  54   4.078  -0.916  -4.679
  362   2HA   GLY  54          2HA       GLY  54   4.653   0.331  -3.569
  363    H    PHE  55           H        PHE  55   5.181  -2.577  -3.527
  364    HA   PHE  55           HA       PHE  55   3.665  -3.900  -1.602
  365   1HB   PHE  55          1HB       PHE  55   6.494  -4.255  -2.540
  366   2HB   PHE  55          2HB       PHE  55   5.775  -5.296  -1.327
  367    HD1  PHE  55           1HD      PHE  55   3.091  -4.500  -3.184
  368    HD2  PHE  55           2HD      PHE  55   6.730  -6.674  -3.543
  369    HE1  PHE  55           1HE      PHE  55   2.061  -5.925  -4.917
  370    HE2  PHE  55           2HE      PHE  55   5.696  -8.113  -5.277
  371    HZ   PHE  55           HZ       PHE  55   3.367  -7.693  -5.976
  372    H    CYS  56           H        CYS  56   4.254  -4.626   0.469
  373    HA   CYS  56           HA       CYS  56   4.896  -2.530   2.287
  374   1HB   CYS  56          1HB       CYS  56   3.371  -4.605   2.610
  375   2HB   CYS  56          2HB       CYS  56   4.860  -5.487   2.912
  376    HA   PRO  57           HA       PRO  57   9.310  -3.026   2.315
  377   1HB   PRO  57          1HB       PRO  57   9.951  -2.011   4.698
  378   2HB   PRO  57          2HB       PRO  57   9.340  -0.994   3.382
  379   1HG   PRO  57          1HG       PRO  57   7.828  -2.284   5.604
  380   2HG   PRO  57          2HG       PRO  57   7.829  -0.563   5.164
  381   1HD   PRO  57          1HD       PRO  57   5.866  -2.150   4.341
  382   2HD   PRO  57          2HD       PRO  57   6.583  -0.977   3.209
  383    H    ASP  58           H        ASP  58  10.712  -3.371   4.793
  384    HA   ASP  58           HA       ASP  58  10.934  -6.184   4.819
  385   1HB   ASP  58          1HB       ASP  58  12.723  -4.489   5.456
  386   2HB   ASP  58          2HB       ASP  58  11.904  -4.346   7.008
  387    H    GLN  59           H        GLN  59   9.276  -7.396   5.447
  388    HA   GLN  59           HA       GLN  59   7.500  -6.617   7.566
  389   1HB   GLN  59          1HB       GLN  59   7.680  -9.224   6.053
  390   2HB   GLN  59          2HB       GLN  59   6.346  -8.717   7.072
  391   1HG   GLN  59          1HG       GLN  59   5.915  -6.847   5.554
  392   2HG   GLN  59          2HG       GLN  59   7.228  -7.401   4.522
  393   1HE2  GLN  59          1HE2      GLN  59   5.156  -9.481   2.724
  394   2HE2  GLN  59          2HE2      GLN  59   6.560  -8.474   2.812
  395    H    GLY  60           H        GLY  60   6.987  -8.093   9.382
  396   1HA   GLY  60          1HA       GLY  60   9.155  -9.833  10.258
  397   2HA   GLY  60          2HA       GLY  60   8.850  -8.412  11.247
  Start of MODEL   25
    1    H    SER   1           1H       SER   1  12.926   2.963   9.843
    2    HA   SER   1           HA       SER   1  11.224   4.202   8.804
    3   1HB   SER   1          1HB       SER   1  13.926   4.824   7.586
    4   2HB   SER   1          2HB       SER   1  12.623   5.972   7.890
    5    HG   SER   1           HG       SER   1  14.040   6.154   9.583
    6    H    TRP   2           H        TRP   2  11.836   1.675   7.072
    7    HA   TRP   2           HA       TRP   2  11.070   0.841   5.110
    8   1HB   TRP   2          1HB       TRP   2   9.997   3.625   4.626
    9   2HB   TRP   2          2HB       TRP   2   9.689   2.234   3.593
   10    HD1  TRP   2           HD1      TRP   2   8.674   0.031   5.347
   11    HE1  TRP   2           1HE      TRP   2   6.589   0.254   6.848
   12    HE3  TRP   2           3HE      TRP   2   8.497   5.123   5.706
   13    HZ2  TRP   2           2HZ      TRP   2   5.065   2.338   8.019
   14    HZ3  TRP   2           3HZ      TRP   2   6.689   6.153   7.020
   15    HH2  TRP   2           HH2      TRP   2   5.008   4.787   8.149
   16    H    MET   3           H        MET   3  12.197   0.352   3.359
   17    HA   MET   3           HA       MET   3  14.113   2.338   2.346
   18   1HB   MET   3          1HB       MET   3  14.977   0.152   1.143
   19   2HB   MET   3          2HB       MET   3  15.422   0.498   2.803
   20   1HG   MET   3          1HG       MET   3  14.842  -1.809   2.593
   21   2HG   MET   3          2HG       MET   3  13.634  -0.993   3.578
   22   1HE   MET   3          1HE       MET   3  12.134  -3.163   3.276
   23   2HE   MET   3          2HE       MET   3  11.594  -3.791   1.721
   24   3HE   MET   3          3HE       MET   3  13.292  -3.924   2.186
   25    H    SER   4           H        SER   4  11.690   2.917   1.623
   26    HA   SER   4           HA       SER   4  10.407   3.475  -0.148
   27   1HB   SER   4          1HB       SER   4  12.669   3.499  -1.368
   28   2HB   SER   4          2HB       SER   4  12.233   1.898  -1.963
   29    HG   SER   4           HG       SER   4  11.369   4.342  -2.786
   30    H    THR   5           H        THR   5   9.548   1.978  -2.322
   31    HA   THR   5           HA       THR   5   8.421  -0.352  -0.926
   32    HB   THR   5           HB       THR   5   6.514  -0.082  -2.493
   33    HG1  THR   5           1HG      THR   5   8.107   1.382  -3.840
   34   1HG2  THR   5          1HG2      THR   5   6.314   2.559  -1.530
   35   2HG2  THR   5          2HG2      THR   5   5.543   1.095  -0.914
   36   3HG2  THR   5          3HG2      THR   5   7.124   1.583  -0.301
   37    H    VAL   6           H        VAL   6   7.702  -2.107  -2.319
   38    HA   VAL   6           HA       VAL   6   9.583  -2.637  -4.542
   39    HB   VAL   6           HB       VAL   6   7.953  -4.894  -3.681
   40   1HG1  VAL   6          1HG1      VAL   6  10.188  -4.678  -5.066
   41   2HG1  VAL   6          2HG1      VAL   6  10.912  -4.885  -3.471
   42   3HG1  VAL   6          3HG1      VAL   6   9.823  -6.117  -4.111
   43   1HG2  VAL   6          1HG2      VAL   6   8.872  -3.296  -1.577
   44   2HG2  VAL   6          2HG2      VAL   6   8.200  -4.924  -1.488
   45   3HG2  VAL   6          3HG2      VAL   6   9.942  -4.697  -1.640
   46    H    GLY   7           H        GLY   7   8.095  -4.584  -5.782
   47   1HA   GLY   7          1HA       GLY   7   6.503  -4.657  -7.485
   48   2HA   GLY   7          2HA       GLY   7   5.434  -4.381  -6.147
   49    H    GLY   8           H        GLY   8   4.013  -2.933  -6.566
   50   1HA   GLY   8          1HA       GLY   8   2.931  -1.154  -7.535
   51   2HA   GLY   8          2HA       GLY   8   4.207  -0.301  -6.701
   52    H    ASN   9           H        ASN   9   4.209   1.359  -8.076
   53    HA   ASN   9           HA       ASN   9   5.658   0.959 -10.557
   54   1HB   ASN   9          1HB       ASN   9   3.954   2.768 -11.517
   55   2HB   ASN   9          2HB       ASN   9   3.672   1.051 -11.692
   56   1HD2  ASN   9          1HD2      ASN   9   1.109   3.354  -9.696
   57   2HD2  ASN   9          2HD2      ASN   9   2.527   3.945 -10.498
   58    H    SER  10           H        SER  10   4.524   2.973  -7.969
   59    HA   SER  10           HA       SER  10   5.331   5.489  -8.638
   60   1HB   SER  10          1HB       SER  10   5.713   4.194  -5.921
   61   2HB   SER  10          2HB       SER  10   5.564   5.912  -6.241
   62    HG   SER  10           HG       SER  10   3.578   4.930  -5.549
   63    H    GLY  11           H        GLY  11   7.392   3.147  -6.901
   64   1HA   GLY  11          1HA       GLY  11   9.659   2.825  -6.899
   65   2HA   GLY  11          2HA       GLY  11   9.687   3.611  -8.468
   66    H    GLY  12           H        GLY  12   9.817   4.149  -4.985
   67   1HA   GLY  12          1HA       GLY  12  11.741   5.637  -4.376
   68   2HA   GLY  12          2HA       GLY  12  11.080   6.759  -5.555
   69    H    ALA  13           H        ALA  13   8.305   6.013  -4.673
   70    HA   ALA  13           HA       ALA  13   8.209   7.949  -2.500
   71   1HB   ALA  13          1HB       ALA  13   6.649   8.159  -4.390
   72   2HB   ALA  13          2HB       ALA  13   5.952   6.591  -3.978
   73   3HB   ALA  13          3HB       ALA  13   5.804   7.941  -2.856
   74    HA   PRO  14           HA       PRO  14   7.645   4.769   0.532
   75   1HB   PRO  14          1HB       PRO  14   7.068   6.368   2.640
   76   2HB   PRO  14          2HB       PRO  14   8.694   6.234   1.966
   77   1HG   PRO  14          1HG       PRO  14   6.733   8.434   1.751
   78   2HG   PRO  14          2HG       PRO  14   8.498   8.483   1.638
   79   1HD   PRO  14          1HD       PRO  14   6.635   8.523  -0.504
   80   2HD   PRO  14          2HD       PRO  14   8.398   8.413  -0.620
   81    H    CYS  15           H        CYS  15   5.979   3.979   2.085
   82    HA   CYS  15           HA       CYS  15   3.376   4.149   0.888
   83   1HB   CYS  15          1HB       CYS  15   3.829   2.979   3.623
   84   2HB   CYS  15          2HB       CYS  15   2.748   2.433   2.351
   85    H    VAL  16           H        VAL  16   1.893   5.705   1.341
   86    HA   VAL  16           HA       VAL  16   2.272   7.381   3.699
   87    HB   VAL  16           HB       VAL  16   0.274   7.663   1.443
   88   1HG1  VAL  16          1HG1      VAL  16  -0.083   8.739   3.830
   89   2HG1  VAL  16          2HG1      VAL  16   1.058   9.929   3.205
   90   3HG1  VAL  16          3HG1      VAL  16  -0.457   9.624   2.353
   91   1HG2  VAL  16          1HG2      VAL  16   2.904   7.940   1.111
   92   2HG2  VAL  16          2HG2      VAL  16   1.739   8.986   0.305
   93   3HG2  VAL  16          3HG2      VAL  16   2.552   9.542   1.766
   94    H    PHE  17           H        PHE  17   1.458   6.505   5.505
   95    HA   PHE  17           HA       PHE  17  -1.121   5.145   5.392
   96   1HB   PHE  17          1HB       PHE  17   0.980   5.261   7.560
   97   2HB   PHE  17          2HB       PHE  17  -0.546   4.410   7.699
   98    HD1  PHE  17           1HD      PHE  17  -0.935   2.831   5.452
   99    HD2  PHE  17           2HD      PHE  17   2.753   3.922   7.250
  100    HE1  PHE  17           1HE      PHE  17   0.117   0.828   4.502
  101    HE2  PHE  17           2HE      PHE  17   3.824   1.927   6.307
  102    HZ   PHE  17           HZ       PHE  17   2.514   0.344   4.913
  103    HA   PRO  18           HA       PRO  18  -2.667   4.636   6.430
  104   1HB   PRO  18          1HB       PRO  18  -5.337   5.460   6.681
  105   2HB   PRO  18          2HB       PRO  18  -4.381   4.619   7.897
  106   1HG   PRO  18          1HG       PRO  18  -5.355   7.257   8.068
  107   2HG   PRO  18          2HG       PRO  18  -4.174   6.500   9.149
  108   1HD   PRO  18          1HD       PRO  18  -3.734   8.352   6.855
  109   2HD   PRO  18          2HD       PRO  18  -2.790   8.153   8.347
  110    H    PHE  19           H        PHE  19  -2.914   4.003   4.388
  111    HA   PHE  19           HA       PHE  19  -3.933   5.963   2.468
  112   1HB   PHE  19          1HB       PHE  19  -3.156   4.506   0.695
  113   2HB   PHE  19          2HB       PHE  19  -1.852   4.838   1.826
  114    HD1  PHE  19           1HD      PHE  19  -1.442   3.013   3.636
  115    HD2  PHE  19           2HD      PHE  19  -3.573   2.361   0.022
  116    HE1  PHE  19           1HE      PHE  19  -1.006   0.601   3.818
  117    HE2  PHE  19           2HE      PHE  19  -3.140  -0.051   0.191
  118    HZ   PHE  19           HZ       PHE  19  -1.852  -0.934   2.091
  119    H    THR  20           H        THR  20  -5.898   5.862   1.684
  120    HA   THR  20           HA       THR  20  -7.588   3.705   2.637
  121    HB   THR  20           HB       THR  20  -8.384   6.195   1.110
  122    HG1  THR  20           1HG      THR  20  -7.208   6.263   3.337
  123   1HG2  THR  20          1HG2      THR  20 -10.458   5.841   2.619
  124   2HG2  THR  20          2HG2      THR  20 -10.285   4.917   1.128
  125   3HG2  THR  20          3HG2      THR  20  -9.903   4.168   2.678
  126    H    PHE  21           H        PHE  21  -8.122   2.049   1.534
  127    HA   PHE  21           HA       PHE  21  -8.278   2.194  -1.401
  128   1HB   PHE  21          1HB       PHE  21  -6.245   0.935  -0.443
  129   2HB   PHE  21          2HB       PHE  21  -7.398  -0.227   0.154
  130    HD1  PHE  21           1HD      PHE  21  -8.172   1.282  -3.067
  131    HD2  PHE  21           2HD      PHE  21  -6.212  -1.922  -1.089
  132    HE1  PHE  21           1HE      PHE  21  -8.022   0.048  -5.181
  133    HE2  PHE  21           2HE      PHE  21  -6.064  -3.163  -3.180
  134    HZ   PHE  21           HZ       PHE  21  -6.959  -2.174  -5.260
  135    H    LEU  22           H        LEU  22 -10.041   1.053  -2.240
  136    HA   LEU  22           HA       LEU  22 -12.201   0.497  -2.312
  137   1HB   LEU  22          1HB       LEU  22 -10.882  -1.439  -0.514
  138   2HB   LEU  22          2HB       LEU  22 -12.459  -1.751  -1.222
  139    HG   LEU  22           HG       LEU  22 -11.354  -2.627  -2.957
  140   1HD1  LEU  22          1HD1      LEU  22 -11.126   0.074  -3.451
  141   2HD1  LEU  22          2HD1      LEU  22  -9.618  -0.702  -3.937
  142   3HD1  LEU  22          3HD1      LEU  22 -11.149  -1.263  -4.603
  143   1HD2  LEU  22          1HD2      LEU  22  -9.303  -2.208  -1.117
  144   2HD2  LEU  22          2HD2      LEU  22  -9.510  -3.512  -2.288
  145   3HD2  LEU  22          3HD2      LEU  22  -8.691  -2.021  -2.756
  146    H    GLY  23           H        GLY  23 -11.754   2.538  -0.350
  147   1HA   GLY  23          1HA       GLY  23 -13.285   3.633   1.027
  148   2HA   GLY  23          2HA       GLY  23 -14.160   2.126   1.221
  149    H    ASN  24           H        ASN  24 -11.093   1.197   1.923
  150    HA   ASN  24           HA       ASN  24 -11.522   1.785   4.773
  151   1HB   ASN  24          1HB       ASN  24  -9.990  -0.468   3.474
  152   2HB   ASN  24          2HB       ASN  24 -10.254  -0.254   5.198
  153   1HD2  ASN  24          1HD2      ASN  24 -12.905  -2.194   2.991
  154   2HD2  ASN  24          2HD2      ASN  24 -11.308  -1.783   2.489
  155    H    LYS  25           H        LYS  25  -9.997   2.827   5.917
  156    HA   LYS  25           HA       LYS  25  -7.705   3.888   4.550
  157   1HB   LYS  25          1HB       LYS  25  -8.654   4.199   7.405
  158   2HB   LYS  25          2HB       LYS  25  -7.493   5.200   6.577
  159   1HG   LYS  25          1HG       LYS  25  -9.159   6.036   5.065
  160   2HG   LYS  25          2HG       LYS  25 -10.347   4.915   5.730
  161   1HD   LYS  25          1HD       LYS  25 -10.750   7.102   6.631
  162   2HD   LYS  25          2HD       LYS  25 -10.131   6.069   7.919
  163   1HE   LYS  25          1HE       LYS  25  -7.964   7.056   7.761
  164   2HE   LYS  25          2HE       LYS  25  -8.412   7.938   6.302
  165   1HZ   LYS  25          1HZ       LYS  25 -10.196   8.533   8.432
  166   2HZ   LYS  25          2HZ       LYS  25  -8.588   8.840   8.899
  167   3HZ   LYS  25          3HZ       LYS  25  -9.233   9.580   7.510
  168    H    TYR  26           H        TYR  26  -5.804   2.770   4.514
  169    HA   TYR  26           HA       TYR  26  -5.448   0.689   6.524
  170   1HB   TYR  26          1HB       TYR  26  -3.885   1.145   3.991
  171   2HB   TYR  26          2HB       TYR  26  -3.817  -0.268   5.034
  172    HD1  TYR  26           1HD      TYR  26  -6.883  -0.386   5.508
  173    HD2  TYR  26           2HD      TYR  26  -4.502   0.002   2.013
  174    HE1  TYR  26           1HE      TYR  26  -8.625  -1.494   4.197
  175    HE2  TYR  26           2HE      TYR  26  -6.234  -1.099   0.705
  176    HH   TYR  26           HH       TYR  26  -9.064  -1.300   1.217
  177    H    GLU  27           H        GLU  27  -4.407   1.175   8.197
  178    HA   GLU  27           HA       GLU  27  -2.462   3.301   8.319
  179   1HB   GLU  27          1HB       GLU  27  -3.442   1.353  10.393
  180   2HB   GLU  27          2HB       GLU  27  -2.427   2.742  10.705
  181   1HG   GLU  27          1HG       GLU  27  -4.146   4.248  10.299
  182   2HG   GLU  27          2HG       GLU  27  -5.094   3.067   9.393
  183    H    SER  28           H        SER  28  -2.487  -0.039   7.801
  184    HA   SER  28           HA       SER  28   0.422  -0.139   8.012
  185   1HB   SER  28          1HB       SER  28   0.001  -2.609   8.637
  186   2HB   SER  28          2HB       SER  28  -0.258  -1.406   9.896
  187    HG   SER  28           HG       SER  28  -2.376  -1.716   9.802
  188    H    CYS  29           H        CYS  29   0.889  -2.558   6.829
  189    HA   CYS  29           HA       CYS  29   0.306  -2.040   4.116
  190   1HB   CYS  29          1HB       CYS  29   1.258  -4.596   5.405
  191   2HB   CYS  29          2HB       CYS  29   1.243  -4.285   3.686
  192    H    THR  30           H        THR  30  -0.714  -3.644   2.692
  193    HA   THR  30           HA       THR  30  -2.960  -5.083   3.867
  194    HB   THR  30           HB       THR  30  -3.815  -2.772   3.296
  195    HG1  THR  30           1HG      THR  30  -5.398  -4.224   3.172
  196   1HG2  THR  30          1HG2      THR  30  -3.939  -3.210   0.452
  197   2HG2  THR  30          2HG2      THR  30  -3.410  -1.787   1.350
  198   3HG2  THR  30          3HG2      THR  30  -2.268  -3.085   0.999
  199    H    SER  31           H        SER  31  -4.121  -6.255   2.059
  200    HA   SER  31           HA       SER  31  -2.283  -6.990  -0.098
  201   1HB   SER  31          1HB       SER  31  -3.120  -9.379   0.199
  202   2HB   SER  31          2HB       SER  31  -2.040  -8.776   1.471
  203    HG   SER  31           HG       SER  31  -3.832  -9.830   2.390
  204    H    ALA  32           H        ALA  32  -4.658  -5.276   0.436
  205    HA   ALA  32           HA       ALA  32  -6.981  -6.256  -0.800
  206   1HB   ALA  32          1HB       ALA  32  -6.450  -4.014   0.557
  207   2HB   ALA  32          2HB       ALA  32  -6.270  -3.375  -1.077
  208   3HB   ALA  32          3HB       ALA  32  -7.795  -4.109  -0.587
  209    H    GLY  33           H        GLY  33  -7.678  -6.318  -2.871
  210   1HA   GLY  33          1HA       GLY  33  -7.637  -6.085  -5.167
  211   2HA   GLY  33          2HA       GLY  33  -6.330  -4.921  -4.984
  212    H    ARG  34           H        ARG  34  -5.305  -7.486  -3.267
  213    HA   ARG  34           HA       ARG  34  -3.954  -8.660  -5.598
  214   1HB   ARG  34          1HB       ARG  34  -2.965  -8.383  -2.750
  215   2HB   ARG  34          2HB       ARG  34  -2.131  -9.236  -4.023
  216   1HG   ARG  34          1HG       ARG  34  -2.420  -6.836  -5.196
  217   2HG   ARG  34          2HG       ARG  34  -2.317  -6.363  -3.501
  218   1HD   ARG  34          1HD       ARG  34  -0.099  -6.445  -4.606
  219   2HD   ARG  34          2HD       ARG  34  -0.227  -7.550  -3.233
  220    HE   ARG  34           HE       ARG  34   0.024  -9.319  -4.653
  221   1HH1  ARG  34          1HH1      ARG  34  -0.705  -6.467  -6.560
  222   2HH1  ARG  34          2HH1      ARG  34  -0.429  -7.260  -8.083
  223   1HH2  ARG  34          1HH2      ARG  34   0.365 -10.363  -6.628
  224   2HH2  ARG  34          2HH2      ARG  34   0.142  -9.491  -8.115
  225    H    SER  35           H        SER  35  -4.091  -9.729  -2.246
  226    HA   SER  35           HA       SER  35  -4.629 -11.703  -1.279
  227   1HB   SER  35          1HB       SER  35  -6.748 -11.897  -3.441
  228   2HB   SER  35          2HB       SER  35  -6.744 -12.719  -1.882
  229    HG   SER  35           HG       SER  35  -7.279 -10.897  -0.884
  230    H    ASP  36           H        ASP  36  -2.615 -11.653  -3.323
  231    HA   ASP  36           HA       ASP  36  -2.830 -14.346  -4.461
  232   1HB   ASP  36          1HB       ASP  36  -1.660 -13.601  -6.293
  233   2HB   ASP  36          2HB       ASP  36  -2.481 -12.133  -5.822
  234    H    GLY  37           H        GLY  37  -1.040 -12.224  -2.468
  235   1HA   GLY  37          1HA       GLY  37   0.153 -13.964  -0.807
  236   2HA   GLY  37          2HA       GLY  37   1.233 -14.006  -2.190
  237    H    LYS  38           H        LYS  38   1.880 -11.706  -2.962
  238    HA   LYS  38           HA       LYS  38   3.311 -10.509  -0.867
  239   1HB   LYS  38          1HB       LYS  38   2.713  -9.201  -3.512
  240   2HB   LYS  38          2HB       LYS  38   4.141  -9.009  -2.502
  241   1HG   LYS  38          1HG       LYS  38   4.967 -10.377  -4.114
  242   2HG   LYS  38          2HG       LYS  38   4.426 -11.579  -2.958
  243   1HD   LYS  38          1HD       LYS  38   2.310 -11.777  -4.251
  244   2HD   LYS  38          2HD       LYS  38   2.984 -10.661  -5.442
  245   1HE   LYS  38          1HE       LYS  38   4.747 -12.194  -5.969
  246   2HE   LYS  38          2HE       LYS  38   4.279 -13.262  -4.647
  247   1HZ   LYS  38          1HZ       LYS  38   2.069 -12.825  -6.347
  248   2HZ   LYS  38          2HZ       LYS  38   3.401 -13.350  -7.268
  249   3HZ   LYS  38          3HZ       LYS  38   2.846 -14.282  -5.960
  250    H    MET  39           H        MET  39   2.947  -8.765   0.380
  251    HA   MET  39           HA       MET  39   0.334  -7.476   0.140
  252   1HB   MET  39          1HB       MET  39   2.353  -7.494   2.393
  253   2HB   MET  39          2HB       MET  39   0.831  -6.631   2.413
  254   1HG   MET  39          1HG       MET  39  -0.296  -8.867   2.042
  255   2HG   MET  39          2HG       MET  39   1.270  -9.590   2.406
  256   1HE   MET  39          1HE       MET  39   0.171 -10.982   4.330
  257   2HE   MET  39          2HE       MET  39  -0.735 -10.289   5.673
  258   3HE   MET  39          3HE       MET  39  -1.412 -10.257   4.044
  259    H    TRP  40           H        TRP  40   0.235  -5.129   0.258
  260    HA   TRP  40           HA       TRP  40   2.759  -3.808  -0.447
  261   1HB   TRP  40          1HB       TRP  40   1.592  -2.570  -2.244
  262   2HB   TRP  40          2HB       TRP  40   1.632  -4.306  -2.550
  263    HD1  TRP  40           HD1      TRP  40  -0.809  -5.621  -1.843
  264    HE1  TRP  40           1HE      TRP  40  -3.204  -4.741  -2.149
  265    HE3  TRP  40           3HE      TRP  40   0.211  -0.646  -2.334
  266    HZ2  TRP  40           2HZ      TRP  40  -4.484  -2.276  -2.500
  267    HZ3  TRP  40           3HZ      TRP  40  -1.666   0.913  -2.617
  268    HH2  TRP  40           HH2      TRP  40  -3.967   0.111  -2.709
  269    H    CYS  41           H        CYS  41   2.016  -1.345  -0.913
  270    HA   CYS  41           HA       CYS  41   0.208  -0.267   1.080
  271   1HB   CYS  41          1HB       CYS  41   2.030   1.197   2.023
  272   2HB   CYS  41          2HB       CYS  41   2.204  -0.508   2.437
  273    H    ALA  42           H        ALA  42  -0.468   1.851   0.455
  274    HA   ALA  42           HA       ALA  42   0.238   2.537  -2.271
  275   1HB   ALA  42          1HB       ALA  42  -2.100   2.743  -1.374
  276   2HB   ALA  42          2HB       ALA  42  -1.538   4.124  -0.429
  277   3HB   ALA  42          3HB       ALA  42  -1.478   4.177  -2.191
  278    H    THR  43           H        THR  43   0.921   4.683  -2.887
  279    HA   THR  43           HA       THR  43   2.762   5.798  -0.890
  280    HB   THR  43           HB       THR  43   4.088   6.582  -2.786
  281    HG1  THR  43           1HG      THR  43   2.524   6.902  -4.348
  282   1HG2  THR  43          1HG2      THR  43   4.287   4.172  -3.930
  283   2HG2  THR  43          2HG2      THR  43   4.952   4.548  -2.339
  284   3HG2  THR  43          3HG2      THR  43   3.391   3.738  -2.473
  285    H    THR  44           H        THR  44  -0.155   6.311  -1.547
  286    HA   THR  44           HA       THR  44   0.018   9.221  -1.443
  287    HB   THR  44           HB       THR  44  -2.128   9.274  -2.839
  288    HG1  THR  44           1HG      THR  44  -2.850   7.478  -3.613
  289   1HG2  THR  44          1HG2      THR  44  -0.887   8.845  -5.042
  290   2HG2  THR  44          2HG2      THR  44  -0.303  10.128  -3.980
  291   3HG2  THR  44          3HG2      THR  44   0.527   8.571  -4.023
  292    H    ALA  45           H        ALA  45  -1.650  10.163  -0.174
  293    HA   ALA  45           HA       ALA  45  -2.469   8.692   2.047
  294   1HB   ALA  45          1HB       ALA  45  -3.127  11.350   0.947
  295   2HB   ALA  45          2HB       ALA  45  -4.277  10.672   2.099
  296   3HB   ALA  45          3HB       ALA  45  -2.590  10.891   2.564
  297    H    ASN  46           H        ASN  46  -4.220   9.459  -0.916
  298    HA   ASN  46           HA       ASN  46  -6.275   7.516  -0.114
  299   1HB   ASN  46          1HB       ASN  46  -7.091   9.886  -0.366
  300   2HB   ASN  46          2HB       ASN  46  -6.652   9.795  -2.073
  301   1HD2  ASN  46          1HD2      ASN  46 -10.103   8.325  -0.742
  302   2HD2  ASN  46          2HD2      ASN  46  -8.991   9.192   0.252
  303    H    TYR  47           H        TYR  47  -5.698   5.674  -1.060
  304    HA   TYR  47           HA       TYR  47  -4.308   5.587  -3.558
  305   1HB   TYR  47          1HB       TYR  47  -3.980   3.892  -1.766
  306   2HB   TYR  47          2HB       TYR  47  -5.617   3.308  -2.061
  307    HD1  TYR  47           1HD      TYR  47  -2.374   3.882  -3.831
  308    HD2  TYR  47           2HD      TYR  47  -5.964   1.605  -3.618
  309    HE1  TYR  47           1HE      TYR  47  -1.539   2.409  -5.610
  310    HE2  TYR  47           2HE      TYR  47  -5.119   0.126  -5.388
  311    HH   TYR  47           HH       TYR  47  -2.299  -0.337  -6.221
  312    H    ASP  48           H        ASP  48  -7.645   5.310  -2.581
  313    HA   ASP  48           HA       ASP  48  -8.689   3.953  -4.749
  314   1HB   ASP  48          1HB       ASP  48  -9.835   5.940  -2.842
  315   2HB   ASP  48          2HB       ASP  48 -10.789   5.427  -4.228
  316    H    ASP  49           H        ASP  49  -7.841   7.352  -4.490
  317    HA   ASP  49           HA       ASP  49  -8.993   7.908  -7.102
  318   1HB   ASP  49          1HB       ASP  49  -7.794   9.669  -4.973
  319   2HB   ASP  49          2HB       ASP  49  -8.270  10.272  -6.553
  320    H    ASP  50           H        ASP  50  -5.827   8.390  -5.515
  321    HA   ASP  50           HA       ASP  50  -4.593   9.055  -8.020
  322   1HB   ASP  50          1HB       ASP  50  -3.500   8.703  -5.244
  323   2HB   ASP  50          2HB       ASP  50  -2.490   9.111  -6.630
  324    H    ARG  51           H        ARG  51  -5.072   6.133  -6.336
  325    HA   ARG  51           HA       ARG  51  -4.151   4.076  -6.424
  326   1HB   ARG  51          1HB       ARG  51  -4.535   4.726  -9.317
  327   2HB   ARG  51          2HB       ARG  51  -4.476   3.107  -8.624
  328   1HG   ARG  51          1HG       ARG  51  -6.319   4.093  -7.044
  329   2HG   ARG  51          2HG       ARG  51  -6.572   5.197  -8.393
  330   1HD   ARG  51          1HD       ARG  51  -6.319   2.362  -9.065
  331   2HD   ARG  51          2HD       ARG  51  -7.756   2.818  -8.149
  332    HE   ARG  51           HE       ARG  51  -7.521   4.653 -10.214
  333   1HH1  ARG  51          1HH1      ARG  51  -7.892   1.170  -9.981
  334   2HH1  ARG  51          2HH1      ARG  51  -8.889   1.061 -11.398
  335   1HH2  ARG  51          1HH2      ARG  51  -8.795   4.498 -12.094
  336   2HH2  ARG  51          2HH2      ARG  51  -9.386   2.948 -12.607
  337    H    LYS  52           H        LYS  52  -1.977   5.305  -5.776
  338    HA   LYS  52           HA       LYS  52   0.057   4.211  -7.593
  339   1HB   LYS  52          1HB       LYS  52   0.236   6.655  -5.808
  340   2HB   LYS  52          2HB       LYS  52   1.643   5.898  -6.541
  341   1HG   LYS  52          1HG       LYS  52   0.806   6.367  -8.754
  342   2HG   LYS  52          2HG       LYS  52  -0.692   7.000  -8.084
  343   1HD   LYS  52          1HD       LYS  52   0.479   8.945  -8.526
  344   2HD   LYS  52          2HD       LYS  52   0.883   8.669  -6.834
  345   1HE   LYS  52          1HE       LYS  52   2.608   7.739  -9.127
  346   2HE   LYS  52          2HE       LYS  52   2.804   9.304  -8.336
  347   1HZ   LYS  52          1HZ       LYS  52   3.096   8.041  -6.211
  348   2HZ   LYS  52          2HZ       LYS  52   3.153   6.612  -7.125
  349   3HZ   LYS  52          3HZ       LYS  52   4.334   7.810  -7.350
  350    H    TRP  53           H        TRP  53   1.024   2.499  -6.783
  351    HA   TRP  53           HA       TRP  53   1.091   2.202  -3.855
  352   1HB   TRP  53          1HB       TRP  53   0.384  -0.096  -4.132
  353   2HB   TRP  53          2HB       TRP  53  -0.771   0.986  -4.832
  354    HD1  TRP  53           HD1      TRP  53  -0.430   1.275  -7.687
  355    HE1  TRP  53           1HE      TRP  53   0.078  -0.629  -9.346
  356    HE3  TRP  53           3HE      TRP  53   1.299  -2.060  -4.383
  357    HZ2  TRP  53           2HZ      TRP  53   1.102  -3.295  -9.219
  358    HZ3  TRP  53           3HZ      TRP  53   2.055  -4.303  -5.172
  359    HH2  TRP  53           HH2      TRP  53   1.953  -4.888  -7.546
  360    H    GLY  54           H        GLY  54   2.278   0.162  -3.258
  361   1HA   GLY  54          1HA       GLY  54   4.531  -0.679  -4.812
  362   2HA   GLY  54          2HA       GLY  54   4.987   0.410  -3.499
  363    H    PHE  55           H        PHE  55   5.493  -2.525  -3.874
  364    HA   PHE  55           HA       PHE  55   3.863  -3.934  -2.037
  365   1HB   PHE  55          1HB       PHE  55   6.511  -4.484  -3.327
  366   2HB   PHE  55          2HB       PHE  55   5.913  -5.531  -2.054
  367    HD1  PHE  55           1HD      PHE  55   2.967  -5.186  -2.933
  368    HD2  PHE  55           2HD      PHE  55   6.540  -6.203  -4.997
  369    HE1  PHE  55           1HE      PHE  55   1.650  -6.510  -4.540
  370    HE2  PHE  55           2HE      PHE  55   5.232  -7.523  -6.615
  371    HZ   PHE  55           HZ       PHE  55   2.788  -7.675  -6.393
  372    H    CYS  56           H        CYS  56   4.582  -4.910  -0.035
  373    HA   CYS  56           HA       CYS  56   6.120  -3.033   1.596
  374   1HB   CYS  56          1HB       CYS  56   4.113  -5.206   2.225
  375   2HB   CYS  56          2HB       CYS  56   5.189  -4.579   3.481
  376    HA   PRO  57           HA       PRO  57   9.643  -5.606   2.119
  377   1HB   PRO  57          1HB       PRO  57  10.006  -6.087   4.739
  378   2HB   PRO  57          2HB       PRO  57  10.298  -4.506   3.997
  379   1HG   PRO  57          1HG       PRO  57   7.826  -5.523   5.319
  380   2HG   PRO  57          2HG       PRO  57   8.702  -4.020   5.685
  381   1HD   PRO  57          1HD       PRO  57   6.547  -3.944   4.151
  382   2HD   PRO  57          2HD       PRO  57   7.994  -3.036   3.643
  383    H    ASP  58           H        ASP  58   6.828  -6.869   2.653
  384    HA   ASP  58           HA       ASP  58   5.879  -8.923   2.614
  385   1HB   ASP  58          1HB       ASP  58   7.291  -9.317   0.733
  386   2HB   ASP  58          2HB       ASP  58   8.671  -9.653   1.765
  387    H    GLN  59           H        GLN  59   5.512 -10.783   3.832
  388    HA   GLN  59           HA       GLN  59   6.464 -10.629   6.517
  389   1HB   GLN  59          1HB       GLN  59   4.682 -12.661   5.155
  390   2HB   GLN  59          2HB       GLN  59   5.014 -12.626   6.881
  391   1HG   GLN  59          1HG       GLN  59   2.894 -11.618   6.481
  392   2HG   GLN  59          2HG       GLN  59   4.028 -10.368   6.968
  393   1HE2  GLN  59          1HE2      GLN  59   3.292  -8.405   4.252
  394   2HE2  GLN  59          2HE2      GLN  59   3.782  -8.556   5.899
  395    H    GLY  60           H        GLY  60   6.984 -12.889   3.828
  396   1HA   GLY  60          1HA       GLY  60   9.525 -13.598   4.209
  397   2HA   GLY  60          2HA       GLY  60   8.740 -14.525   5.480
  Start of MODEL   26
    1    H    SER   1           1H       SER   1  12.413   7.320   0.696
    2    HA   SER   1           HA       SER   1  13.492   7.847   3.380
    3   1HB   SER   1          1HB       SER   1  11.674   6.325   4.112
    4   2HB   SER   1          2HB       SER   1  11.052   7.812   3.402
    5    HG   SER   1           HG       SER   1  10.009   5.819   2.693
    6    H    TRP   2           H        TRP   2  13.763   5.562   4.420
    7    HA   TRP   2           HA       TRP   2  15.583   4.113   2.696
    8   1HB   TRP   2          1HB       TRP   2  16.173   4.579   5.056
    9   2HB   TRP   2          2HB       TRP   2  14.807   3.599   5.582
   10    HD1  TRP   2           HD1      TRP   2  17.914   2.981   3.296
   11    HE1  TRP   2           1HE      TRP   2  18.865   0.663   3.904
   12    HE3  TRP   2           3HE      TRP   2  14.537   1.646   6.891
   13    HZ2  TRP   2           2HZ      TRP   2  18.250  -1.448   5.674
   14    HZ3  TRP   2           3HZ      TRP   2  14.784  -0.543   7.992
   15    HH2  TRP   2           HH2      TRP   2  16.605  -2.056   7.394
   16    H    MET   3           H        MET   3  12.563   3.448   4.430
   17    HA   MET   3           HA       MET   3  12.379   0.812   3.257
   18   1HB   MET   3          1HB       MET   3  10.211   0.718   4.538
   19   2HB   MET   3          2HB       MET   3  11.651   0.928   5.513
   20   1HG   MET   3          1HG       MET   3  11.139   3.177   5.966
   21   2HG   MET   3          2HG       MET   3   9.932   3.246   4.680
   22   1HE   MET   3          1HE       MET   3   8.790   4.527   6.331
   23   2HE   MET   3          2HE       MET   3   7.414   3.792   7.154
   24   3HE   MET   3          3HE       MET   3   8.908   4.099   8.038
   25    H    SER   4           H        SER   4  12.265   1.438   1.037
   26    HA   SER   4           HA       SER   4   9.914   2.926   0.176
   27   1HB   SER   4          1HB       SER   4  12.155   1.688  -1.456
   28   2HB   SER   4          2HB       SER   4  10.911   2.779  -2.066
   29    HG   SER   4           HG       SER   4  13.182   3.539  -1.237
   30    H    THR   5           H        THR   5   8.766   1.957  -1.836
   31    HA   THR   5           HA       THR   5   7.715  -0.580  -0.996
   32    HB   THR   5           HB       THR   5   6.167  -0.188  -2.965
   33    HG1  THR   5           1HG      THR   5   7.724   1.285  -3.976
   34   1HG2  THR   5          1HG2      THR   5   6.081   2.237  -1.268
   35   2HG2  THR   5          2HG2      THR   5   4.774   1.178  -1.806
   36   3HG2  THR   5          3HG2      THR   5   5.857   0.656  -0.516
   37    H    VAL   6           H        VAL   6   6.959  -1.996  -2.859
   38    HA   VAL   6           HA       VAL   6   9.043  -2.573  -4.865
   39    HB   VAL   6           HB       VAL   6   7.734  -4.958  -3.799
   40   1HG1  VAL   6          1HG1      VAL   6  10.549  -4.142  -4.410
   41   2HG1  VAL   6          2HG1      VAL   6  10.161  -5.704  -3.690
   42   3HG1  VAL   6          3HG1      VAL   6   9.511  -5.277  -5.274
   43   1HG2  VAL   6          1HG2      VAL   6   8.192  -3.367  -1.746
   44   2HG2  VAL   6          2HG2      VAL   6   8.495  -5.103  -1.659
   45   3HG2  VAL   6          3HG2      VAL   6   9.832  -3.989  -1.943
   46    H    GLY   7           H        GLY   7   7.746  -4.811  -5.839
   47   1HA   GLY   7          1HA       GLY   7   6.100  -5.337  -7.384
   48   2HA   GLY   7          2HA       GLY   7   5.055  -4.923  -6.061
   49    H    GLY   8           H        GLY   8   4.109  -2.975  -5.950
   50   1HA   GLY   8          1HA       GLY   8   2.718  -1.951  -7.952
   51   2HA   GLY   8          2HA       GLY   8   3.196  -0.968  -6.595
   52    H    ASN   9           H        ASN   9   2.580   0.061  -9.036
   53    HA   ASN   9           HA       ASN   9   4.897   0.529 -10.634
   54   1HB   ASN   9          1HB       ASN   9   3.483   2.160 -11.841
   55   2HB   ASN   9          2HB       ASN   9   2.760   0.572 -11.705
   56   1HD2  ASN   9          1HD2      ASN   9   0.908   2.607  -8.895
   57   2HD2  ASN   9          2HD2      ASN   9   2.471   1.886  -8.765
   58    H    SER  10           H        SER  10   4.075   1.881  -7.658
   59    HA   SER  10           HA       SER  10   4.892   4.556  -8.152
   60   1HB   SER  10          1HB       SER  10   4.930   3.074  -5.519
   61   2HB   SER  10          2HB       SER  10   4.836   4.815  -5.772
   62    HG   SER  10           HG       SER  10   2.774   4.064  -5.379
   63    H    GLY  11           H        GLY  11   6.605   1.612  -7.762
   64   1HA   GLY  11          1HA       GLY  11   8.866   1.204  -7.972
   65   2HA   GLY  11          2HA       GLY  11   9.111   2.932  -8.184
   66    H    GLY  12           H        GLY  12   9.975   4.077  -6.545
   67   1HA   GLY  12          1HA       GLY  12  10.343   2.622  -4.005
   68   2HA   GLY  12          2HA       GLY  12  11.471   3.809  -4.647
   69    H    ALA  13           H        ALA  13   7.928   3.930  -4.241
   70    HA   ALA  13           HA       ALA  13   8.274   6.508  -2.911
   71   1HB   ALA  13          1HB       ALA  13   6.563   5.925  -4.819
   72   2HB   ALA  13          2HB       ALA  13   5.593   5.339  -3.468
   73   3HB   ALA  13          3HB       ALA  13   6.119   7.021  -3.509
   74    HA   PRO  14           HA       PRO  14   7.468   4.761   1.068
   75   1HB   PRO  14          1HB       PRO  14   6.429   7.258   2.061
   76   2HB   PRO  14          2HB       PRO  14   8.025   6.562   2.323
   77   1HG   PRO  14          1HG       PRO  14   7.537   8.839   0.841
   78   2HG   PRO  14          2HG       PRO  14   8.976   7.817   0.675
   79   1HD   PRO  14          1HD       PRO  14   6.530   7.945  -1.040
   80   2HD   PRO  14          2HD       PRO  14   8.220   7.644  -1.497
   81    H    CYS  15           H        CYS  15   5.763   3.866   2.206
   82    HA   CYS  15           HA       CYS  15   3.149   4.029   1.036
   83   1HB   CYS  15          1HB       CYS  15   3.717   2.889   3.773
   84   2HB   CYS  15          2HB       CYS  15   2.476   2.406   2.629
   85    H    VAL  16           H        VAL  16   1.743   5.665   1.417
   86    HA   VAL  16           HA       VAL  16   2.134   7.425   3.680
   87    HB   VAL  16           HB       VAL  16   0.018   7.492   1.519
   88   1HG1  VAL  16          1HG1      VAL  16   0.764   9.536   3.607
   89   2HG1  VAL  16          2HG1      VAL  16  -0.322   9.831   2.251
   90   3HG1  VAL  16          3HG1      VAL  16  -0.761   8.656   3.490
   91   1HG2  VAL  16          1HG2      VAL  16   2.770   8.133   1.440
   92   2HG2  VAL  16          2HG2      VAL  16   1.550   8.410   0.197
   93   3HG2  VAL  16          3HG2      VAL  16   1.877   9.652   1.407
   94    H    PHE  17           H        PHE  17   1.410   6.747   5.622
   95    HA   PHE  17           HA       PHE  17  -1.145   5.318   5.722
   96   1HB   PHE  17          1HB       PHE  17   1.156   5.422   7.674
   97   2HB   PHE  17          2HB       PHE  17  -0.392   4.692   8.045
   98    HD1  PHE  17           1HD      PHE  17  -1.180   2.994   6.039
   99    HD2  PHE  17           2HD      PHE  17   2.800   3.988   7.144
  100    HE1  PHE  17           1HE      PHE  17  -0.386   0.880   5.077
  101    HE2  PHE  17           2HE      PHE  17   3.615   1.878   6.182
  102    HZ   PHE  17           HZ       PHE  17   2.027   0.294   5.136
  103    HA   PRO  18           HA       PRO  18  -2.663   4.851   6.902
  104   1HB   PRO  18          1HB       PRO  18  -5.301   5.880   7.188
  105   2HB   PRO  18          2HB       PRO  18  -4.399   4.909   8.353
  106   1HG   PRO  18          1HG       PRO  18  -5.151   7.565   8.702
  107   2HG   PRO  18          2HG       PRO  18  -3.891   6.730   9.623
  108   1HD   PRO  18          1HD       PRO  18  -3.622   8.598   7.301
  109   2HD   PRO  18          2HD       PRO  18  -2.577   8.407   8.728
  110    H    PHE  19           H        PHE  19  -3.168   4.085   4.901
  111    HA   PHE  19           HA       PHE  19  -4.123   6.066   2.944
  112   1HB   PHE  19          1HB       PHE  19  -3.210   4.688   1.195
  113   2HB   PHE  19          2HB       PHE  19  -1.970   4.912   2.416
  114    HD1  PHE  19           1HD      PHE  19  -4.454   2.492   1.108
  115    HD2  PHE  19           2HD      PHE  19  -0.942   3.072   3.434
  116    HE1  PHE  19           1HE      PHE  19  -4.095   0.062   1.171
  117    HE2  PHE  19           2HE      PHE  19  -0.588   0.639   3.512
  118    HZ   PHE  19           HZ       PHE  19  -2.169  -0.868   2.372
  119    H    THR  20           H        THR  20  -6.032   5.765   1.900
  120    HA   THR  20           HA       THR  20  -7.632   3.547   2.945
  121    HB   THR  20           HB       THR  20  -8.456   6.099   1.516
  122    HG1  THR  20           1HG      THR  20  -8.911   6.885   3.480
  123   1HG2  THR  20          1HG2      THR  20 -10.721   5.503   2.546
  124   2HG2  THR  20          2HG2      THR  20 -10.226   4.677   1.067
  125   3HG2  THR  20          3HG2      THR  20 -10.089   3.858   2.623
  126    H    PHE  21           H        PHE  21  -8.005   1.842   1.760
  127    HA   PHE  21           HA       PHE  21  -7.742   2.066  -1.171
  128   1HB   PHE  21          1HB       PHE  21  -6.125   0.459  -0.095
  129   2HB   PHE  21          2HB       PHE  21  -7.496  -0.428   0.524
  130    HD1  PHE  21           1HD      PHE  21  -5.799   0.567  -2.596
  131    HD2  PHE  21           2HD      PHE  21  -8.675  -2.014  -0.828
  132    HE1  PHE  21           1HE      PHE  21  -5.795  -0.801  -4.622
  133    HE2  PHE  21           2HE      PHE  21  -8.679  -3.377  -2.860
  134    HZ   PHE  21           HZ       PHE  21  -7.249  -2.790  -4.765
  135    H    LEU  22           H        LEU  22  -9.424   1.591  -2.337
  136    HA   LEU  22           HA       LEU  22 -11.621   1.452  -2.807
  137   1HB   LEU  22          1HB       LEU  22 -10.390  -1.073  -1.945
  138   2HB   LEU  22          2HB       LEU  22 -12.040  -1.096  -2.528
  139    HG   LEU  22           HG       LEU  22 -10.326  -1.606  -4.259
  140   1HD1  LEU  22          1HD1      LEU  22 -12.541   0.089  -4.305
  141   2HD1  LEU  22          2HD1      LEU  22 -11.332   0.730  -5.420
  142   3HD1  LEU  22          3HD1      LEU  22 -11.907  -0.929  -5.596
  143   1HD2  LEU  22          1HD2      LEU  22  -8.645   0.041  -3.488
  144   2HD2  LEU  22          2HD2      LEU  22  -9.010   0.109  -5.211
  145   3HD2  LEU  22          3HD2      LEU  22  -9.700   1.311  -4.117
  146    H    GLY  23           H        GLY  23 -11.576   2.674  -0.409
  147   1HA   GLY  23          1HA       GLY  23 -13.510   3.272   0.843
  148   2HA   GLY  23          2HA       GLY  23 -14.032   1.606   0.787
  149    H    ASN  24           H        ASN  24 -11.071   0.911   1.822
  150    HA   ASN  24           HA       ASN  24 -11.835   1.455   4.619
  151   1HB   ASN  24          1HB       ASN  24  -9.974  -0.670   3.555
  152   2HB   ASN  24          2HB       ASN  24 -10.568  -0.523   5.199
  153   1HD2  ASN  24          1HD2      ASN  24 -12.570  -2.645   2.544
  154   2HD2  ASN  24          2HD2      ASN  24 -10.946  -2.086   2.364
  155    H    LYS  25           H        LYS  25 -10.298   2.208   6.113
  156    HA   LYS  25           HA       LYS  25  -8.041   3.612   4.986
  157   1HB   LYS  25          1HB       LYS  25  -9.041   3.450   7.829
  158   2HB   LYS  25          2HB       LYS  25  -8.010   4.669   7.129
  159   1HG   LYS  25          1HG       LYS  25  -9.715   5.699   5.975
  160   2HG   LYS  25          2HG       LYS  25 -10.722   4.248   6.001
  161   1HD   LYS  25          1HD       LYS  25 -10.052   5.965   8.382
  162   2HD   LYS  25          2HD       LYS  25 -11.572   5.993   7.483
  163   1HE   LYS  25          1HE       LYS  25 -11.978   3.664   8.082
  164   2HE   LYS  25          2HE       LYS  25 -10.453   3.619   8.971
  165   1HZ   LYS  25          1HZ       LYS  25 -11.334   5.398  10.413
  166   2HZ   LYS  25          2HZ       LYS  25 -12.830   5.293   9.610
  167   3HZ   LYS  25          3HZ       LYS  25 -12.246   3.971  10.498
  168    H    TYR  26           H        TYR  26  -6.003   2.769   5.054
  169    HA   TYR  26           HA       TYR  26  -5.562   0.470   6.823
  170   1HB   TYR  26          1HB       TYR  26  -4.163   1.162   4.236
  171   2HB   TYR  26          2HB       TYR  26  -3.854  -0.251   5.231
  172    HD1  TYR  26           1HD      TYR  26  -6.503   1.422   3.236
  173    HD2  TYR  26           2HD      TYR  26  -5.076  -2.205   4.908
  174    HE1  TYR  26           1HE      TYR  26  -8.218   0.192   2.011
  175    HE2  TYR  26           2HE      TYR  26  -6.793  -3.452   3.678
  176    HH   TYR  26           HH       TYR  26  -8.610  -3.320   2.401
  177    H    GLU  27           H        GLU  27  -4.393   0.856   8.461
  178    HA   GLU  27           HA       GLU  27  -2.556   3.105   8.574
  179   1HB   GLU  27          1HB       GLU  27  -3.246   1.109  10.714
  180   2HB   GLU  27          2HB       GLU  27  -2.533   2.683  10.924
  181   1HG   GLU  27          1HG       GLU  27  -4.556   3.787  10.336
  182   2HG   GLU  27          2HG       GLU  27  -5.297   2.261   9.852
  183    H    SER  28           H        SER  28  -2.608  -0.275   8.194
  184    HA   SER  28           HA       SER  28   0.318  -0.387   8.339
  185   1HB   SER  28          1HB       SER  28  -0.182  -2.898   8.829
  186   2HB   SER  28          2HB       SER  28  -0.365  -1.743  10.147
  187    HG   SER  28           HG       SER  28  -2.488  -1.997  10.100
  188    H    CYS  29           H        CYS  29   0.861  -2.673   7.049
  189    HA   CYS  29           HA       CYS  29   0.279  -2.065   4.361
  190   1HB   CYS  29          1HB       CYS  29   1.371  -4.606   5.571
  191   2HB   CYS  29          2HB       CYS  29   1.294  -4.276   3.855
  192    H    THR  30           H        THR  30  -0.602  -3.766   2.856
  193    HA   THR  30           HA       THR  30  -2.801  -5.310   3.973
  194    HB   THR  30           HB       THR  30  -3.794  -3.046   3.488
  195    HG1  THR  30           1HG      THR  30  -5.217  -4.696   3.234
  196   1HG2  THR  30          1HG2      THR  30  -3.446  -3.543   0.569
  197   2HG2  THR  30          2HG2      THR  30  -3.787  -2.044   1.430
  198   3HG2  THR  30          3HG2      THR  30  -2.164  -2.733   1.467
  199    H    SER  31           H        SER  31  -3.960  -6.357   2.021
  200    HA   SER  31           HA       SER  31  -2.148  -6.941  -0.178
  201   1HB   SER  31          1HB       SER  31  -2.665  -9.402   0.091
  202   2HB   SER  31          2HB       SER  31  -1.635  -8.724   1.366
  203    HG   SER  31           HG       SER  31  -3.692 -10.109   1.836
  204    H    ALA  32           H        ALA  32  -4.487  -5.392   0.444
  205    HA   ALA  32           HA       ALA  32  -6.883  -6.489  -0.490
  206   1HB   ALA  32          1HB       ALA  32  -5.980  -4.031   0.558
  207   2HB   ALA  32          2HB       ALA  32  -6.726  -3.653  -0.997
  208   3HB   ALA  32          3HB       ALA  32  -7.647  -4.512   0.239
  209    H    GLY  33           H        GLY  33  -7.869  -6.577  -2.417
  210   1HA   GLY  33          1HA       GLY  33  -8.199  -6.354  -4.685
  211   2HA   GLY  33          2HA       GLY  33  -6.879  -5.196  -4.723
  212    H    ARG  34           H        ARG  34  -5.516  -7.718  -3.217
  213    HA   ARG  34           HA       ARG  34  -4.386  -8.667  -5.732
  214   1HB   ARG  34          1HB       ARG  34  -3.418  -9.255  -2.939
  215   2HB   ARG  34          2HB       ARG  34  -2.559  -9.502  -4.439
  216   1HG   ARG  34          1HG       ARG  34  -2.975  -6.877  -4.644
  217   2HG   ARG  34          2HG       ARG  34  -2.985  -7.027  -2.889
  218   1HD   ARG  34          1HD       ARG  34  -0.737  -6.544  -3.863
  219   2HD   ARG  34          2HD       ARG  34  -0.803  -8.019  -2.887
  220    HE   ARG  34           HE       ARG  34  -0.259  -9.209  -4.759
  221   1HH1  ARG  34          1HH1      ARG  34  -1.496  -6.090  -5.798
  222   2HH1  ARG  34          2HH1      ARG  34  -1.179  -6.393  -7.482
  223   1HH2  ARG  34          1HH2      ARG  34   0.189  -9.587  -6.944
  224   2HH2  ARG  34          2HH2      ARG  34  -0.152  -8.350  -8.122
  225    H    SER  35           H        SER  35  -4.135 -10.842  -6.229
  226    HA   SER  35           HA       SER  35  -5.936 -12.661  -4.779
  227   1HB   SER  35          1HB       SER  35  -6.077 -13.789  -7.127
  228   2HB   SER  35          2HB       SER  35  -7.036 -12.340  -6.809
  229    HG   SER  35           HG       SER  35  -5.793 -11.199  -8.119
  230    H    ASP  36           H        ASP  36  -2.801 -12.009  -5.255
  231    HA   ASP  36           HA       ASP  36  -1.961 -14.768  -5.635
  232   1HB   ASP  36          1HB       ASP  36   0.362 -13.697  -5.606
  233   2HB   ASP  36          2HB       ASP  36  -0.656 -13.393  -6.991
  234    H    GLY  37           H        GLY  37  -0.587 -12.265  -3.637
  235   1HA   GLY  37          1HA       GLY  37  -1.296 -13.080  -1.139
  236   2HA   GLY  37          2HA       GLY  37   0.039 -14.137  -1.558
  237    H    LYS  38           H        LYS  38   0.865 -11.476  -3.197
  238    HA   LYS  38           HA       LYS  38   2.853 -10.704  -1.325
  239   1HB   LYS  38          1HB       LYS  38   2.055  -8.796  -3.451
  240   2HB   LYS  38          2HB       LYS  38   3.659  -9.318  -2.962
  241   1HG   LYS  38          1HG       LYS  38   1.737 -10.993  -4.542
  242   2HG   LYS  38          2HG       LYS  38   2.996 -10.010  -5.237
  243   1HD   LYS  38          1HD       LYS  38   4.697 -11.295  -4.058
  244   2HD   LYS  38          2HD       LYS  38   3.431 -12.282  -3.313
  245   1HE   LYS  38          1HE       LYS  38   2.751 -13.121  -5.475
  246   2HE   LYS  38          2HE       LYS  38   3.870 -12.029  -6.291
  247   1HZ   LYS  38          1HZ       LYS  38   5.668 -13.257  -4.995
  248   2HZ   LYS  38          2HZ       LYS  38   4.484 -14.440  -4.685
  249   3HZ   LYS  38          3HZ       LYS  38   4.939 -14.078  -6.287
  250    H    MET  39           H        MET  39   2.944  -8.946   0.059
  251    HA   MET  39           HA       MET  39   0.404  -7.560   0.455
  252   1HB   MET  39          1HB       MET  39   2.850  -7.679   2.232
  253   2HB   MET  39          2HB       MET  39   1.339  -6.875   2.611
  254   1HG   MET  39          1HG       MET  39   0.178  -9.033   2.550
  255   2HG   MET  39          2HG       MET  39   1.713  -9.831   2.206
  256   1HE   MET  39          1HE       MET  39   3.722  -9.959   3.889
  257   2HE   MET  39          2HE       MET  39   3.748  -8.204   4.059
  258   3HE   MET  39          3HE       MET  39   3.727  -9.232   5.494
  259    H    TRP  40           H        TRP  40   0.281  -5.329   0.404
  260    HA   TRP  40           HA       TRP  40   2.680  -3.886  -0.471
  261   1HB   TRP  40          1HB       TRP  40   1.372  -2.772  -2.241
  262   2HB   TRP  40          2HB       TRP  40   1.460  -4.512  -2.505
  263    HD1  TRP  40           HD1      TRP  40  -0.874  -5.882  -1.556
  264    HE1  TRP  40           1HE      TRP  40  -3.321  -5.118  -1.775
  265    HE3  TRP  40           3HE      TRP  40  -0.097  -0.918  -2.441
  266    HZ2  TRP  40           2HZ      TRP  40  -4.722  -2.723  -2.217
  267    HZ3  TRP  40           3HZ      TRP  40  -2.042   0.544  -2.717
  268    HH2  TRP  40           HH2      TRP  40  -4.303  -0.342  -2.617
  269    H    CYS  41           H        CYS  41   1.564  -1.472  -0.987
  270    HA   CYS  41           HA       CYS  41  -0.153  -0.557   1.143
  271   1HB   CYS  41          1HB       CYS  41   1.544   1.037   2.051
  272   2HB   CYS  41          2HB       CYS  41   1.961  -0.646   2.373
  273    H    ALA  42           H        ALA  42  -0.912   1.598   0.699
  274    HA   ALA  42           HA       ALA  42  -0.519   2.365  -2.066
  275   1HB   ALA  42          1HB       ALA  42  -2.681   2.581  -0.436
  276   2HB   ALA  42          2HB       ALA  42  -2.014   4.211  -0.337
  277   3HB   ALA  42          3HB       ALA  42  -2.440   3.531  -1.906
  278    H    THR  43           H        THR  43   0.470   4.251  -2.757
  279    HA   THR  43           HA       THR  43   2.277   5.404  -0.764
  280    HB   THR  43           HB       THR  43   3.664   6.033  -2.697
  281    HG1  THR  43           1HG      THR  43   2.602   6.241  -4.513
  282   1HG2  THR  43          1HG2      THR  43   3.889   3.606  -3.652
  283   2HG2  THR  43          2HG2      THR  43   4.300   3.933  -1.968
  284   3HG2  THR  43          3HG2      THR  43   2.745   3.210  -2.371
  285    H    THR  44           H        THR  44  -0.589   6.051  -1.430
  286    HA   THR  44           HA       THR  44  -0.257   8.956  -1.447
  287    HB   THR  44           HB       THR  44  -2.351   9.140  -2.823
  288    HG1  THR  44           1HG      THR  44  -3.408   7.399  -3.258
  289   1HG2  THR  44          1HG2      THR  44  -0.886   7.684  -4.786
  290   2HG2  THR  44          2HG2      THR  44  -1.073   9.426  -4.598
  291   3HG2  THR  44          3HG2      THR  44   0.239   8.585  -3.771
  292    H    ALA  45           H        ALA  45  -1.959  10.059  -0.266
  293    HA   ALA  45           HA       ALA  45  -2.788   8.740   2.067
  294   1HB   ALA  45          1HB       ALA  45  -2.516  11.203   1.801
  295   2HB   ALA  45          2HB       ALA  45  -4.039  11.225   0.911
  296   3HB   ALA  45          3HB       ALA  45  -4.013  10.722   2.601
  297    H    ASN  46           H        ASN  46  -4.482   9.378  -0.957
  298    HA   ASN  46           HA       ASN  46  -6.597   7.542  -0.054
  299   1HB   ASN  46          1HB       ASN  46  -7.456   9.871  -0.240
  300   2HB   ASN  46          2HB       ASN  46  -6.966   9.894  -1.935
  301   1HD2  ASN  46          1HD2      ASN  46 -10.474   8.349  -0.838
  302   2HD2  ASN  46          2HD2      ASN  46  -9.414   9.165   0.250
  303    H    TYR  47           H        TYR  47  -6.243   5.698  -1.066
  304    HA   TYR  47           HA       TYR  47  -4.807   5.561  -3.534
  305   1HB   TYR  47          1HB       TYR  47  -4.725   3.796  -1.745
  306   2HB   TYR  47          2HB       TYR  47  -6.366   3.345  -2.201
  307    HD1  TYR  47           1HD      TYR  47  -6.809   2.217  -4.309
  308    HD2  TYR  47           2HD      TYR  47  -2.851   3.269  -3.186
  309    HE1  TYR  47           1HE      TYR  47  -5.918   0.721  -6.045
  310    HE2  TYR  47           2HE      TYR  47  -1.957   1.780  -4.914
  311    HH   TYR  47           HH       TYR  47  -3.163  -0.505  -6.169
  312    H    ASP  48           H        ASP  48  -8.202   5.352  -2.614
  313    HA   ASP  48           HA       ASP  48  -9.344   4.233  -4.828
  314   1HB   ASP  48          1HB       ASP  48 -10.326   6.491  -3.102
  315   2HB   ASP  48          2HB       ASP  48 -11.316   5.784  -4.370
  316    H    ASP  49           H        ASP  49  -8.209   7.547  -4.506
  317    HA   ASP  49           HA       ASP  49  -9.212   8.273  -7.113
  318   1HB   ASP  49          1HB       ASP  49  -7.798   9.743  -4.929
  319   2HB   ASP  49          2HB       ASP  49  -7.886  10.437  -6.543
  320    H    ASP  50           H        ASP  50  -5.923   8.482  -5.706
  321    HA   ASP  50           HA       ASP  50  -4.752   8.743  -8.305
  322   1HB   ASP  50          1HB       ASP  50  -3.705   8.664  -5.514
  323   2HB   ASP  50          2HB       ASP  50  -2.583   8.461  -6.860
  324    H    ARG  51           H        ARG  51  -5.335   6.020  -6.250
  325    HA   ARG  51           HA       ARG  51  -4.679   3.862  -6.299
  326   1HB   ARG  51          1HB       ARG  51  -5.016   4.306  -9.244
  327   2HB   ARG  51          2HB       ARG  51  -5.212   2.785  -8.377
  328   1HG   ARG  51          1HG       ARG  51  -6.861   4.326  -6.956
  329   2HG   ARG  51          2HG       ARG  51  -6.996   5.127  -8.520
  330   1HD   ARG  51          1HD       ARG  51  -7.243   2.171  -8.301
  331   2HD   ARG  51          2HD       ARG  51  -8.602   3.209  -7.874
  332    HE   ARG  51           HE       ARG  51  -7.565   3.923 -10.415
  333   1HH1  ARG  51          1HH1      ARG  51  -9.501   1.532  -8.775
  334   2HH1  ARG  51          2HH1      ARG  51 -10.431   1.126 -10.179
  335   1HH2  ARG  51          1HH2      ARG  51  -8.757   3.377 -12.279
  336   2HH2  ARG  51          2HH2      ARG  51  -9.993   2.168 -12.182
  337    H    LYS  52           H        LYS  52  -2.436   5.158  -5.855
  338    HA   LYS  52           HA       LYS  52  -0.481   3.915  -7.648
  339   1HB   LYS  52          1HB       LYS  52  -0.249   6.336  -5.853
  340   2HB   LYS  52          2HB       LYS  52   1.155   5.552  -6.569
  341   1HG   LYS  52          1HG       LYS  52   0.681   6.284  -8.665
  342   2HG   LYS  52          2HG       LYS  52  -1.061   6.319  -8.389
  343   1HD   LYS  52          1HD       LYS  52  -0.749   8.326  -6.966
  344   2HD   LYS  52          2HD       LYS  52   0.973   8.303  -7.360
  345   1HE   LYS  52          1HE       LYS  52   0.517   8.700  -9.676
  346   2HE   LYS  52          2HE       LYS  52  -1.214   8.475  -9.439
  347   1HZ   LYS  52          1HZ       LYS  52  -1.154  10.468  -7.969
  348   2HZ   LYS  52          2HZ       LYS  52   0.458  10.726  -8.445
  349   3HZ   LYS  52          3HZ       LYS  52  -0.791  10.789  -9.598
  350    H    TRP  53           H        TRP  53   0.402   2.146  -6.886
  351    HA   TRP  53           HA       TRP  53   0.537   1.802  -3.966
  352   1HB   TRP  53          1HB       TRP  53  -0.243  -0.457  -4.247
  353   2HB   TRP  53          2HB       TRP  53  -1.364   0.632  -4.964
  354    HD1  TRP  53           HD1      TRP  53  -1.031   0.848  -7.841
  355    HE1  TRP  53           1HE      TRP  53  -0.525  -1.113  -9.456
  356    HE3  TRP  53           3HE      TRP  53   0.687  -2.416  -4.438
  357    HZ2  TRP  53           2HZ      TRP  53   0.491  -3.772  -9.241
  358    HZ3  TRP  53           3HZ      TRP  53   1.412  -4.676  -5.169
  359    HH2  TRP  53           HH2      TRP  53   1.314  -5.330  -7.525
  360    H    GLY  54           H        GLY  54   1.768  -0.163  -3.363
  361   1HA   GLY  54          1HA       GLY  54   3.841  -1.170  -5.021
  362   2HA   GLY  54          2HA       GLY  54   4.460   0.071  -3.937
  363    H    PHE  55           H        PHE  55   4.918  -2.899  -4.024
  364    HA   PHE  55           HA       PHE  55   3.613  -4.176  -1.899
  365   1HB   PHE  55          1HB       PHE  55   6.291  -4.594  -3.201
  366   2HB   PHE  55          2HB       PHE  55   5.706  -5.629  -1.917
  367    HD1  PHE  55           1HD      PHE  55   2.824  -4.811  -3.537
  368    HD2  PHE  55           2HD      PHE  55   6.397  -7.033  -4.186
  369    HE1  PHE  55           1HE      PHE  55   1.650  -6.223  -5.184
  370    HE2  PHE  55           2HE      PHE  55   5.229  -8.438  -5.833
  371    HZ   PHE  55           HZ       PHE  55   2.849  -8.027  -6.337
  372    H    CYS  56           H        CYS  56   4.513  -4.805   0.165
  373    HA   CYS  56           HA       CYS  56   5.841  -2.559   1.448
  374   1HB   CYS  56          1HB       CYS  56   4.326  -4.959   2.452
  375   2HB   CYS  56          2HB       CYS  56   5.398  -4.067   3.542
  376    HA   PRO  57           HA       PRO  57   9.813  -4.381   1.584
  377   1HB   PRO  57          1HB       PRO  57  10.883  -3.339   3.787
  378   2HB   PRO  57          2HB       PRO  57  10.496  -2.341   2.376
  379   1HG   PRO  57          1HG       PRO  57   8.837  -2.880   4.792
  380   2HG   PRO  57          2HG       PRO  57   9.300  -1.294   4.139
  381   1HD   PRO  57          1HD       PRO  57   6.912  -2.344   3.598
  382   2HD   PRO  57          2HD       PRO  57   7.840  -1.533   2.310
  383    H    ASP  58           H        ASP  58   7.539  -5.399   3.450
  384    HA   ASP  58           HA       ASP  58   9.129  -7.177   5.146
  385   1HB   ASP  58          1HB       ASP  58   7.195  -5.887   6.116
  386   2HB   ASP  58          2HB       ASP  58   6.128  -6.840   5.092
  387    H    GLN  59           H        GLN  59   9.814  -8.889   3.959
  388    HA   GLN  59           HA       GLN  59   7.790 -10.296   2.332
  389   1HB   GLN  59          1HB       GLN  59  10.794 -10.235   1.974
  390   2HB   GLN  59          2HB       GLN  59   9.675 -11.173   0.998
  391   1HG   GLN  59          1HG       GLN  59   9.655  -8.174   1.213
  392   2HG   GLN  59          2HG       GLN  59  10.434  -9.080  -0.080
  393   1HE2  GLN  59          1HE2      GLN  59   6.618  -8.118  -0.367
  394   2HE2  GLN  59          2HE2      GLN  59   7.746  -7.423   0.740
  395    H    GLY  60           H        GLY  60   8.003 -10.756   5.104
  396   1HA   GLY  60          1HA       GLY  60   8.651 -13.596   5.032
  397   2HA   GLY  60          2HA       GLY  60   9.564 -12.629   6.181
  Start of MODEL   27
    1    H    SER   1           1H       SER   1  10.167   2.114  12.122
    2    HA   SER   1           HA       SER   1  11.551   1.899  10.501
    3   1HB   SER   1          1HB       SER   1   9.522  -0.052   9.382
    4   2HB   SER   1          2HB       SER   1  11.214   0.052   8.901
    5    HG   SER   1           HG       SER   1  10.618  -1.585  10.557
    6    H    TRP   2           H        TRP   2  12.130   2.849   8.576
    7    HA   TRP   2           HA       TRP   2   9.966   3.965   6.911
    8   1HB   TRP   2          1HB       TRP   2  11.076   5.603   8.571
    9   2HB   TRP   2          2HB       TRP   2  12.495   5.492   7.535
   10    HD1  TRP   2           HD1      TRP   2  11.615   5.953   4.713
   11    HE1  TRP   2           1HE      TRP   2  10.293   8.024   3.939
   12    HE3  TRP   2           3HE      TRP   2   9.655   7.403   9.220
   13    HZ2  TRP   2           2HZ      TRP   2   8.626  10.000   5.090
   14    HZ3  TRP   2           3HZ      TRP   2   8.208   9.394   9.294
   15    HH2  TRP   2           HH2      TRP   2   7.708  10.663   7.268
   16    H    MET   3           H        MET   3  10.403   2.213   5.463
   17    HA   MET   3           HA       MET   3  12.964   2.430   4.061
   18   1HB   MET   3          1HB       MET   3  12.569   0.124   3.335
   19   2HB   MET   3          2HB       MET   3  12.618   0.252   5.083
   20   1HG   MET   3          1HG       MET   3  10.081   0.147   3.461
   21   2HG   MET   3          2HG       MET   3  10.859  -1.267   4.165
   22   1HE   MET   3          1HE       MET   3   8.024  -0.755   4.492
   23   2HE   MET   3          2HE       MET   3   8.494  -1.901   5.748
   24   3HE   MET   3          3HE       MET   3   7.523  -0.486   6.162
   25    H    SER   4           H        SER   4  12.789   1.717   1.704
   26    HA   SER   4           HA       SER   4  10.715   3.319   0.460
   27   1HB   SER   4          1HB       SER   4  12.972   1.768  -0.849
   28   2HB   SER   4          2HB       SER   4  11.978   3.017  -1.603
   29    HG   SER   4           HG       SER   4  13.622   4.222  -0.974
   30    H    THR   5           H        THR   5   9.983   2.152  -1.825
   31    HA   THR   5           HA       THR   5   8.684  -0.291  -0.892
   32    HB   THR   5           HB       THR   5   7.278   0.207  -3.054
   33    HG1  THR   5           1HG      THR   5   7.624   2.862  -2.493
   34   1HG2  THR   5          1HG2      THR   5   6.340   2.207  -1.324
   35   2HG2  THR   5          2HG2      THR   5   5.761   0.549  -1.502
   36   3HG2  THR   5          3HG2      THR   5   7.016   0.923  -0.321
   37    H    VAL   6           H        VAL   6   8.030  -1.794  -2.603
   38    HA   VAL   6           HA       VAL   6   9.993  -2.325  -4.684
   39    HB   VAL   6           HB       VAL   6  10.868  -3.870  -3.244
   40   1HG1  VAL   6          1HG1      VAL   6   8.313  -3.566  -1.747
   41   2HG1  VAL   6          2HG1      VAL   6   9.321  -4.975  -1.427
   42   3HG1  VAL   6          3HG1      VAL   6   9.974  -3.355  -1.190
   43   1HG2  VAL   6          1HG2      VAL   6   8.352  -5.298  -4.029
   44   2HG2  VAL   6          2HG2      VAL   6   9.919  -5.360  -4.837
   45   3HG2  VAL   6          3HG2      VAL   6   9.721  -6.078  -3.236
   46    H    GLY   7           H        GLY   7   8.861  -3.995  -6.240
   47   1HA   GLY   7          1HA       GLY   7   6.898  -4.655  -7.353
   48   2HA   GLY   7          2HA       GLY   7   6.076  -4.440  -5.835
   49    H    GLY   8           H        GLY   8   4.275  -3.525  -6.796
   50   1HA   GLY   8          1HA       GLY   8   2.945  -1.836  -7.591
   51   2HA   GLY   8          2HA       GLY   8   4.061  -0.798  -6.735
   52    H    ASN   9           H        ASN   9   3.937   0.859  -8.134
   53    HA   ASN   9           HA       ASN   9   5.351   0.499 -10.679
   54   1HB   ASN   9          1HB       ASN   9   3.706   2.450 -11.455
   55   2HB   ASN   9          2HB       ASN   9   3.307   0.766 -11.678
   56   1HD2  ASN   9          1HD2      ASN   9   1.007   3.112  -9.472
   57   2HD2  ASN   9          2HD2      ASN   9   2.361   3.661 -10.396
   58    H    SER  10           H        SER  10   4.462   2.490  -7.968
   59    HA   SER  10           HA       SER  10   5.566   4.932  -8.631
   60   1HB   SER  10          1HB       SER  10   5.626   3.595  -5.911
   61   2HB   SER  10          2HB       SER  10   5.727   5.324  -6.224
   62    HG   SER  10           HG       SER  10   3.601   4.730  -5.665
   63    H    GLY  11           H        GLY  11   7.162   2.009  -7.455
   64   1HA   GLY  11          1HA       GLY  11   9.410   1.563  -8.242
   65   2HA   GLY  11          2HA       GLY  11   9.735   3.286  -8.119
   66    H    GLY  12           H        GLY  12  10.035   4.217  -6.040
   67   1HA   GLY  12          1HA       GLY  12  10.389   2.294  -3.847
   68   2HA   GLY  12          2HA       GLY  12  11.750   3.298  -4.327
   69    H    ALA  13           H        ALA  13   8.427   4.414  -4.341
   70    HA   ALA  13           HA       ALA  13   9.134   6.598  -2.599
   71   1HB   ALA  13          1HB       ALA  13   7.642   6.923  -4.527
   72   2HB   ALA  13          2HB       ALA  13   6.450   5.871  -3.766
   73   3HB   ALA  13          3HB       ALA  13   6.879   7.406  -3.012
   74    HA   PRO  14           HA       PRO  14   7.993   4.759   1.252
   75   1HB   PRO  14          1HB       PRO  14   7.050   7.439   2.065
   76   2HB   PRO  14          2HB       PRO  14   8.325   6.442   2.764
   77   1HG   PRO  14          1HG       PRO  14   8.871   8.654   1.334
   78   2HG   PRO  14          2HG       PRO  14   9.936   7.233   1.328
   79   1HD   PRO  14          1HD       PRO  14   7.991   8.158  -0.753
   80   2HD   PRO  14          2HD       PRO  14   9.565   7.364  -0.946
   81    H    CYS  15           H        CYS  15   6.178   3.813   2.036
   82    HA   CYS  15           HA       CYS  15   3.664   4.318   0.742
   83   1HB   CYS  15          1HB       CYS  15   4.509   2.450   2.962
   84   2HB   CYS  15          2HB       CYS  15   2.839   2.566   2.414
   85    H    VAL  16           H        VAL  16   2.078   5.649   1.403
   86    HA   VAL  16           HA       VAL  16   2.418   7.145   3.866
   87    HB   VAL  16           HB       VAL  16   0.338   7.402   1.683
   88   1HG1  VAL  16          1HG1      VAL  16  -0.280   8.280   4.001
   89   2HG1  VAL  16          2HG1      VAL  16   0.985   9.484   3.748
   90   3HG1  VAL  16          3HG1      VAL  16  -0.390   9.408   2.649
   91   1HG2  VAL  16          1HG2      VAL  16   2.903   7.906   1.333
   92   2HG2  VAL  16          2HG2      VAL  16   1.654   8.954   0.659
   93   3HG2  VAL  16          3HG2      VAL  16   2.475   9.408   2.153
   94    H    PHE  17           H        PHE  17   1.468   6.582   5.728
   95    HA   PHE  17           HA       PHE  17  -0.947   4.922   5.632
   96   1HB   PHE  17          1HB       PHE  17   1.274   5.007   7.671
   97   2HB   PHE  17          2HB       PHE  17  -0.235   4.151   7.911
   98    HD1  PHE  17           1HD      PHE  17  -0.828   2.587   5.741
   99    HD2  PHE  17           2HD      PHE  17   3.032   3.725   7.101
  100    HE1  PHE  17           1HE      PHE  17   0.143   0.628   4.621
  101    HE2  PHE  17           2HE      PHE  17   4.017   1.775   5.989
  102    HZ   PHE  17           HZ       PHE  17   2.578   0.197   4.724
  103    HA   PRO  18           HA       PRO  18  -2.479   4.330   6.741
  104   1HB   PRO  18          1HB       PRO  18  -5.150   5.195   7.100
  105   2HB   PRO  18          2HB       PRO  18  -4.190   4.222   8.214
  106   1HG   PRO  18          1HG       PRO  18  -5.087   6.824   8.691
  107   2HG   PRO  18          2HG       PRO  18  -3.795   5.997   9.580
  108   1HD   PRO  18          1HD       PRO  18  -3.600   7.993   7.358
  109   2HD   PRO  18          2HD       PRO  18  -2.553   7.775   8.781
  110    H    PHE  19           H        PHE  19  -2.833   3.743   4.683
  111    HA   PHE  19           HA       PHE  19  -3.912   5.775   2.867
  112   1HB   PHE  19          1HB       PHE  19  -3.158   4.425   1.013
  113   2HB   PHE  19          2HB       PHE  19  -1.825   4.678   2.129
  114    HD1  PHE  19           1HD      PHE  19  -1.345   2.764   3.791
  115    HD2  PHE  19           2HD      PHE  19  -3.662   2.307   0.259
  116    HE1  PHE  19           1HE      PHE  19  -0.923   0.336   3.820
  117    HE2  PHE  19           2HE      PHE  19  -3.247  -0.107   0.279
  118    HZ   PHE  19           HZ       PHE  19  -1.870  -1.099   2.063
  119    H    THR  20           H        THR  20  -5.902   5.650   2.106
  120    HA   THR  20           HA       THR  20  -7.500   3.419   3.065
  121    HB   THR  20           HB       THR  20  -8.380   5.978   1.704
  122    HG1  THR  20           1HG      THR  20  -7.676   6.747   3.542
  123   1HG2  THR  20          1HG2      THR  20 -10.490   5.501   3.039
  124   2HG2  THR  20          2HG2      THR  20 -10.224   4.568   1.567
  125   3HG2  THR  20          3HG2      THR  20  -9.902   3.843   3.143
  126    H    PHE  21           H        PHE  21  -8.105   1.816   1.939
  127    HA   PHE  21           HA       PHE  21  -8.350   2.035  -0.997
  128   1HB   PHE  21          1HB       PHE  21  -6.319   0.689  -0.071
  129   2HB   PHE  21          2HB       PHE  21  -7.517  -0.483   0.421
  130    HD1  PHE  21           1HD      PHE  21  -8.451   1.157  -2.638
  131    HD2  PHE  21           2HD      PHE  21  -6.110  -1.980  -0.982
  132    HE1  PHE  21           1HE      PHE  21  -8.351   0.056  -4.824
  133    HE2  PHE  21           2HE      PHE  21  -6.004  -3.078  -3.152
  134    HZ   PHE  21           HZ       PHE  21  -7.110  -2.059  -5.105
  135    H    LEU  22           H        LEU  22 -10.141   0.915  -1.814
  136    HA   LEU  22           HA       LEU  22 -12.307   0.388  -1.833
  137   1HB   LEU  22          1HB       LEU  22 -10.950  -1.635  -0.165
  138   2HB   LEU  22          2HB       LEU  22 -12.538  -1.911  -0.864
  139    HG   LEU  22           HG       LEU  22 -11.430  -2.731  -2.630
  140   1HD1  LEU  22          1HD1      LEU  22 -11.132   0.056  -3.002
  141   2HD1  LEU  22          2HD1      LEU  22  -9.849  -0.869  -3.779
  142   3HD1  LEU  22          3HD1      LEU  22 -11.536  -1.211  -4.164
  143   1HD2  LEU  22          1HD2      LEU  22  -9.443  -2.533  -0.834
  144   2HD2  LEU  22          2HD2      LEU  22  -9.424  -3.455  -2.335
  145   3HD2  LEU  22          3HD2      LEU  22  -8.783  -1.813  -2.306
  146    H    GLY  23           H        GLY  23 -11.718   2.315   0.306
  147   1HA   GLY  23          1HA       GLY  23 -13.254   3.358   1.739
  148   2HA   GLY  23          2HA       GLY  23 -14.151   1.855   1.834
  149    H    ASN  24           H        ASN  24 -11.005   0.983   2.475
  150    HA   ASN  24           HA       ASN  24 -11.470   1.328   5.366
  151   1HB   ASN  24          1HB       ASN  24  -9.918  -0.816   3.900
  152   2HB   ASN  24          2HB       ASN  24 -10.154  -0.725   5.638
  153   1HD2  ASN  24          1HD2      ASN  24 -12.875  -2.444   3.292
  154   2HD2  ASN  24          2HD2      ASN  24 -11.313  -1.940   2.764
  155    H    LYS  25           H        LYS  25  -9.923   2.243   6.615
  156    HA   LYS  25           HA       LYS  25  -7.723   3.585   5.377
  157   1HB   LYS  25          1HB       LYS  25  -8.189   3.236   8.333
  158   2HB   LYS  25          2HB       LYS  25  -7.431   4.557   7.495
  159   1HG   LYS  25          1HG       LYS  25 -10.353   3.929   7.345
  160   2HG   LYS  25          2HG       LYS  25  -9.635   5.145   8.403
  161   1HD   LYS  25          1HD       LYS  25  -8.811   6.363   6.449
  162   2HD   LYS  25          2HD       LYS  25  -9.496   5.133   5.382
  163   1HE   LYS  25          1HE       LYS  25 -10.970   7.031   7.201
  164   2HE   LYS  25          2HE       LYS  25 -10.995   6.991   5.440
  165   1HZ   LYS  25          1HZ       LYS  25 -11.781   4.471   6.237
  166   2HZ   LYS  25          2HZ       LYS  25 -12.581   5.518   7.292
  167   3HZ   LYS  25          3HZ       LYS  25 -12.782   5.695   5.611
  168    H    TYR  26           H        TYR  26  -5.765   2.569   5.011
  169    HA   TYR  26           HA       TYR  26  -5.215   0.215   6.663
  170   1HB   TYR  26          1HB       TYR  26  -3.989   1.035   4.031
  171   2HB   TYR  26          2HB       TYR  26  -3.613  -0.430   4.927
  172    HD1  TYR  26           1HD      TYR  26  -6.672  -0.742   5.759
  173    HD2  TYR  26           2HD      TYR  26  -4.599  -0.268   2.086
  174    HE1  TYR  26           1HE      TYR  26  -8.458  -1.947   4.597
  175    HE2  TYR  26           2HE      TYR  26  -6.375  -1.467   0.918
  176    HH   TYR  26           HH       TYR  26  -9.132  -1.812   1.647
  177    H    GLU  27           H        GLU  27  -4.171   0.712   8.338
  178    HA   GLU  27           HA       GLU  27  -2.232   2.844   8.460
  179   1HB   GLU  27          1HB       GLU  27  -3.207   0.862  10.504
  180   2HB   GLU  27          2HB       GLU  27  -2.142   2.204  10.843
  181   1HG   GLU  27          1HG       GLU  27  -3.839   3.794  10.295
  182   2HG   GLU  27          2HG       GLU  27  -4.898   2.523   9.689
  183    H    SER  28           H        SER  28  -2.247  -0.446   7.780
  184    HA   SER  28           HA       SER  28   0.665  -0.542   7.922
  185   1HB   SER  28          1HB       SER  28   0.352  -3.014   8.466
  186   2HB   SER  28          2HB       SER  28  -0.002  -1.896   9.778
  187    HG   SER  28           HG       SER  28  -1.585  -3.735   8.724
  188    H    CYS  29           H        CYS  29   1.156  -2.830   6.586
  189    HA   CYS  29           HA       CYS  29   0.348  -2.186   3.950
  190   1HB   CYS  29          1HB       CYS  29   1.604  -4.728   4.988
  191   2HB   CYS  29          2HB       CYS  29   1.447  -4.294   3.303
  192    H    THR  30           H        THR  30  -0.703  -3.738   2.506
  193    HA   THR  30           HA       THR  30  -2.777  -5.355   3.799
  194    HB   THR  30           HB       THR  30  -3.715  -3.063   3.309
  195    HG1  THR  30           1HG      THR  30  -5.233  -4.616   3.277
  196   1HG2  THR  30          1HG2      THR  30  -4.193  -3.144   0.599
  197   2HG2  THR  30          2HG2      THR  30  -3.062  -2.072   1.430
  198   3HG2  THR  30          3HG2      THR  30  -2.491  -3.585   0.730
  199    H    SER  31           H        SER  31  -4.078  -6.445   1.950
  200    HA   SER  31           HA       SER  31  -2.287  -7.212  -0.238
  201   1HB   SER  31          1HB       SER  31  -3.267  -9.556   0.026
  202   2HB   SER  31          2HB       SER  31  -2.124  -9.044   1.276
  203    HG   SER  31           HG       SER  31  -4.705  -8.367   1.895
  204    H    ALA  32           H        ALA  32  -4.662  -5.437   0.377
  205    HA   ALA  32           HA       ALA  32  -6.967  -6.372  -0.925
  206   1HB   ALA  32          1HB       ALA  32  -6.074  -3.940   0.301
  207   2HB   ALA  32          2HB       ALA  32  -6.818  -3.559  -1.251
  208   3HB   ALA  32          3HB       ALA  32  -7.727  -4.458  -0.037
  209    H    GLY  33           H        GLY  33  -7.689  -6.248  -2.989
  210   1HA   GLY  33          1HA       GLY  33  -7.653  -5.803  -5.263
  211   2HA   GLY  33          2HA       GLY  33  -6.264  -4.757  -5.001
  212    H    ARG  34           H        ARG  34  -5.195  -7.342  -3.495
  213    HA   ARG  34           HA       ARG  34  -4.026  -8.498  -5.934
  214   1HB   ARG  34          1HB       ARG  34  -3.024  -8.595  -3.085
  215   2HB   ARG  34          2HB       ARG  34  -2.228  -9.297  -4.478
  216   1HG   ARG  34          1HG       ARG  34  -2.456  -6.734  -5.292
  217   2HG   ARG  34          2HG       ARG  34  -2.306  -6.512  -3.546
  218   1HD   ARG  34          1HD       ARG  34  -0.120  -6.496  -4.718
  219   2HD   ARG  34          2HD       ARG  34  -0.244  -7.785  -3.514
  220    HE   ARG  34           HE       ARG  34  -0.096  -9.341  -5.191
  221   1HH1  ARG  34          1HH1      ARG  34  -0.783  -6.211  -6.601
  222   2HH1  ARG  34          2HH1      ARG  34  -0.651  -6.754  -8.241
  223   1HH2  ARG  34          1HH2      ARG  34   0.015 -10.089  -7.382
  224   2HH2  ARG  34          2HH2      ARG  34  -0.185  -8.951  -8.687
  225    H    SER  35           H        SER  35  -4.524  -9.678  -2.627
  226    HA   SER  35           HA       SER  35  -5.377 -11.602  -1.776
  227   1HB   SER  35          1HB       SER  35  -7.415 -10.716  -3.004
  228   2HB   SER  35          2HB       SER  35  -6.997 -11.806  -4.323
  229    HG   SER  35           HG       SER  35  -7.379 -12.687  -1.645
  230    H    ASP  36           H        ASP  36  -2.978 -11.665  -3.383
  231    HA   ASP  36           HA       ASP  36  -3.104 -14.383  -4.435
  232   1HB   ASP  36          1HB       ASP  36  -1.022 -13.777  -5.682
  233   2HB   ASP  36          2HB       ASP  36  -2.456 -12.930  -6.189
  234    H    GLY  37           H        GLY  37  -0.754 -12.219  -3.028
  235   1HA   GLY  37          1HA       GLY  37  -0.201 -13.805  -0.790
  236   2HA   GLY  37          2HA       GLY  37   0.971 -14.179  -2.038
  237    H    LYS  38           H        LYS  38   1.626 -11.830  -3.154
  238    HA   LYS  38           HA       LYS  38   3.282 -10.651  -1.208
  239   1HB   LYS  38          1HB       LYS  38   2.584  -9.631  -3.961
  240   2HB   LYS  38          2HB       LYS  38   4.000  -9.199  -3.008
  241   1HG   LYS  38          1HG       LYS  38   4.848 -10.739  -4.476
  242   2HG   LYS  38          2HG       LYS  38   4.536 -11.731  -3.065
  243   1HD   LYS  38          1HD       LYS  38   3.777 -12.976  -4.905
  244   2HD   LYS  38          2HD       LYS  38   2.315 -12.303  -4.183
  245   1HE   LYS  38          1HE       LYS  38   2.348 -10.488  -5.834
  246   2HE   LYS  38          2HE       LYS  38   3.791 -11.183  -6.566
  247   1HZ   LYS  38          1HZ       LYS  38   2.212 -13.289  -6.696
  248   2HZ   LYS  38          2HZ       LYS  38   1.012 -12.082  -6.702
  249   3HZ   LYS  38          3HZ       LYS  38   2.212 -12.088  -7.903
  250    H    MET  39           H        MET  39   2.557  -9.336   0.358
  251    HA   MET  39           HA       MET  39   0.224  -7.714  -0.034
  252   1HB   MET  39          1HB       MET  39   2.216  -7.709   2.238
  253   2HB   MET  39          2HB       MET  39   0.655  -6.909   2.234
  254   1HG   MET  39          1HG       MET  39  -0.356  -9.212   1.874
  255   2HG   MET  39          2HG       MET  39   1.236  -9.847   2.282
  256   1HE   MET  39          1HE       MET  39   2.438  -8.211   4.098
  257   2HE   MET  39          2HE       MET  39   1.691  -7.796   5.638
  258   3HE   MET  39          3HE       MET  39   2.164  -9.462   5.310
  259    H    TRP  40           H        TRP  40   0.249  -5.367   0.233
  260    HA   TRP  40           HA       TRP  40   2.786  -4.076  -0.511
  261   1HB   TRP  40          1HB       TRP  40   1.626  -2.803  -2.285
  262   2HB   TRP  40          2HB       TRP  40   1.630  -4.534  -2.625
  263    HD1  TRP  40           HD1      TRP  40  -0.818  -5.816  -1.918
  264    HE1  TRP  40           1HE      TRP  40  -3.207  -4.909  -2.160
  265    HE3  TRP  40           3HE      TRP  40   0.241  -0.844  -2.335
  266    HZ2  TRP  40           2HZ      TRP  40  -4.469  -2.428  -2.445
  267    HZ3  TRP  40           3HZ      TRP  40  -1.631   0.733  -2.564
  268    HH2  TRP  40           HH2      TRP  40  -3.937  -0.040  -2.625
  269    H    CYS  41           H        CYS  41   1.935  -1.571  -0.944
  270    HA   CYS  41           HA       CYS  41   0.002  -0.613   0.923
  271   1HB   CYS  41          1HB       CYS  41   1.705   0.869   2.133
  272   2HB   CYS  41          2HB       CYS  41   1.629  -0.819   2.617
  273    H    ALA  42           H        ALA  42  -0.597   1.535   0.431
  274    HA   ALA  42           HA       ALA  42   0.209   2.369  -2.193
  275   1HB   ALA  42          1HB       ALA  42  -1.798   3.295  -0.219
  276   2HB   ALA  42          2HB       ALA  42  -1.268   4.428  -1.466
  277   3HB   ALA  42          3HB       ALA  42  -1.985   2.884  -1.924
  278    H    THR  43           H        THR  43   1.057   4.395  -2.774
  279    HA   THR  43           HA       THR  43   2.936   5.434  -0.780
  280    HB   THR  43           HB       THR  43   4.216   6.245  -2.696
  281    HG1  THR  43           1HG      THR  43   2.907   6.721  -4.314
  282   1HG2  THR  43          1HG2      THR  43   4.444   3.987  -3.951
  283   2HG2  THR  43          2HG2      THR  43   4.892   4.082  -2.247
  284   3HG2  THR  43          3HG2      THR  43   3.338   3.392  -2.716
  285    H    THR  44           H        THR  44  -0.025   5.999  -1.561
  286    HA   THR  44           HA       THR  44   0.177   8.913  -1.299
  287    HB   THR  44           HB       THR  44  -1.936   9.044  -2.687
  288    HG1  THR  44           1HG      THR  44  -2.759   7.292  -3.484
  289   1HG2  THR  44          1HG2      THR  44  -0.867   8.815  -4.863
  290   2HG2  THR  44          2HG2      THR  44   0.183   9.639  -3.710
  291   3HG2  THR  44          3HG2      THR  44   0.475   7.947  -4.116
  292    H    ALA  45           H        ALA  45  -1.611   9.860  -0.111
  293    HA   ALA  45           HA       ALA  45  -2.390   8.398   2.146
  294   1HB   ALA  45          1HB       ALA  45  -3.303  10.995   0.972
  295   2HB   ALA  45          2HB       ALA  45  -4.086  10.322   2.399
  296   3HB   ALA  45          3HB       ALA  45  -2.363  10.699   2.435
  297    H    ASN  46           H        ASN  46  -4.305   9.287  -0.724
  298    HA   ASN  46           HA       ASN  46  -6.255   7.252   0.104
  299   1HB   ASN  46          1HB       ASN  46  -7.208   9.554  -0.076
  300   2HB   ASN  46          2HB       ASN  46  -6.742   9.576  -1.780
  301   1HD2  ASN  46          1HD2      ASN  46 -10.189   7.980  -0.669
  302   2HD2  ASN  46          2HD2      ASN  46  -9.185   8.930   0.361
  303    H    TYR  47           H        TYR  47  -5.807   5.452  -0.906
  304    HA   TYR  47           HA       TYR  47  -4.434   5.401  -3.414
  305   1HB   TYR  47          1HB       TYR  47  -4.023   3.719  -1.647
  306   2HB   TYR  47          2HB       TYR  47  -5.658   3.099  -1.885
  307    HD1  TYR  47           1HD      TYR  47  -2.391   3.593  -3.567
  308    HD2  TYR  47           2HD      TYR  47  -6.127   1.564  -3.608
  309    HE1  TYR  47           1HE      TYR  47  -1.571   2.142  -5.366
  310    HE2  TYR  47           2HE      TYR  47  -5.308   0.111  -5.409
  311    HH   TYR  47           HH       TYR  47  -2.129  -0.180  -6.250
  312    H    ASP  48           H        ASP  48  -7.769   5.051  -2.418
  313    HA   ASP  48           HA       ASP  48  -8.814   3.755  -4.637
  314   1HB   ASP  48          1HB       ASP  48  -9.969   5.749  -2.723
  315   2HB   ASP  48          2HB       ASP  48 -10.912   5.187  -4.097
  316    H    ASP  49           H        ASP  49  -7.890   7.092  -4.244
  317    HA   ASP  49           HA       ASP  49  -9.064   7.870  -6.776
  318   1HB   ASP  49          1HB       ASP  49  -7.594   9.364  -4.615
  319   2HB   ASP  49          2HB       ASP  49  -8.034  10.114  -6.141
  320    H    ASP  50           H        ASP  50  -5.787   8.084  -5.368
  321    HA   ASP  50           HA       ASP  50  -4.597   8.678  -7.898
  322   1HB   ASP  50          1HB       ASP  50  -3.517   8.180  -5.146
  323   2HB   ASP  50          2HB       ASP  50  -2.434   8.350  -6.525
  324    H    ARG  51           H        ARG  51  -4.964   5.735  -6.044
  325    HA   ARG  51           HA       ARG  51  -4.281   3.616  -6.339
  326   1HB   ARG  51          1HB       ARG  51  -4.826   4.460  -9.155
  327   2HB   ARG  51          2HB       ARG  51  -4.520   2.796  -8.684
  328   1HG   ARG  51          1HG       ARG  51  -6.475   4.165  -7.059
  329   2HG   ARG  51          2HG       ARG  51  -6.968   3.945  -8.730
  330   1HD   ARG  51          1HD       ARG  51  -6.185   1.885  -6.684
  331   2HD   ARG  51          2HD       ARG  51  -7.733   2.052  -7.513
  332    HE   ARG  51           HE       ARG  51  -5.797   1.606  -9.467
  333   1HH1  ARG  51          1HH1      ARG  51  -7.289  -0.072  -6.797
  334   2HH1  ARG  51          2HH1      ARG  51  -6.914  -1.651  -7.409
  335   1HH2  ARG  51          1HH2      ARG  51  -5.361  -0.448 -10.314
  336   2HH2  ARG  51          2HH2      ARG  51  -5.880  -1.867  -9.455
  337    H    LYS  52           H        LYS  52  -2.094   5.123  -5.859
  338    HA   LYS  52           HA       LYS  52  -0.086   3.951  -7.642
  339   1HB   LYS  52          1HB       LYS  52   0.094   6.417  -5.889
  340   2HB   LYS  52          2HB       LYS  52   1.474   5.711  -6.724
  341   1HG   LYS  52          1HG       LYS  52   0.527   6.194  -8.854
  342   2HG   LYS  52          2HG       LYS  52  -1.011   6.670  -8.131
  343   1HD   LYS  52          1HD       LYS  52   0.061   8.589  -7.079
  344   2HD   LYS  52          2HD       LYS  52   1.623   8.096  -7.738
  345   1HE   LYS  52          1HE       LYS  52   0.886   8.476  -9.968
  346   2HE   LYS  52          2HE       LYS  52  -0.785   8.710  -9.446
  347   1HZ   LYS  52          1HZ       LYS  52   1.043  10.516  -8.162
  348   2HZ   LYS  52          2HZ       LYS  52   1.061  10.669  -9.857
  349   3HZ   LYS  52          3HZ       LYS  52  -0.399  10.837  -9.005
  350    H    TRP  53           H        TRP  53   0.846   2.243  -6.828
  351    HA   TRP  53           HA       TRP  53   1.037   1.992  -3.899
  352   1HB   TRP  53          1HB       TRP  53   0.283  -0.301  -4.140
  353   2HB   TRP  53          2HB       TRP  53  -0.880   0.804  -4.784
  354    HD1  TRP  53           HD1      TRP  53  -0.600   1.108  -7.672
  355    HE1  TRP  53           1HE      TRP  53  -0.246  -0.826  -9.335
  356    HE3  TRP  53           3HE      TRP  53   1.073  -2.296  -4.399
  357    HZ2  TRP  53           2HZ      TRP  53   0.660  -3.538  -9.219
  358    HZ3  TRP  53           3HZ      TRP  53   1.691  -4.575  -5.197
  359    HH2  TRP  53           HH2      TRP  53   1.485  -5.170  -7.566
  360    H    GLY  54           H        GLY  54   2.203   0.011  -3.267
  361   1HA   GLY  54          1HA       GLY  54   4.358  -0.957  -4.898
  362   2HA   GLY  54          2HA       GLY  54   4.898   0.137  -3.626
  363    H    PHE  55           H        PHE  55   5.216  -2.808  -4.036
  364    HA   PHE  55           HA       PHE  55   3.699  -4.299  -2.247
  365   1HB   PHE  55          1HB       PHE  55   6.414  -4.592  -3.456
  366   2HB   PHE  55          2HB       PHE  55   5.876  -5.731  -2.238
  367    HD1  PHE  55           1HD      PHE  55   2.878  -5.167  -3.462
  368    HD2  PHE  55           2HD      PHE  55   6.603  -6.640  -4.888
  369    HE1  PHE  55           1HE      PHE  55   1.695  -6.505  -5.164
  370    HE2  PHE  55           2HE      PHE  55   5.427  -7.982  -6.586
  371    HZ   PHE  55           HZ       PHE  55   2.972  -7.903  -6.730
  372    H    CYS  56           H        CYS  56   4.333  -5.268  -0.250
  373    HA   CYS  56           HA       CYS  56   5.497  -3.346   1.587
  374   1HB   CYS  56          1HB       CYS  56   3.342  -4.699   2.008
  375   2HB   CYS  56          2HB       CYS  56   4.408  -6.074   2.258
  376    HA   PRO  57           HA       PRO  57   9.311  -5.700   1.208
  377   1HB   PRO  57          1HB       PRO  57  10.992  -3.950   2.223
  378   2HB   PRO  57          2HB       PRO  57  10.210  -3.636   0.664
  379   1HG   PRO  57          1HG       PRO  57   9.390  -2.727   3.388
  380   2HG   PRO  57          2HG       PRO  57   9.634  -1.725   1.943
  381   1HD   PRO  57          1HD       PRO  57   7.189  -2.576   2.723
  382   2HD   PRO  57          2HD       PRO  57   7.621  -2.424   1.003
  383    H    ASP  58           H        ASP  58   7.533  -5.158   3.727
  384    HA   ASP  58           HA       ASP  58   9.100  -6.894   5.461
  385   1HB   ASP  58          1HB       ASP  58   9.348  -4.312   6.006
  386   2HB   ASP  58          2HB       ASP  58   7.783  -4.556   6.779
  387    H    GLN  59           H        GLN  59   7.405  -8.299   4.579
  388    HA   GLN  59           HA       GLN  59   4.681  -7.813   5.324
  389   1HB   GLN  59          1HB       GLN  59   5.916 -10.407   4.401
  390   2HB   GLN  59          2HB       GLN  59   4.214  -9.974   4.357
  391   1HG   GLN  59          1HG       GLN  59   4.864  -8.115   2.779
  392   2HG   GLN  59          2HG       GLN  59   6.449  -8.877   2.689
  393   1HE2  GLN  59          1HE2      GLN  59   5.481 -11.199   0.343
  394   2HE2  GLN  59          2HE2      GLN  59   6.736 -10.358   1.183
  395    H    GLY  60           H        GLY  60   7.350  -9.742   6.578
  396   1HA   GLY  60          1HA       GLY  60   6.635  -9.684   9.212
  397   2HA   GLY  60          2HA       GLY  60   5.733 -11.047   8.559
  Start of MODEL   28
    1    H    SER   1           1H       SER   1  13.801   3.524   9.573
    2    HA   SER   1           HA       SER   1  15.877   1.894   8.423
    3   1HB   SER   1          1HB       SER   1  13.917   0.275   8.570
    4   2HB   SER   1          2HB       SER   1  14.475   0.942  10.104
    5    HG   SER   1           HG       SER   1  12.083   0.923   9.577
    6    H    TRP   2           H        TRP   2  15.722   0.936   6.404
    7    HA   TRP   2           HA       TRP   2  14.501   2.555   4.373
    8   1HB   TRP   2          1HB       TRP   2  16.714   1.368   4.130
    9   2HB   TRP   2          2HB       TRP   2  15.826  -0.146   4.067
   10    HD1  TRP   2           HD1      TRP   2  14.161  -0.461   1.876
   11    HE1  TRP   2           1HE      TRP   2  14.453   0.402  -0.535
   12    HE3  TRP   2           3HE      TRP   2  17.641   3.187   2.736
   13    HZ2  TRP   2           2HZ      TRP   2  15.965   2.353  -1.885
   14    HZ3  TRP   2           3HZ      TRP   2  18.479   4.486   0.823
   15    HH2  TRP   2           HH2      TRP   2  17.655   4.076  -1.443
   16    H    MET   3           H        MET   3  12.314   2.415   4.885
   17    HA   MET   3           HA       MET   3  11.046  -0.189   4.490
   18   1HB   MET   3          1HB       MET   3   9.047   0.945   5.538
   19   2HB   MET   3          2HB       MET   3  10.417   0.684   6.600
   20   1HG   MET   3          1HG       MET   3  11.037   3.006   6.440
   21   2HG   MET   3          2HG       MET   3   9.782   3.293   5.234
   22   1HE   MET   3          1HE       MET   3   7.525   2.085   5.755
   23   2HE   MET   3          2HE       MET   3   6.739   2.065   7.334
   24   3HE   MET   3          3HE       MET   3   6.787   3.554   6.393
   25    H    SER   4           H        SER   4  11.934   0.977   2.221
   26    HA   SER   4           HA       SER   4   9.947   2.598   0.951
   27   1HB   SER   4          1HB       SER   4  12.119   0.969  -0.390
   28   2HB   SER   4          2HB       SER   4  11.317   2.417  -1.006
   29    HG   SER   4           HG       SER   4  13.531   2.326   0.399
   30    H    THR   5           H        THR   5   9.321   1.578  -1.435
   31    HA   THR   5           HA       THR   5   7.790  -0.798  -0.708
   32    HB   THR   5           HB       THR   5   6.419  -0.123  -2.728
   33    HG1  THR   5           1HG      THR   5   7.657   1.282  -3.807
   34   1HG2  THR   5          1HG2      THR   5   6.088   2.216  -1.112
   35   2HG2  THR   5          2HG2      THR   5   5.017   0.829  -1.332
   36   3HG2  THR   5          3HG2      THR   5   6.298   0.774  -0.120
   37    H    VAL   6           H        VAL   6   7.124  -2.130  -2.500
   38    HA   VAL   6           HA       VAL   6   9.216  -2.699  -4.502
   39    HB   VAL   6           HB       VAL   6   7.658  -5.025  -3.700
   40   1HG1  VAL   6          1HG1      VAL   6  10.366  -4.358  -4.504
   41   2HG1  VAL   6          2HG1      VAL   6  10.307  -5.615  -3.267
   42   3HG1  VAL   6          3HG1      VAL   6   9.424  -5.823  -4.779
   43   1HG2  VAL   6          1HG2      VAL   6   8.546  -3.431  -1.528
   44   2HG2  VAL   6          2HG2      VAL   6   7.791  -5.025  -1.492
   45   3HG2  VAL   6          3HG2      VAL   6   9.546  -4.884  -1.587
   46    H    GLY   7           H        GLY   7   7.801  -4.662  -5.797
   47   1HA   GLY   7          1HA       GLY   7   6.240  -4.723  -7.543
   48   2HA   GLY   7          2HA       GLY   7   5.158  -4.645  -6.187
   49    H    GLY   8           H        GLY   8   3.574  -3.370  -6.637
   50   1HA   GLY   8          1HA       GLY   8   2.332  -1.615  -7.435
   51   2HA   GLY   8          2HA       GLY   8   3.546  -0.693  -6.585
   52    H    ASN   9           H        ASN   9   3.393   1.035  -7.912
   53    HA   ASN   9           HA       ASN   9   4.631   0.729 -10.559
   54   1HB   ASN   9          1HB       ASN   9   3.070   2.238 -11.565
   55   2HB   ASN   9          2HB       ASN   9   2.121   1.040 -10.717
   56   1HD2  ASN   9          1HD2      ASN   9   0.575   3.260  -8.624
   57   2HD2  ASN   9          2HD2      ASN   9   0.898   1.632  -9.085
   58    H    SER  10           H        SER  10   3.955   2.596  -7.719
   59    HA   SER  10           HA       SER  10   5.264   4.987  -8.315
   60   1HB   SER  10          1HB       SER  10   5.160   3.677  -5.593
   61   2HB   SER  10          2HB       SER  10   5.237   5.397  -5.959
   62    HG   SER  10           HG       SER  10   3.115   4.845  -5.462
   63    H    GLY  11           H        GLY  11   6.533   1.876  -7.383
   64   1HA   GLY  11          1HA       GLY  11   8.774   1.255  -7.914
   65   2HA   GLY  11          2HA       GLY  11   9.248   2.939  -7.751
   66    H    GLY  12           H        GLY  12  10.007   3.656  -5.827
   67   1HA   GLY  12          1HA       GLY  12   9.771   1.791  -3.546
   68   2HA   GLY  12          2HA       GLY  12  11.297   2.565  -3.952
   69    H    ALA  13           H        ALA  13   8.060   4.006  -3.976
   70    HA   ALA  13           HA       ALA  13   9.054   6.150  -2.291
   71   1HB   ALA  13          1HB       ALA  13   6.627   5.764  -3.975
   72   2HB   ALA  13          2HB       ALA  13   6.595   6.963  -2.685
   73   3HB   ALA  13          3HB       ALA  13   7.799   7.082  -3.970
   74    HA   PRO  14           HA       PRO  14   7.598   4.570   1.559
   75   1HB   PRO  14          1HB       PRO  14   6.984   7.414   2.160
   76   2HB   PRO  14          2HB       PRO  14   7.994   6.267   3.049
   77   1HG   PRO  14          1HG       PRO  14   9.083   8.234   1.594
   78   2HG   PRO  14          2HG       PRO  14   9.832   6.628   1.680
   79   1HD   PRO  14          1HD       PRO  14   8.222   7.858  -0.525
   80   2HD   PRO  14          2HD       PRO  14   9.630   6.779  -0.620
   81    H    CYS  15           H        CYS  15   5.660   3.779   2.155
   82    HA   CYS  15           HA       CYS  15   3.288   4.654   0.808
   83   1HB   CYS  15          1HB       CYS  15   3.841   2.574   2.910
   84   2HB   CYS  15          2HB       CYS  15   2.195   2.963   2.416
   85    H    VAL  16           H        VAL  16   1.768   6.035   1.480
   86    HA   VAL  16           HA       VAL  16   2.189   7.517   3.926
   87    HB   VAL  16           HB       VAL  16   0.053   7.795   1.796
   88   1HG1  VAL  16          1HG1      VAL  16   0.335   9.046   4.392
   89   2HG1  VAL  16          2HG1      VAL  16   0.385  10.235   3.089
   90   3HG1  VAL  16          3HG1      VAL  16  -0.990   9.141   3.233
   91   1HG2  VAL  16          1HG2      VAL  16   2.803   8.501   1.815
   92   2HG2  VAL  16          2HG2      VAL  16   1.592   8.824   0.574
   93   3HG2  VAL  16          3HG2      VAL  16   1.851   9.984   1.876
   94    H    PHE  17           H        PHE  17   1.353   6.892   5.818
   95    HA   PHE  17           HA       PHE  17  -1.161   5.369   5.804
   96   1HB   PHE  17          1HB       PHE  17   1.228   5.209   7.637
   97   2HB   PHE  17          2HB       PHE  17  -0.317   4.475   8.015
   98    HD1  PHE  17           1HD      PHE  17  -0.529   3.956   4.774
   99    HD2  PHE  17           2HD      PHE  17   2.056   2.888   7.970
  100    HE1  PHE  17           1HE      PHE  17   0.181   1.959   3.534
  101    HE2  PHE  17           2HE      PHE  17   2.778   0.891   6.751
  102    HZ   PHE  17           HZ       PHE  17   1.848   0.399   4.501
  103    HA   PRO  18           HA       PRO  18  -2.543   4.698   7.034
  104   1HB   PRO  18          1HB       PRO  18  -5.182   5.567   7.649
  105   2HB   PRO  18          2HB       PRO  18  -4.149   4.518   8.622
  106   1HG   PRO  18          1HG       PRO  18  -4.975   7.080   9.332
  107   2HG   PRO  18          2HG       PRO  18  -3.608   6.203  10.045
  108   1HD   PRO  18          1HD       PRO  18  -3.607   8.323   7.937
  109   2HD   PRO  18          2HD       PRO  18  -2.446   8.037   9.253
  110    H    PHE  19           H        PHE  19  -3.357   4.105   5.051
  111    HA   PHE  19           HA       PHE  19  -4.402   6.319   3.424
  112   1HB   PHE  19          1HB       PHE  19  -3.900   5.035   1.432
  113   2HB   PHE  19          2HB       PHE  19  -2.462   5.189   2.419
  114    HD1  PHE  19           1HD      PHE  19  -1.882   3.144   3.923
  115    HD2  PHE  19           2HD      PHE  19  -4.526   2.988   0.594
  116    HE1  PHE  19           1HE      PHE  19  -1.499   0.723   3.736
  117    HE2  PHE  19           2HE      PHE  19  -4.147   0.568   0.403
  118    HZ   PHE  19           HZ       PHE  19  -2.630  -0.568   1.966
  119    H    THR  20           H        THR  20  -5.804   4.832   1.536
  120    HA   THR  20           HA       THR  20  -7.769   3.312   3.055
  121    HB   THR  20           HB       THR  20  -8.407   5.907   1.613
  122    HG1  THR  20           1HG      THR  20  -7.756   5.499   4.088
  123   1HG2  THR  20          1HG2      THR  20 -10.726   5.552   2.460
  124   2HG2  THR  20          2HG2      THR  20 -10.237   4.518   1.117
  125   3HG2  THR  20          3HG2      THR  20 -10.281   3.870   2.757
  126    H    PHE  21           H        PHE  21  -8.455   1.660   1.937
  127    HA   PHE  21           HA       PHE  21  -8.437   1.842  -1.012
  128   1HB   PHE  21          1HB       PHE  21  -6.561   0.413   0.046
  129   2HB   PHE  21          2HB       PHE  21  -7.843  -0.668   0.541
  130    HD1  PHE  21           1HD      PHE  21  -6.729   1.045  -2.587
  131    HD2  PHE  21           2HD      PHE  21  -8.285  -2.477  -0.796
  132    HE1  PHE  21           1HE      PHE  21  -6.528  -0.129  -4.727
  133    HE2  PHE  21           2HE      PHE  21  -8.082  -3.656  -2.932
  134    HZ   PHE  21           HZ       PHE  21  -7.211  -2.488  -4.917
  135    H    LEU  22           H        LEU  22 -10.153   0.963  -1.969
  136    HA   LEU  22           HA       LEU  22 -12.362   0.521  -2.165
  137   1HB   LEU  22          1HB       LEU  22 -10.723  -1.708  -1.182
  138   2HB   LEU  22          2HB       LEU  22 -12.407  -2.003  -1.556
  139    HG   LEU  22           HG       LEU  22 -10.815  -2.513  -3.409
  140   1HD1  LEU  22          1HD1      LEU  22 -13.273  -1.651  -3.492
  141   2HD1  LEU  22          2HD1      LEU  22 -12.494  -0.302  -4.321
  142   3HD1  LEU  22          3HD1      LEU  22 -12.327  -1.939  -4.953
  143   1HD2  LEU  22          1HD2      LEU  22  -9.462  -0.380  -2.904
  144   2HD2  LEU  22          2HD2      LEU  22  -9.680  -0.907  -4.572
  145   3HD2  LEU  22          3HD2      LEU  22 -10.670   0.403  -3.924
  146    H    GLY  23           H        GLY  23 -12.309   2.033   0.010
  147   1HA   GLY  23          1HA       GLY  23 -14.043   2.597   1.480
  148   2HA   GLY  23          2HA       GLY  23 -14.526   0.916   1.518
  149    H    ASN  24           H        ASN  24 -11.386   0.485   2.229
  150    HA   ASN  24           HA       ASN  24 -11.900   0.953   5.095
  151   1HB   ASN  24          1HB       ASN  24 -10.219  -1.186   3.778
  152   2HB   ASN  24          2HB       ASN  24 -10.490  -1.002   5.505
  153   1HD2  ASN  24          1HD2      ASN  24 -13.084  -2.972   3.208
  154   2HD2  ASN  24          2HD2      ASN  24 -11.565  -2.374   2.652
  155    H    LYS  25           H        LYS  25 -10.456   2.026   6.291
  156    HA   LYS  25           HA       LYS  25  -8.269   3.366   5.022
  157   1HB   LYS  25          1HB       LYS  25  -9.149   3.253   7.916
  158   2HB   LYS  25          2HB       LYS  25  -8.047   4.405   7.211
  159   1HG   LYS  25          1HG       LYS  25  -9.789   5.388   5.893
  160   2HG   LYS  25          2HG       LYS  25 -10.917   4.128   6.397
  161   1HD   LYS  25          1HD       LYS  25 -11.388   6.084   7.685
  162   2HD   LYS  25          2HD       LYS  25 -10.615   4.910   8.750
  163   1HE   LYS  25          1HE       LYS  25  -8.451   6.074   8.372
  164   2HE   LYS  25          2HE       LYS  25  -9.319   7.303   7.449
  165   1HZ   LYS  25          1HZ       LYS  25 -10.332   6.742  10.117
  166   2HZ   LYS  25          2HZ       LYS  25  -8.812   7.503  10.045
  167   3HZ   LYS  25          3HZ       LYS  25 -10.160   8.229   9.308
  168    H    TYR  26           H        TYR  26  -6.194   2.566   4.951
  169    HA   TYR  26           HA       TYR  26  -5.619   0.314   6.739
  170   1HB   TYR  26          1HB       TYR  26  -4.332   0.993   4.101
  171   2HB   TYR  26          2HB       TYR  26  -3.963  -0.392   5.111
  172    HD1  TYR  26           1HD      TYR  26  -6.987  -0.827   5.850
  173    HD2  TYR  26           2HD      TYR  26  -4.886  -0.369   2.191
  174    HE1  TYR  26           1HE      TYR  26  -8.679  -2.188   4.711
  175    HE2  TYR  26           2HE      TYR  26  -6.568  -1.712   1.039
  176    HH   TYR  26           HH       TYR  26  -8.530  -3.747   2.329
  177    H    GLU  27           H        GLU  27  -4.373   0.670   8.291
  178    HA   GLU  27           HA       GLU  27  -2.641   3.003   8.375
  179   1HB   GLU  27          1HB       GLU  27  -3.444   0.974  10.456
  180   2HB   GLU  27          2HB       GLU  27  -2.437   2.371  10.757
  181   1HG   GLU  27          1HG       GLU  27  -4.193   3.869  10.433
  182   2HG   GLU  27          2HG       GLU  27  -5.175   2.668   9.595
  183    H    SER  28           H        SER  28  -2.414  -0.201   7.516
  184    HA   SER  28           HA       SER  28   0.494  -0.110   7.675
  185   1HB   SER  28          1HB       SER  28   0.399  -2.565   8.289
  186   2HB   SER  28          2HB       SER  28  -0.064  -1.458   9.571
  187    HG   SER  28           HG       SER  28  -1.714  -3.094   7.955
  188    H    CYS  29           H        CYS  29   0.923  -2.649   6.510
  189    HA   CYS  29           HA       CYS  29   0.184  -2.075   3.812
  190   1HB   CYS  29          1HB       CYS  29   1.493  -4.521   4.998
  191   2HB   CYS  29          2HB       CYS  29   1.317  -4.207   3.286
  192    H    THR  30           H        THR  30  -0.777  -3.852   2.447
  193    HA   THR  30           HA       THR  30  -2.823  -5.459   3.775
  194    HB   THR  30           HB       THR  30  -3.874  -3.205   3.389
  195    HG1  THR  30           1HG      THR  30  -5.360  -4.749   3.327
  196   1HG2  THR  30          1HG2      THR  30  -4.498  -2.874   0.881
  197   2HG2  THR  30          2HG2      THR  30  -2.965  -2.255   1.496
  198   3HG2  THR  30          3HG2      THR  30  -3.004  -3.766   0.586
  199    H    SER  31           H        SER  31  -4.006  -6.786   2.137
  200    HA   SER  31           HA       SER  31  -2.344  -7.290  -0.237
  201   1HB   SER  31          1HB       SER  31  -3.057  -9.699  -0.019
  202   2HB   SER  31          2HB       SER  31  -1.983  -9.133   1.268
  203    HG   SER  31           HG       SER  31  -3.962 -10.390   1.859
  204    H    ALA  32           H        ALA  32  -4.681  -5.635   0.456
  205    HA   ALA  32           HA       ALA  32  -7.084  -6.606  -0.577
  206   1HB   ALA  32          1HB       ALA  32  -6.889  -4.568   0.800
  207   2HB   ALA  32          2HB       ALA  32  -6.049  -3.763  -0.526
  208   3HB   ALA  32          3HB       ALA  32  -7.736  -4.240  -0.713
  209    H    GLY  33           H        GLY  33  -8.031  -6.604  -2.546
  210   1HA   GLY  33          1HA       GLY  33  -8.260  -6.400  -4.831
  211   2HA   GLY  33          2HA       GLY  33  -6.933  -5.251  -4.814
  212    H    ARG  34           H        ARG  34  -5.599  -7.732  -3.283
  213    HA   ARG  34           HA       ARG  34  -4.565  -8.851  -5.786
  214   1HB   ARG  34          1HB       ARG  34  -3.323  -8.993  -3.039
  215   2HB   ARG  34          2HB       ARG  34  -2.585  -9.426  -4.560
  216   1HG   ARG  34          1HG       ARG  34  -3.064  -6.895  -5.134
  217   2HG   ARG  34          2HG       ARG  34  -3.047  -6.749  -3.378
  218   1HD   ARG  34          1HD       ARG  34  -0.842  -6.340  -4.362
  219   2HD   ARG  34          2HD       ARG  34  -0.842  -7.741  -3.289
  220    HE   ARG  34           HE       ARG  34  -0.267  -9.050  -5.060
  221   1HH1  ARG  34          1HH1      ARG  34  -1.591  -6.039  -6.262
  222   2HH1  ARG  34          2HH1      ARG  34  -1.271  -6.401  -7.935
  223   1HH2  ARG  34          1HH2      ARG  34   0.160  -9.543  -7.272
  224   2HH2  ARG  34          2HH2      ARG  34  -0.244  -8.380  -8.491
  225    H    SER  35           H        SER  35  -4.948  -9.962  -2.443
  226    HA   SER  35           HA       SER  35  -5.673 -11.888  -1.516
  227   1HB   SER  35          1HB       SER  35  -7.173 -12.153  -4.130
  228   2HB   SER  35          2HB       SER  35  -7.418 -13.195  -2.725
  229    HG   SER  35           HG       SER  35  -8.398 -11.599  -1.679
  230    H    ASP  36           H        ASP  36  -3.319 -11.758  -3.511
  231    HA   ASP  36           HA       ASP  36  -3.111 -14.573  -4.220
  232   1HB   ASP  36          1HB       ASP  36  -0.780 -13.659  -5.072
  233   2HB   ASP  36          2HB       ASP  36  -2.245 -13.451  -6.002
  234    H    GLY  37           H        GLY  37  -0.826 -12.304  -2.898
  235   1HA   GLY  37          1HA       GLY  37  -0.435 -13.555  -0.435
  236   2HA   GLY  37          2HA       GLY  37   0.755 -14.193  -1.557
  237    H    LYS  38           H        LYS  38   0.992 -11.693  -3.048
  238    HA   LYS  38           HA       LYS  38   3.003 -10.461  -1.456
  239   1HB   LYS  38          1HB       LYS  38   1.843  -9.325  -3.993
  240   2HB   LYS  38          2HB       LYS  38   3.485  -9.177  -3.380
  241   1HG   LYS  38          1HG       LYS  38   3.780 -10.689  -5.060
  242   2HG   LYS  38          2HG       LYS  38   3.512 -11.784  -3.720
  243   1HD   LYS  38          1HD       LYS  38   1.179 -12.022  -4.388
  244   2HD   LYS  38          2HD       LYS  38   1.434 -10.883  -5.710
  245   1HE   LYS  38          1HE       LYS  38   3.001 -12.391  -6.757
  246   2HE   LYS  38          2HE       LYS  38   2.890 -13.506  -5.397
  247   1HZ   LYS  38          1HZ       LYS  38   0.332 -12.900  -6.544
  248   2HZ   LYS  38          2HZ       LYS  38   1.388 -13.601  -7.670
  249   3HZ   LYS  38          3HZ       LYS  38   1.035 -14.407  -6.212
  250    H    MET  39           H        MET  39   2.561  -9.047   0.142
  251    HA   MET  39           HA       MET  39   0.083  -7.539   0.057
  252   1HB   MET  39          1HB       MET  39   2.239  -7.571   2.173
  253   2HB   MET  39          2HB       MET  39   0.641  -6.862   2.310
  254   1HG   MET  39          1HG       MET  39  -0.384  -9.055   2.123
  255   2HG   MET  39          2HG       MET  39   1.216  -9.786   1.968
  256   1HE   MET  39          1HE       MET  39   0.273 -11.373   3.860
  257   2HE   MET  39          2HE       MET  39   0.031 -10.890   5.535
  258   3HE   MET  39          3HE       MET  39  -1.161 -10.449   4.311
  259    H    TRP  40           H        TRP  40  -0.042  -5.302   0.035
  260    HA   TRP  40           HA       TRP  40   2.421  -3.832  -0.645
  261   1HB   TRP  40          1HB       TRP  40   1.156  -2.637  -2.406
  262   2HB   TRP  40          2HB       TRP  40   1.276  -4.363  -2.747
  263    HD1  TRP  40           HD1      TRP  40  -1.097  -5.794  -1.958
  264    HE1  TRP  40           1HE      TRP  40  -3.540  -5.042  -2.214
  265    HE3  TRP  40           3HE      TRP  40  -0.344  -0.788  -2.548
  266    HZ2  TRP  40           2HZ      TRP  40  -4.959  -2.649  -2.590
  267    HZ3  TRP  40           3HZ      TRP  40  -2.303   0.673  -2.830
  268    HH2  TRP  40           HH2      TRP  40  -4.563  -0.242  -2.856
  269    H    CYS  41           H        CYS  41   1.249  -1.396  -1.140
  270    HA   CYS  41           HA       CYS  41  -0.651  -0.557   0.768
  271   1HB   CYS  41          1HB       CYS  41   0.928   0.939   2.081
  272   2HB   CYS  41          2HB       CYS  41   0.997  -0.775   2.467
  273    H    ALA  42           H        ALA  42  -1.062   1.765   0.577
  274    HA   ALA  42           HA       ALA  42  -0.433   2.656  -2.099
  275   1HB   ALA  42          1HB       ALA  42  -2.317   3.524   0.021
  276   2HB   ALA  42          2HB       ALA  42  -1.823   4.718  -1.179
  277   3HB   ALA  42          3HB       ALA  42  -2.599   3.219  -1.695
  278    H    THR  43           H        THR  43   0.639   4.510  -2.675
  279    HA   THR  43           HA       THR  43   2.520   5.485  -0.663
  280    HB   THR  43           HB       THR  43   3.858   6.254  -2.557
  281    HG1  THR  43           1HG      THR  43   2.947   6.572  -4.413
  282   1HG2  THR  43          1HG2      THR  43   3.766   3.874  -3.831
  283   2HG2  THR  43          2HG2      THR  43   4.598   4.155  -2.302
  284   3HG2  THR  43          3HG2      THR  43   2.971   3.473  -2.308
  285    H    THR  44           H        THR  44  -0.390   6.217  -1.355
  286    HA   THR  44           HA       THR  44  -0.034   9.108  -1.056
  287    HB   THR  44           HB       THR  44  -2.098   9.415  -2.467
  288    HG1  THR  44           1HG      THR  44  -3.112   7.701  -3.071
  289   1HG2  THR  44          1HG2      THR  44  -0.990   8.841  -4.696
  290   2HG2  THR  44          2HG2      THR  44  -0.169   9.985  -3.634
  291   3HG2  THR  44          3HG2      THR  44   0.384   8.312  -3.723
  292    H    ALA  45           H        ALA  45  -1.917  10.111   0.030
  293    HA   ALA  45           HA       ALA  45  -2.726   8.629   2.279
  294   1HB   ALA  45          1HB       ALA  45  -2.578  11.158   2.022
  295   2HB   ALA  45          2HB       ALA  45  -4.177  11.058   1.290
  296   3HB   ALA  45          3HB       ALA  45  -3.935  10.521   2.953
  297    H    ASN  46           H        ASN  46  -4.487   9.479  -0.678
  298    HA   ASN  46           HA       ASN  46  -6.507   7.482   0.094
  299   1HB   ASN  46          1HB       ASN  46  -7.362   9.853  -0.076
  300   2HB   ASN  46          2HB       ASN  46  -6.943   9.812  -1.786
  301   1HD2  ASN  46          1HD2      ASN  46 -10.380   8.302  -0.486
  302   2HD2  ASN  46          2HD2      ASN  46  -9.282   9.177   0.511
  303    H    TYR  47           H        TYR  47  -5.983   5.689  -0.944
  304    HA   TYR  47           HA       TYR  47  -4.539   5.664  -3.393
  305   1HB   TYR  47          1HB       TYR  47  -4.395   3.836  -1.730
  306   2HB   TYR  47          2HB       TYR  47  -6.061   3.397  -2.101
  307    HD1  TYR  47           1HD      TYR  47  -2.646   3.584  -3.489
  308    HD2  TYR  47           2HD      TYR  47  -6.590   2.115  -4.027
  309    HE1  TYR  47           1HE      TYR  47  -1.866   2.172  -5.332
  310    HE2  TYR  47           2HE      TYR  47  -5.812   0.691  -5.868
  311    HH   TYR  47           HH       TYR  47  -3.225  -0.335  -6.458
  312    H    ASP  48           H        ASP  48  -7.948   5.186  -2.575
  313    HA   ASP  48           HA       ASP  48  -8.924   4.173  -4.915
  314   1HB   ASP  48          1HB       ASP  48 -10.157   6.159  -3.027
  315   2HB   ASP  48          2HB       ASP  48 -11.043   5.443  -4.366
  316    H    ASP  49           H        ASP  49  -8.103   7.529  -4.284
  317    HA   ASP  49           HA       ASP  49  -9.116   8.381  -6.853
  318   1HB   ASP  49          1HB       ASP  49  -7.808   9.820  -4.564
  319   2HB   ASP  49          2HB       ASP  49  -8.120  10.609  -6.102
  320    H    ASP  50           H        ASP  50  -5.911   8.600  -5.276
  321    HA   ASP  50           HA       ASP  50  -4.637   9.316  -7.731
  322   1HB   ASP  50          1HB       ASP  50  -3.588   8.660  -4.994
  323   2HB   ASP  50          2HB       ASP  50  -2.522   9.016  -6.350
  324    H    ARG  51           H        ARG  51  -5.232   6.281  -6.203
  325    HA   ARG  51           HA       ARG  51  -4.537   4.181  -6.567
  326   1HB   ARG  51          1HB       ARG  51  -4.838   5.218  -9.358
  327   2HB   ARG  51          2HB       ARG  51  -4.733   3.515  -8.939
  328   1HG   ARG  51          1HG       ARG  51  -6.633   4.606  -7.225
  329   2HG   ARG  51          2HG       ARG  51  -6.997   5.249  -8.835
  330   1HD   ARG  51          1HD       ARG  51  -6.486   2.348  -8.254
  331   2HD   ARG  51          2HD       ARG  51  -8.096   3.071  -8.211
  332    HE   ARG  51           HE       ARG  51  -7.017   3.748 -10.665
  333   1HH1  ARG  51          1HH1      ARG  51  -7.786   0.785  -8.977
  334   2HH1  ARG  51          2HH1      ARG  51  -8.179  -0.086 -10.423
  335   1HH2  ARG  51          1HH2      ARG  51  -7.624   2.625 -12.558
  336   2HH2  ARG  51          2HH2      ARG  51  -8.106   0.959 -12.450
  337    H    LYS  52           H        LYS  52  -2.311   5.409  -5.788
  338    HA   LYS  52           HA       LYS  52  -0.299   4.244  -7.577
  339   1HB   LYS  52          1HB       LYS  52  -0.018   6.647  -5.760
  340   2HB   LYS  52          2HB       LYS  52   1.357   5.820  -6.479
  341   1HG   LYS  52          1HG       LYS  52   0.360   6.289  -8.724
  342   2HG   LYS  52          2HG       LYS  52  -0.847   7.282  -7.912
  343   1HD   LYS  52          1HD       LYS  52   0.898   8.717  -8.717
  344   2HD   LYS  52          2HD       LYS  52   0.994   8.646  -6.952
  345   1HE   LYS  52          1HE       LYS  52   3.215   8.495  -7.970
  346   2HE   LYS  52          2HE       LYS  52   2.808   7.011  -7.114
  347   1HZ   LYS  52          1HZ       LYS  52   2.419   7.327 -10.034
  348   2HZ   LYS  52          2HZ       LYS  52   3.864   6.746  -9.371
  349   3HZ   LYS  52          3HZ       LYS  52   2.425   5.884  -9.133
  350    H    TRP  53           H        TRP  53   0.486   2.468  -6.811
  351    HA   TRP  53           HA       TRP  53   0.571   2.078  -3.902
  352   1HB   TRP  53          1HB       TRP  53  -0.193  -0.180  -4.266
  353   2HB   TRP  53          2HB       TRP  53  -1.311   0.951  -4.937
  354    HD1  TRP  53           HD1      TRP  53  -0.806   1.347  -7.821
  355    HE1  TRP  53           1HE      TRP  53  -0.424  -0.567  -9.510
  356    HE3  TRP  53           3HE      TRP  53   0.467  -2.218  -4.536
  357    HZ2  TRP  53           2HZ      TRP  53   0.326  -3.324  -9.402
  358    HZ3  TRP  53           3HZ      TRP  53   1.000  -4.504  -5.350
  359    HH2  TRP  53           HH2      TRP  53   0.931  -5.036  -7.741
  360    H    GLY  54           H        GLY  54   1.758   0.126  -3.293
  361   1HA   GLY  54          1HA       GLY  54   3.961  -0.783  -4.885
  362   2HA   GLY  54          2HA       GLY  54   4.456   0.343  -3.621
  363    H    PHE  55           H        PHE  55   4.902  -2.622  -3.979
  364    HA   PHE  55           HA       PHE  55   3.401  -4.072  -2.102
  365   1HB   PHE  55          1HB       PHE  55   6.149  -4.457  -3.272
  366   2HB   PHE  55          2HB       PHE  55   5.478  -5.571  -2.098
  367    HD1  PHE  55           1HD      PHE  55   2.737  -4.509  -3.862
  368    HD2  PHE  55           2HD      PHE  55   6.230  -6.884  -4.348
  369    HE1  PHE  55           1HE      PHE  55   1.614  -5.791  -5.641
  370    HE2  PHE  55           2HE      PHE  55   5.118  -8.169  -6.136
  371    HZ   PHE  55           HZ       PHE  55   2.805  -7.614  -6.787
  372    H    CYS  56           H        CYS  56   4.114  -4.957  -0.085
  373    HA   CYS  56           HA       CYS  56   5.136  -2.968   1.712
  374   1HB   CYS  56          1HB       CYS  56   3.361  -4.851   2.112
  375   2HB   CYS  56          2HB       CYS  56   4.761  -5.875   2.397
  376    HA   PRO  57           HA       PRO  57   9.405  -4.156   1.358
  377   1HB   PRO  57          1HB       PRO  57  10.451  -3.039   3.513
  378   2HB   PRO  57          2HB       PRO  57   9.728  -2.031   2.244
  379   1HG   PRO  57          1HG       PRO  57   8.441  -3.099   4.721
  380   2HG   PRO  57          2HG       PRO  57   8.572  -1.394   4.237
  381   1HD   PRO  57          1HD       PRO  57   6.352  -2.767   3.710
  382   2HD   PRO  57          2HD       PRO  57   7.027  -1.686   2.469
  383    H    ASP  58           H        ASP  58  11.055  -4.547   3.608
  384    HA   ASP  58           HA       ASP  58  10.781  -7.330   3.981
  385   1HB   ASP  58          1HB       ASP  58  12.951  -6.075   4.102
  386   2HB   ASP  58          2HB       ASP  58  12.430  -5.432   5.657
  387    H    GLN  59           H        GLN  59   9.163  -8.188   5.059
  388    HA   GLN  59           HA       GLN  59   8.005  -6.848   7.362
  389   1HB   GLN  59          1HB       GLN  59   7.222  -9.454   6.041
  390   2HB   GLN  59          2HB       GLN  59   6.296  -8.601   7.266
  391   1HG   GLN  59          1HG       GLN  59   5.917  -6.773   5.766
  392   2HG   GLN  59          2HG       GLN  59   6.966  -7.504   4.551
  393   1HE2  GLN  59          1HE2      GLN  59   4.371  -9.227   3.091
  394   2HE2  GLN  59          2HE2      GLN  59   5.923  -8.470   2.980
  395    H    GLY  60           H        GLY  60   9.067  -7.093   9.220
  396   1HA   GLY  60          1HA       GLY  60  10.576  -9.500   9.781
  397   2HA   GLY  60          2HA       GLY  60  10.445  -8.086  10.812
  Start of MODEL   29
    1    H    SER   1           1H       SER   1  11.949   6.655   9.108
    2    HA   SER   1           HA       SER   1   9.786   7.695   7.419
    3   1HB   SER   1          1HB       SER   1  11.645   7.396   5.653
    4   2HB   SER   1          2HB       SER   1  11.748   8.805   6.713
    5    HG   SER   1           HG       SER   1  13.365   6.535   6.563
    6    H    TRP   2           H        TRP   2   9.298   6.237   5.660
    7    HA   TRP   2           HA       TRP   2   9.480   3.438   6.505
    8   1HB   TRP   2          1HB       TRP   2   7.769   4.765   4.378
    9   2HB   TRP   2          2HB       TRP   2   7.707   3.059   4.810
   10    HD1  TRP   2           HD1      TRP   2   5.354   5.427   5.136
   11    HE1  TRP   2           1HE      TRP   2   4.166   5.544   7.415
   12    HE3  TRP   2           3HE      TRP   2   8.788   2.892   7.989
   13    HZ2  TRP   2           2HZ      TRP   2   4.608   4.668  10.055
   14    HZ3  TRP   2           3HZ      TRP   2   8.311   2.566  10.387
   15    HH2  TRP   2           HH2      TRP   2   6.261   3.438  11.394
   16    H    MET   3           H        MET   3  10.007   1.781   4.916
   17    HA   MET   3           HA       MET   3  12.265   2.561   3.310
   18   1HB   MET   3          1HB       MET   3  10.880  -0.107   3.654
   19   2HB   MET   3          2HB       MET   3  12.348   0.132   2.717
   20   1HG   MET   3          1HG       MET   3  12.038   0.632   5.668
   21   2HG   MET   3          2HG       MET   3  12.823  -0.762   4.918
   22   1HE   MET   3          1HE       MET   3  14.198   0.616   7.054
   23   2HE   MET   3          2HE       MET   3  15.345  -0.344   6.117
   24   3HE   MET   3          3HE       MET   3  15.725   1.328   6.531
   25    H    SER   4           H        SER   4  12.469   1.946   0.995
   26    HA   SER   4           HA       SER   4  10.308   2.994  -0.520
   27   1HB   SER   4          1HB       SER   4  12.657   1.390  -1.549
   28   2HB   SER   4          2HB       SER   4  11.664   2.525  -2.465
   29    HG   SER   4           HG       SER   4  13.649   3.014  -0.542
   30    H    THR   5           H        THR   5   9.082   1.888  -2.142
   31    HA   THR   5           HA       THR   5   8.185  -0.674  -1.201
   32    HB   THR   5           HB       THR   5   6.535  -0.391  -3.122
   33    HG1  THR   5           1HG      THR   5   7.322   2.301  -3.126
   34   1HG2  THR   5          1HG2      THR   5   5.467   1.700  -1.994
   35   2HG2  THR   5          2HG2      THR   5   5.543   0.155  -1.147
   36   3HG2  THR   5          3HG2      THR   5   6.717   1.420  -0.783
   37    H    VAL   6           H        VAL   6   7.579  -2.289  -2.832
   38    HA   VAL   6           HA       VAL   6   9.565  -2.705  -4.930
   39    HB   VAL   6           HB       VAL   6  10.414  -4.380  -3.662
   40   1HG1  VAL   6          1HG1      VAL   6   8.700  -3.369  -1.801
   41   2HG1  VAL   6          2HG1      VAL   6   8.237  -5.068  -1.872
   42   3HG1  VAL   6          3HG1      VAL   6   9.902  -4.624  -1.507
   43   1HG2  VAL   6          1HG2      VAL   6   7.797  -5.542  -4.458
   44   2HG2  VAL   6          2HG2      VAL   6   9.427  -5.981  -4.979
   45   3HG2  VAL   6          3HG2      VAL   6   8.858  -6.453  -3.381
   46    H    GLY   7           H        GLY   7   8.484  -4.316  -6.591
   47   1HA   GLY   7          1HA       GLY   7   6.522  -4.913  -7.760
   48   2HA   GLY   7          2HA       GLY   7   5.672  -4.696  -6.262
   49    H    GLY   8           H        GLY   8   3.939  -3.636  -7.109
   50   1HA   GLY   8          1HA       GLY   8   2.683  -1.907  -7.942
   51   2HA   GLY   8          2HA       GLY   8   3.753  -0.969  -6.925
   52    H    ASN   9           H        ASN   9   3.596   0.816  -8.167
   53    HA   ASN   9           HA       ASN   9   5.337   0.876 -10.482
   54   1HB   ASN   9          1HB       ASN   9   3.709   2.063 -11.907
   55   2HB   ASN   9          2HB       ASN   9   3.213   0.421 -11.555
   56   1HD2  ASN   9          1HD2      ASN   9   1.029   2.593  -9.085
   57   2HD2  ASN   9          2HD2      ASN   9   2.679   2.140  -8.840
   58    H    SER  10           H        SER  10   5.364   1.855  -7.779
   59    HA   SER  10           HA       SER  10   4.814   4.621  -7.659
   60   1HB   SER  10          1HB       SER  10   6.717   4.181  -5.753
   61   2HB   SER  10          2HB       SER  10   4.996   3.848  -5.532
   62    HG   SER  10           HG       SER  10   6.547   2.058  -5.075
   63    H    GLY  11           H        GLY  11   7.962   2.912  -7.790
   64   1HA   GLY  11          1HA       GLY  11   9.764   3.511  -9.206
   65   2HA   GLY  11          2HA       GLY  11   8.984   5.060  -9.501
   66    H    GLY  12           H        GLY  12   9.868   3.387  -6.481
   67   1HA   GLY  12          1HA       GLY  12  11.657   3.977  -5.049
   68   2HA   GLY  12          2HA       GLY  12  11.835   5.484  -5.931
   69    H    ALA  13           H        ALA  13   8.614   4.693  -5.056
   70    HA   ALA  13           HA       ALA  13   8.715   6.789  -2.998
   71   1HB   ALA  13          1HB       ALA  13   7.124   6.828  -5.058
   72   2HB   ALA  13          2HB       ALA  13   6.161   5.699  -4.109
   73   3HB   ALA  13          3HB       ALA  13   6.510   7.306  -3.475
   74    HA   PRO  14           HA       PRO  14   7.835   3.666   0.033
   75   1HB   PRO  14          1HB       PRO  14   7.491   5.343   2.146
   76   2HB   PRO  14          2HB       PRO  14   9.070   4.949   1.469
   77   1HG   PRO  14          1HG       PRO  14   7.543   7.449   1.302
   78   2HG   PRO  14          2HG       PRO  14   9.272   7.173   1.059
   79   1HD   PRO  14          1HD       PRO  14   7.242   7.511  -0.937
   80   2HD   PRO  14          2HD       PRO  14   8.974   7.215  -1.167
   81    H    CYS  15           H        CYS  15   6.117   3.210   1.743
   82    HA   CYS  15           HA       CYS  15   3.535   3.602   0.548
   83   1HB   CYS  15          1HB       CYS  15   3.907   2.548   3.343
   84   2HB   CYS  15          2HB       CYS  15   2.702   2.095   2.151
   85    H    VAL  16           H        VAL  16   1.759   4.738   1.451
   86    HA   VAL  16           HA       VAL  16   2.483   6.756   3.487
   87    HB   VAL  16           HB       VAL  16   0.437   6.993   1.258
   88   1HG1  VAL  16          1HG1      VAL  16   1.071   8.771   3.599
   89   2HG1  VAL  16          2HG1      VAL  16   0.365   9.411   2.117
   90   3HG1  VAL  16          3HG1      VAL  16  -0.503   8.189   3.047
   91   1HG2  VAL  16          1HG2      VAL  16   3.207   7.520   1.307
   92   2HG2  VAL  16          2HG2      VAL  16   2.046   7.929   0.043
   93   3HG2  VAL  16          3HG2      VAL  16   2.387   9.080   1.338
   94    H    PHE  17           H        PHE  17   1.542   6.355   5.402
   95    HA   PHE  17           HA       PHE  17  -1.029   4.947   5.398
   96   1HB   PHE  17          1HB       PHE  17   1.165   4.979   7.468
   97   2HB   PHE  17          2HB       PHE  17  -0.400   4.225   7.688
   98    HD1  PHE  17           1HD      PHE  17  -1.067   2.528   5.734
   99    HD2  PHE  17           2HD      PHE  17   2.884   3.670   6.802
  100    HE1  PHE  17           1HE      PHE  17  -0.193   0.471   4.710
  101    HE2  PHE  17           2HE      PHE  17   3.773   1.626   5.778
  102    HZ   PHE  17           HZ       PHE  17   2.246  -0.001   4.714
  103    HA   PRO  18           HA       PRO  18  -2.564   4.503   6.506
  104   1HB   PRO  18          1HB       PRO  18  -5.193   5.471   6.760
  105   2HB   PRO  18          2HB       PRO  18  -4.269   4.609   7.988
  106   1HG   PRO  18          1HG       PRO  18  -5.113   7.298   8.087
  107   2HG   PRO  18          2HG       PRO  18  -3.979   6.499   9.190
  108   1HD   PRO  18          1HD       PRO  18  -3.441   8.287   6.879
  109   2HD   PRO  18          2HD       PRO  18  -2.494   8.041   8.363
  110    H    PHE  19           H        PHE  19  -2.982   3.781   4.474
  111    HA   PHE  19           HA       PHE  19  -3.931   5.795   2.545
  112   1HB   PHE  19          1HB       PHE  19  -3.153   4.390   0.759
  113   2HB   PHE  19          2HB       PHE  19  -1.843   4.623   1.907
  114    HD1  PHE  19           1HD      PHE  19  -1.388   2.725   3.566
  115    HD2  PHE  19           2HD      PHE  19  -3.801   2.264   0.097
  116    HE1  PHE  19           1HE      PHE  19  -1.055   0.291   3.655
  117    HE2  PHE  19           2HE      PHE  19  -3.464  -0.167   0.176
  118    HZ   PHE  19           HZ       PHE  19  -2.088  -1.158   1.957
  119    H    THR  20           H        THR  20  -5.911   5.660   1.733
  120    HA   THR  20           HA       THR  20  -7.580   3.471   2.688
  121    HB   THR  20           HB       THR  20  -8.416   5.925   1.120
  122    HG1  THR  20           1HG      THR  20  -8.045   7.039   2.835
  123   1HG2  THR  20          1HG2      THR  20 -10.314   5.179   3.058
  124   2HG2  THR  20          2HG2      THR  20 -10.470   5.160   1.299
  125   3HG2  THR  20          3HG2      THR  20  -9.888   3.729   2.147
  126    H    PHE  21           H        PHE  21  -8.094   1.793   1.495
  127    HA   PHE  21           HA       PHE  21  -7.939   2.055  -1.436
  128   1HB   PHE  21          1HB       PHE  21  -6.248   0.488  -0.423
  129   2HB   PHE  21          2HB       PHE  21  -7.589  -0.461   0.174
  130    HD1  PHE  21           1HD      PHE  21  -5.872   0.649  -2.870
  131    HD2  PHE  21           2HD      PHE  21  -8.820  -1.961  -1.271
  132    HE1  PHE  21           1HE      PHE  21  -5.844  -0.618  -4.956
  133    HE2  PHE  21           2HE      PHE  21  -8.794  -3.240  -3.367
  134    HZ   PHE  21           HZ       PHE  21  -7.318  -2.586  -5.211
  135    H    LEU  22           H        LEU  22  -9.660   1.627  -2.502
  136    HA   LEU  22           HA       LEU  22 -11.855   1.463  -2.898
  137   1HB   LEU  22          1HB       LEU  22 -10.589  -1.078  -2.137
  138   2HB   LEU  22          2HB       LEU  22 -12.256  -1.087  -2.683
  139    HG   LEU  22           HG       LEU  22 -10.574  -1.544  -4.466
  140   1HD1  LEU  22          1HD1      LEU  22 -12.869  -0.355  -4.634
  141   2HD1  LEU  22          2HD1      LEU  22 -11.855   1.010  -5.113
  142   3HD1  LEU  22          3HD1      LEU  22 -11.796  -0.489  -6.033
  143   1HD2  LEU  22          1HD2      LEU  22  -8.912   0.147  -3.627
  144   2HD2  LEU  22          2HD2      LEU  22  -9.211   0.116  -5.366
  145   3HD2  LEU  22          3HD2      LEU  22  -9.953   1.365  -4.363
  146    H    GLY  23           H        GLY  23 -11.816   2.697  -0.578
  147   1HA   GLY  23          1HA       GLY  23 -13.687   3.220   0.791
  148   2HA   GLY  23          2HA       GLY  23 -14.150   1.534   0.756
  149    H    ASN  24           H        ASN  24 -11.137   0.889   1.612
  150    HA   ASN  24           HA       ASN  24 -11.722   1.499   4.436
  151   1HB   ASN  24          1HB       ASN  24 -10.254  -0.847   3.245
  152   2HB   ASN  24          2HB       ASN  24 -10.540  -0.583   4.962
  153   1HD2  ASN  24          1HD2      ASN  24 -13.312  -2.296   2.674
  154   2HD2  ASN  24          2HD2      ASN  24 -11.698  -1.974   2.163
  155    H    LYS  25           H        LYS  25 -10.267   2.464   5.699
  156    HA   LYS  25           HA       LYS  25  -7.888   3.582   4.585
  157   1HB   LYS  25          1HB       LYS  25  -8.754   3.514   7.470
  158   2HB   LYS  25          2HB       LYS  25  -7.796   4.718   6.655
  159   1HG   LYS  25          1HG       LYS  25  -9.606   5.714   5.641
  160   2HG   LYS  25          2HG       LYS  25 -10.597   4.256   5.780
  161   1HD   LYS  25          1HD       LYS  25  -9.730   6.019   8.075
  162   2HD   LYS  25          2HD       LYS  25 -11.328   6.027   7.325
  163   1HE   LYS  25          1HE       LYS  25 -11.627   3.677   7.980
  164   2HE   LYS  25          2HE       LYS  25 -10.038   3.693   8.749
  165   1HZ   LYS  25          1HZ       LYS  25 -12.063   5.674   9.552
  166   2HZ   LYS  25          2HZ       LYS  25 -12.160   4.089  10.147
  167   3HZ   LYS  25          3HZ       LYS  25 -10.772   5.018  10.450
  168    H    TYR  26           H        TYR  26  -5.882   2.618   4.652
  169    HA   TYR  26           HA       TYR  26  -5.589   0.337   6.474
  170   1HB   TYR  26          1HB       TYR  26  -4.111   0.928   3.917
  171   2HB   TYR  26          2HB       TYR  26  -3.910  -0.498   4.922
  172    HD1  TYR  26           1HD      TYR  26  -7.007  -0.699   5.495
  173    HD2  TYR  26           2HD      TYR  26  -4.678  -0.341   1.962
  174    HE1  TYR  26           1HE      TYR  26  -8.739  -1.879   4.226
  175    HE2  TYR  26           2HE      TYR  26  -6.403  -1.513   0.694
  176    HH   TYR  26           HH       TYR  26  -9.224  -1.775   1.251
  177    H    GLU  27           H        GLU  27  -4.395   0.608   8.103
  178    HA   GLU  27           HA       GLU  27  -2.468   2.769   8.316
  179   1HB   GLU  27          1HB       GLU  27  -3.392   0.712  10.325
  180   2HB   GLU  27          2HB       GLU  27  -2.410   2.110  10.674
  181   1HG   GLU  27          1HG       GLU  27  -4.151   3.592  10.414
  182   2HG   GLU  27          2HG       GLU  27  -5.088   2.467   9.433
  183    H    SER  28           H        SER  28  -2.618  -0.547   7.688
  184    HA   SER  28           HA       SER  28   0.299  -0.777   7.833
  185   1HB   SER  28          1HB       SER  28  -0.293  -3.280   8.251
  186   2HB   SER  28          2HB       SER  28  -0.424  -2.163   9.608
  187    HG   SER  28           HG       SER  28  -2.285  -3.494   9.422
  188    H    CYS  29           H        CYS  29   0.764  -2.987   6.419
  189    HA   CYS  29           HA       CYS  29  -0.017  -2.245   3.798
  190   1HB   CYS  29          1HB       CYS  29   1.342  -4.723   4.829
  191   2HB   CYS  29          2HB       CYS  29   1.086  -4.396   3.126
  192    H    THR  30           H        THR  30  -0.929  -3.968   2.292
  193    HA   THR  30           HA       THR  30  -3.039  -5.551   3.558
  194    HB   THR  30           HB       THR  30  -3.988  -3.258   3.134
  195    HG1  THR  30           1HG      THR  30  -5.545  -4.732   3.075
  196   1HG2  THR  30          1HG2      THR  30  -4.537  -3.215   0.469
  197   2HG2  THR  30          2HG2      THR  30  -3.295  -2.249   1.268
  198   3HG2  THR  30          3HG2      THR  30  -2.865  -3.771   0.489
  199    H    SER  31           H        SER  31  -4.313  -6.678   1.779
  200    HA   SER  31           HA       SER  31  -2.579  -7.361  -0.483
  201   1HB   SER  31          1HB       SER  31  -3.510  -9.720  -0.242
  202   2HB   SER  31          2HB       SER  31  -2.379  -9.204   1.020
  203    HG   SER  31           HG       SER  31  -5.084  -9.813   1.182
  204    H    ALA  32           H        ALA  32  -4.858  -5.563   0.168
  205    HA   ALA  32           HA       ALA  32  -7.271  -6.372  -0.970
  206   1HB   ALA  32          1HB       ALA  32  -6.519  -4.204   0.391
  207   2HB   ALA  32          2HB       ALA  32  -6.436  -3.526  -1.236
  208   3HB   ALA  32          3HB       ALA  32  -7.951  -4.204  -0.639
  209    H    GLY  33           H        GLY  33  -8.070  -6.448  -2.978
  210   1HA   GLY  33          1HA       GLY  33  -8.184  -6.252  -5.277
  211   2HA   GLY  33          2HA       GLY  33  -6.867  -5.093  -5.197
  212    H    ARG  34           H        ARG  34  -5.606  -7.524  -3.549
  213    HA   ARG  34           HA       ARG  34  -4.453  -8.744  -5.958
  214   1HB   ARG  34          1HB       ARG  34  -3.279  -8.481  -3.183
  215   2HB   ARG  34          2HB       ARG  34  -2.504  -9.254  -4.544
  216   1HG   ARG  34          1HG       ARG  34  -2.887  -6.877  -5.640
  217   2HG   ARG  34          2HG       ARG  34  -2.874  -6.380  -3.951
  218   1HD   ARG  34          1HD       ARG  34  -0.635  -6.302  -5.003
  219   2HD   ARG  34          2HD       ARG  34  -0.711  -7.391  -3.615
  220    HE   ARG  34           HE       ARG  34  -0.213  -9.138  -4.998
  221   1HH1  ARG  34          1HH1      ARG  34  -1.345  -6.473  -6.965
  222   2HH1  ARG  34          2HH1      ARG  34  -0.970  -7.255  -8.467
  223   1HH2  ARG  34          1HH2      ARG  34   0.233 -10.188  -6.975
  224   2HH2  ARG  34          2HH2      ARG  34  -0.108  -9.381  -8.475
  225    H    SER  35           H        SER  35  -4.006  -9.932  -2.747
  226    HA   SER  35           HA       SER  35  -4.463 -11.868  -1.690
  227   1HB   SER  35          1HB       SER  35  -6.894 -11.130  -2.358
  228   2HB   SER  35          2HB       SER  35  -6.771 -12.448  -3.523
  229    HG   SER  35           HG       SER  35  -7.177 -13.766  -1.941
  230    H    ASP  36           H        ASP  36  -2.684 -11.707  -3.903
  231    HA   ASP  36           HA       ASP  36  -2.959 -14.326  -5.168
  232   1HB   ASP  36          1HB       ASP  36  -1.742 -13.505  -6.943
  233   2HB   ASP  36          2HB       ASP  36  -2.498 -12.033  -6.377
  234    H    GLY  37           H        GLY  37  -1.058 -12.392  -3.097
  235   1HA   GLY  37          1HA       GLY  37   0.099 -14.213  -1.511
  236   2HA   GLY  37          2HA       GLY  37   1.134 -14.276  -2.931
  237    H    LYS  38           H        LYS  38   1.323 -11.655  -3.690
  238    HA   LYS  38           HA       LYS  38   3.083 -10.624  -1.674
  239   1HB   LYS  38          1HB       LYS  38   2.215  -9.041  -4.051
  240   2HB   LYS  38          2HB       LYS  38   3.792  -9.108  -3.275
  241   1HG   LYS  38          1HG       LYS  38   2.637 -11.364  -4.874
  242   2HG   LYS  38          2HG       LYS  38   3.648 -10.115  -5.549
  243   1HD   LYS  38          1HD       LYS  38   5.346 -10.739  -3.738
  244   2HD   LYS  38          2HD       LYS  38   4.377 -12.199  -3.520
  245   1HE   LYS  38          1HE       LYS  38   5.779 -11.297  -6.040
  246   2HE   LYS  38          2HE       LYS  38   6.198 -12.672  -5.023
  247   1HZ   LYS  38          1HZ       LYS  38   3.755 -13.384  -5.584
  248   2HZ   LYS  38          2HZ       LYS  38   3.977 -12.374  -6.924
  249   3HZ   LYS  38          3HZ       LYS  38   5.021 -13.687  -6.678
  250    H    MET  39           H        MET  39   2.527  -9.230  -0.085
  251    HA   MET  39           HA       MET  39  -0.034  -7.849  -0.279
  252   1HB   MET  39          1HB       MET  39   1.975  -8.059   1.978
  253   2HB   MET  39          2HB       MET  39   0.480  -7.137   2.058
  254   1HG   MET  39          1HG       MET  39  -0.827  -9.145   1.795
  255   2HG   MET  39          2HG       MET  39   0.629 -10.105   1.573
  256   1HE   MET  39          1HE       MET  39   2.434 -10.242   3.090
  257   2HE   MET  39          2HE       MET  39   2.577  -9.074   4.405
  258   3HE   MET  39          3HE       MET  39   2.129 -10.745   4.750
  259    H    TRP  40           H        TRP  40  -0.139  -5.558  -0.274
  260    HA   TRP  40           HA       TRP  40   2.425  -4.239  -0.876
  261   1HB   TRP  40          1HB       TRP  40   1.254  -2.933  -2.622
  262   2HB   TRP  40          2HB       TRP  40   1.246  -4.664  -2.968
  263    HD1  TRP  40           HD1      TRP  40  -1.218  -5.929  -2.186
  264    HE1  TRP  40           1HE      TRP  40  -3.600  -4.984  -2.378
  265    HE3  TRP  40           3HE      TRP  40  -0.093  -0.993  -2.746
  266    HZ2  TRP  40           2HZ      TRP  40  -4.832  -2.479  -2.689
  267    HZ3  TRP  40           3HZ      TRP  40  -1.924   0.617  -2.962
  268    HH2  TRP  40           HH2      TRP  40  -4.247  -0.114  -2.943
  269    H    CYS  41           H        CYS  41   1.563  -1.739  -1.336
  270    HA   CYS  41           HA       CYS  41  -0.116  -0.704   0.771
  271   1HB   CYS  41          1HB       CYS  41   1.707   0.695   1.736
  272   2HB   CYS  41          2HB       CYS  41   1.952  -1.022   2.039
  273    H    ALA  42           H        ALA  42  -0.796   1.429   0.229
  274    HA   ALA  42           HA       ALA  42  -0.174   2.178  -2.488
  275   1HB   ALA  42          1HB       ALA  42  -1.859   3.624  -0.449
  276   2HB   ALA  42          2HB       ALA  42  -1.702   4.059  -2.152
  277   3HB   ALA  42          3HB       ALA  42  -2.444   2.524  -1.701
  278    H    THR  43           H        THR  43   0.761   4.139  -3.142
  279    HA   THR  43           HA       THR  43   2.691   5.131  -1.178
  280    HB   THR  43           HB       THR  43   4.049   5.767  -3.107
  281    HG1  THR  43           1HG      THR  43   2.923   6.182  -4.843
  282   1HG2  THR  43          1HG2      THR  43   3.682   3.246  -4.216
  283   2HG2  THR  43          2HG2      THR  43   4.813   3.694  -2.937
  284   3HG2  THR  43          3HG2      THR  43   3.210   3.085  -2.525
  285    H    THR  44           H        THR  44  -0.203   5.860  -1.858
  286    HA   THR  44           HA       THR  44   0.185   8.755  -1.687
  287    HB   THR  44           HB       THR  44  -1.928   9.020  -3.049
  288    HG1  THR  44           1HG      THR  44  -2.941   7.269  -3.523
  289   1HG2  THR  44          1HG2      THR  44   0.270   7.692  -4.610
  290   2HG2  THR  44          2HG2      THR  44  -0.934   8.837  -5.207
  291   3HG2  THR  44          3HG2      THR  44   0.305   9.371  -4.067
  292    H    ALA  45           H        ALA  45  -1.409   9.790  -0.376
  293    HA   ALA  45           HA       ALA  45  -2.302   8.360   1.842
  294   1HB   ALA  45          1HB       ALA  45  -3.088  11.028   0.725
  295   2HB   ALA  45          2HB       ALA  45  -3.835  10.385   2.185
  296   3HB   ALA  45          3HB       ALA  45  -2.094  10.661   2.137
  297    H    ASN  46           H        ASN  46  -3.989   9.126  -1.151
  298    HA   ASN  46           HA       ASN  46  -6.118   7.289  -0.299
  299   1HB   ASN  46          1HB       ASN  46  -6.900   9.681  -0.358
  300   2HB   ASN  46          2HB       ASN  46  -6.557   9.694  -2.086
  301   1HD2  ASN  46          1HD2      ASN  46  -9.965   8.195  -0.669
  302   2HD2  ASN  46          2HD2      ASN  46  -8.803   9.016   0.299
  303    H    TYR  47           H        TYR  47  -5.868   5.520  -1.416
  304    HA   TYR  47           HA       TYR  47  -4.448   5.433  -3.897
  305   1HB   TYR  47          1HB       TYR  47  -4.410   3.621  -2.164
  306   2HB   TYR  47          2HB       TYR  47  -6.065   3.232  -2.611
  307    HD1  TYR  47           1HD      TYR  47  -2.572   3.144  -3.654
  308    HD2  TYR  47           2HD      TYR  47  -6.555   2.122  -4.706
  309    HE1  TYR  47           1HE      TYR  47  -1.720   1.657  -5.404
  310    HE2  TYR  47           2HE      TYR  47  -5.710   0.618  -6.459
  311    HH   TYR  47           HH       TYR  47  -3.140  -0.683  -6.703
  312    H    ASP  48           H        ASP  48  -7.847   5.309  -2.984
  313    HA   ASP  48           HA       ASP  48  -8.953   4.296  -5.294
  314   1HB   ASP  48          1HB       ASP  48  -9.945   6.178  -3.209
  315   2HB   ASP  48          2HB       ASP  48 -10.916   5.917  -4.656
  316    H    ASP  49           H        ASP  49  -7.710   7.530  -4.766
  317    HA   ASP  49           HA       ASP  49  -8.855   8.497  -7.246
  318   1HB   ASP  49          1HB       ASP  49  -7.154   9.790  -5.128
  319   2HB   ASP  49          2HB       ASP  49  -7.569  10.598  -6.629
  320    H    ASP  50           H        ASP  50  -5.501   8.337  -5.958
  321    HA   ASP  50           HA       ASP  50  -4.467   8.737  -8.629
  322   1HB   ASP  50          1HB       ASP  50  -3.328   8.785  -5.900
  323   2HB   ASP  50          2HB       ASP  50  -2.226   8.414  -7.223
  324    H    ARG  51           H        ARG  51  -5.045   5.987  -6.665
  325    HA   ARG  51           HA       ARG  51  -4.410   3.829  -6.755
  326   1HB   ARG  51          1HB       ARG  51  -4.628   4.425  -9.684
  327   2HB   ARG  51          2HB       ARG  51  -4.732   2.828  -8.943
  328   1HG   ARG  51          1HG       ARG  51  -6.531   4.308  -7.510
  329   2HG   ARG  51          2HG       ARG  51  -6.742   4.912  -9.159
  330   1HD   ARG  51          1HD       ARG  51  -6.811   2.041  -8.285
  331   2HD   ARG  51          2HD       ARG  51  -8.215   3.038  -8.673
  332    HE   ARG  51           HE       ARG  51  -6.541   3.107 -10.890
  333   1HH1  ARG  51          1HH1      ARG  51  -8.301   0.677  -9.098
  334   2HH1  ARG  51          2HH1      ARG  51  -8.607  -0.311 -10.495
  335   1HH2  ARG  51          1HH2      ARG  51  -6.870   1.801 -12.698
  336   2HH2  ARG  51          2HH2      ARG  51  -7.788   0.329 -12.551
  337    H    LYS  52           H        LYS  52  -2.152   5.110  -6.190
  338    HA   LYS  52           HA       LYS  52  -0.172   3.848  -7.935
  339   1HB   LYS  52          1HB       LYS  52   0.103   6.240  -6.103
  340   2HB   LYS  52          2HB       LYS  52   1.487   5.410  -6.803
  341   1HG   LYS  52          1HG       LYS  52   0.835   5.982  -9.000
  342   2HG   LYS  52          2HG       LYS  52  -0.739   6.555  -8.458
  343   1HD   LYS  52          1HD       LYS  52   0.400   8.351  -7.185
  344   2HD   LYS  52          2HD       LYS  52   1.945   7.788  -7.834
  345   1HE   LYS  52          1HE       LYS  52   1.058   9.707  -9.086
  346   2HE   LYS  52          2HE       LYS  52   1.217   8.264 -10.090
  347   1HZ   LYS  52          1HZ       LYS  52  -1.317   9.225  -8.858
  348   2HZ   LYS  52          2HZ       LYS  52  -0.883   9.418 -10.487
  349   3HZ   LYS  52          3HZ       LYS  52  -1.147   7.865  -9.861
  350    H    TRP  53           H        TRP  53   0.587   2.040  -7.197
  351    HA   TRP  53           HA       TRP  53   0.665   1.644  -4.289
  352   1HB   TRP  53          1HB       TRP  53  -0.062  -0.618  -4.627
  353   2HB   TRP  53          2HB       TRP  53  -1.182   0.453  -5.377
  354    HD1  TRP  53           HD1      TRP  53  -0.700   0.740  -8.225
  355    HE1  TRP  53           1HE      TRP  53  -0.140  -1.193  -9.851
  356    HE3  TRP  53           3HE      TRP  53   0.880  -2.583  -4.823
  357    HZ2  TRP  53           2HZ      TRP  53   0.862  -3.855  -9.654
  358    HZ3  TRP  53           3HZ      TRP  53   1.631  -4.839  -5.561
  359    HH2  TRP  53           HH2      TRP  53   1.616  -5.449  -7.937
  360    H    GLY  54           H        GLY  54   1.851  -0.329  -3.693
  361   1HA   GLY  54          1HA       GLY  54   4.097  -1.227  -5.207
  362   2HA   GLY  54          2HA       GLY  54   4.565  -0.067  -3.963
  363    H    PHE  55           H        PHE  55   4.818  -3.124  -4.335
  364    HA   PHE  55           HA       PHE  55   3.330  -4.441  -2.411
  365   1HB   PHE  55          1HB       PHE  55   6.098  -4.919  -3.493
  366   2HB   PHE  55          2HB       PHE  55   5.348  -5.999  -2.339
  367    HD1  PHE  55           1HD      PHE  55   2.519  -5.742  -3.499
  368    HD2  PHE  55           2HD      PHE  55   6.311  -6.465  -5.283
  369    HE1  PHE  55           1HE      PHE  55   1.428  -7.062  -5.274
  370    HE2  PHE  55           2HE      PHE  55   5.235  -7.770  -7.068
  371    HZ   PHE  55           HZ       PHE  55   2.787  -8.060  -7.075
  372    H    CYS  56           H        CYS  56   3.876  -5.139  -0.309
  373    HA   CYS  56           HA       CYS  56   4.843  -3.082   1.399
  374   1HB   CYS  56          1HB       CYS  56   3.090  -4.908   1.884
  375   2HB   CYS  56          2HB       CYS  56   4.459  -5.979   2.154
  376    HA   PRO  57           HA       PRO  57   9.137  -4.198   1.460
  377   1HB   PRO  57          1HB       PRO  57   9.991  -3.012   3.667
  378   2HB   PRO  57          2HB       PRO  57   9.376  -2.044   2.313
  379   1HG   PRO  57          1HG       PRO  57   7.908  -3.051   4.699
  380   2HG   PRO  57          2HG       PRO  57   8.042  -1.358   4.169
  381   1HD   PRO  57          1HD       PRO  57   5.889  -2.811   3.520
  382   2HD   PRO  57          2HD       PRO  57   6.633  -1.732   2.314
  383    H    ASP  58           H        ASP  58  10.618  -4.624   3.771
  384    HA   ASP  58           HA       ASP  58  11.337  -6.271   5.145
  385   1HB   ASP  58          1HB       ASP  58   9.366  -5.548   6.446
  386   2HB   ASP  58          2HB       ASP  58   8.391  -6.713   5.576
  387    H    GLN  59           H        GLN  59  10.277  -6.706   2.319
  388    HA   GLN  59           HA       GLN  59  10.840  -9.559   2.180
  389   1HB   GLN  59          1HB       GLN  59   8.448  -8.327   0.790
  390   2HB   GLN  59          2HB       GLN  59   8.970  -9.997   0.671
  391   1HG   GLN  59          1HG       GLN  59   8.472 -10.291   3.054
  392   2HG   GLN  59          2HG       GLN  59   7.897  -8.625   3.122
  393   1HE2  GLN  59          1HE2      GLN  59   4.708  -9.507   2.193
  394   2HE2  GLN  59          2HE2      GLN  59   5.790  -8.462   3.043
  395    H    GLY  60           H        GLY  60  10.580  -9.974  -0.487
  396   1HA   GLY  60          1HA       GLY  60  11.056  -8.885  -2.616
  397   2HA   GLY  60          2HA       GLY  60  12.081  -7.758  -1.736
  Start of MODEL   30
    1    H    SER   1           1H       SER   1  13.539   2.978  10.429
    2    HA   SER   1           HA       SER   1  15.107   4.629   9.385
    3   1HB   SER   1          1HB       SER   1  16.150   3.584   7.296
    4   2HB   SER   1          2HB       SER   1  16.928   3.208   8.834
    5    HG   SER   1           HG       SER   1  16.358   1.431   7.200
    6    H    TRP   2           H        TRP   2  14.287   5.646   7.510
    7    HA   TRP   2           HA       TRP   2  11.585   4.866   6.870
    8   1HB   TRP   2          1HB       TRP   2  12.531   7.271   7.108
    9   2HB   TRP   2          2HB       TRP   2  13.149   7.031   5.475
   10    HD1  TRP   2           HD1      TRP   2  11.135   6.386   3.594
   11    HE1  TRP   2           1HE      TRP   2   8.779   7.399   3.406
   12    HE3  TRP   2           3HE      TRP   2  10.689   8.256   8.310
   13    HZ2  TRP   2           2HZ      TRP   2   6.952   8.785   5.050
   14    HZ3  TRP   2           3HZ      TRP   2   8.608   9.399   8.936
   15    HH2  TRP   2           HH2      TRP   2   6.774   9.661   7.338
   16    H    MET   3           H        MET   3  11.283   3.218   5.499
   17    HA   MET   3           HA       MET   3  13.216   2.756   3.359
   18   1HB   MET   3          1HB       MET   3  10.934   0.994   4.253
   19   2HB   MET   3          2HB       MET   3  12.269   0.548   3.204
   20   1HG   MET   3          1HG       MET   3  13.833   0.846   5.052
   21   2HG   MET   3          2HG       MET   3  12.493   1.298   6.106
   22   1HE   MET   3          1HE       MET   3  13.987  -1.398   3.820
   23   2HE   MET   3          2HE       MET   3  13.146  -2.877   4.283
   24   3HE   MET   3          3HE       MET   3  12.301  -1.640   3.352
   25    H    SER   4           H        SER   4  12.195   1.663   1.386
   26    HA   SER   4           HA       SER   4  10.056   3.407   0.364
   27   1HB   SER   4          1HB       SER   4  12.205   1.912  -1.160
   28   2HB   SER   4          2HB       SER   4  10.988   2.977  -1.867
   29    HG   SER   4           HG       SER   4  12.137   4.644  -1.303
   30    H    THR   5           H        THR   5   9.589   1.806  -1.956
   31    HA   THR   5           HA       THR   5   8.107  -0.371  -0.677
   32    HB   THR   5           HB       THR   5   6.816  -0.237  -2.923
   33    HG1  THR   5           1HG      THR   5   7.829   1.144  -4.178
   34   1HG2  THR   5          1HG2      THR   5   6.235   2.277  -1.622
   35   2HG2  THR   5          2HG2      THR   5   5.225   0.843  -1.826
   36   3HG2  THR   5          3HG2      THR   5   6.371   0.935  -0.486
   37    H    VAL   6           H        VAL   6   7.532  -2.149  -2.191
   38    HA   VAL   6           HA       VAL   6   9.602  -2.974  -4.045
   39    HB   VAL   6           HB       VAL   6  10.372  -4.339  -2.381
   40   1HG1  VAL   6          1HG1      VAL   6   7.685  -4.050  -1.099
   41   2HG1  VAL   6          2HG1      VAL   6   8.904  -5.163  -0.482
   42   3HG1  VAL   6          3HG1      VAL   6   9.239  -3.431  -0.533
   43   1HG2  VAL   6          1HG2      VAL   6   7.999  -5.719  -3.477
   44   2HG2  VAL   6          2HG2      VAL   6   9.709  -6.139  -3.607
   45   3HG2  VAL   6          3HG2      VAL   6   8.832  -6.449  -2.108
   46    H    GLY   7           H        GLY   7   8.529  -4.715  -5.497
   47   1HA   GLY   7          1HA       GLY   7   6.612  -5.413  -6.668
   48   2HA   GLY   7          2HA       GLY   7   5.736  -5.163  -5.182
   49    H    GLY   8           H        GLY   8   3.978  -4.301  -6.421
   50   1HA   GLY   8          1HA       GLY   8   2.780  -2.633  -7.499
   51   2HA   GLY   8          2HA       GLY   8   3.555  -1.657  -6.281
   52    H    ASN   9           H        ASN   9   3.792   0.191  -7.403
   53    HA   ASN   9           HA       ASN   9   5.809   0.144  -9.505
   54   1HB   ASN   9          1HB       ASN   9   4.314   2.053 -10.602
   55   2HB   ASN   9          2HB       ASN   9   4.060   0.367 -11.006
   56   1HD2  ASN   9          1HD2      ASN   9   1.039   2.469  -9.601
   57   2HD2  ASN   9          2HD2      ASN   9   2.510   3.128 -10.217
   58    H    SER  10           H        SER  10   3.884   2.892  -8.885
   59    HA   SER  10           HA       SER  10   4.477   5.014  -8.319
   60   1HB   SER  10          1HB       SER  10   5.053   3.648  -5.723
   61   2HB   SER  10          2HB       SER  10   4.299   5.210  -6.000
   62    HG   SER  10           HG       SER  10   3.196   2.690  -6.038
   63    H    GLY  11           H        GLY  11   6.890   3.699  -9.412
   64   1HA   GLY  11          1HA       GLY  11   9.137   4.155  -9.594
   65   2HA   GLY  11          2HA       GLY  11   8.823   5.608  -8.658
   66    H    GLY  12           H        GLY  12   8.990   5.540  -6.412
   67   1HA   GLY  12          1HA       GLY  12   9.882   3.170  -5.048
   68   2HA   GLY  12          2HA       GLY  12  11.150   4.374  -5.269
   69    H    ALA  13           H        ALA  13   7.793   5.198  -4.913
   70    HA   ALA  13           HA       ALA  13   8.336   6.955  -2.731
   71   1HB   ALA  13          1HB       ALA  13   5.984   6.249  -4.379
   72   2HB   ALA  13          2HB       ALA  13   5.667   6.914  -2.774
   73   3HB   ALA  13          3HB       ALA  13   6.626   7.831  -3.935
   74    HA   PRO  14           HA       PRO  14   7.560   4.184   0.628
   75   1HB   PRO  14          1HB       PRO  14   6.907   6.389   2.363
   76   2HB   PRO  14          2HB       PRO  14   8.413   5.471   2.280
   77   1HG   PRO  14          1HG       PRO  14   8.137   8.120   1.540
   78   2HG   PRO  14          2HG       PRO  14   9.431   7.040   0.990
   79   1HD   PRO  14          1HD       PRO  14   6.954   7.916  -0.436
   80   2HD   PRO  14          2HD       PRO  14   8.573   7.569  -1.076
   81    H    CYS  15           H        CYS  15   5.850   3.294   1.803
   82    HA   CYS  15           HA       CYS  15   3.231   3.887   0.817
   83   1HB   CYS  15          1HB       CYS  15   4.150   2.052   3.053
   84   2HB   CYS  15          2HB       CYS  15   2.487   2.172   2.494
   85    H    VAL  16           H        VAL  16   1.711   5.200   1.648
   86    HA   VAL  16           HA       VAL  16   2.334   6.618   4.137
   87    HB   VAL  16           HB       VAL  16   0.307   7.290   1.987
   88   1HG1  VAL  16          1HG1      VAL  16   0.827   8.401   4.656
   89   2HG1  VAL  16          2HG1      VAL  16   0.733   9.590   3.358
   90   3HG1  VAL  16          3HG1      VAL  16  -0.618   8.489   3.650
   91   1HG2  VAL  16          1HG2      VAL  16   3.088   7.643   2.011
   92   2HG2  VAL  16          2HG2      VAL  16   1.919   8.326   0.880
   93   3HG2  VAL  16          3HG2      VAL  16   2.378   9.227   2.323
   94    H    PHE  17           H        PHE  17   1.182   6.279   5.945
   95    HA   PHE  17           HA       PHE  17  -1.370   4.860   5.681
   96   1HB   PHE  17          1HB       PHE  17   0.672   4.655   7.896
   97   2HB   PHE  17          2HB       PHE  17  -0.907   3.900   7.910
   98    HD1  PHE  17           1HD      PHE  17  -1.406   2.013   6.422
   99    HD2  PHE  17           2HD      PHE  17   2.458   3.769   6.611
  100    HE1  PHE  17           1HE      PHE  17  -0.461   0.036   5.323
  101    HE2  PHE  17           2HE      PHE  17   3.420   1.801   5.499
  102    HZ   PHE  17           HZ       PHE  17   1.971  -0.098   4.843
  103    HA   PRO  18           HA       PRO  18  -2.940   4.309   6.867
  104   1HB   PRO  18          1HB       PRO  18  -5.555   5.375   7.128
  105   2HB   PRO  18          2HB       PRO  18  -4.704   4.349   8.280
  106   1HG   PRO  18          1HG       PRO  18  -5.419   7.018   8.693
  107   2HG   PRO  18          2HG       PRO  18  -4.232   6.106   9.638
  108   1HD   PRO  18          1HD       PRO  18  -3.802   8.064   7.434
  109   2HD   PRO  18          2HD       PRO  18  -2.816   7.754   8.878
  110    H    PHE  19           H        PHE  19  -3.340   3.674   4.816
  111    HA   PHE  19           HA       PHE  19  -4.199   5.759   2.932
  112   1HB   PHE  19          1HB       PHE  19  -3.319   4.417   1.145
  113   2HB   PHE  19          2HB       PHE  19  -2.083   4.588   2.382
  114    HD1  PHE  19           1HD      PHE  19  -4.343   2.274   0.675
  115    HD2  PHE  19           2HD      PHE  19  -1.348   2.678   3.668
  116    HE1  PHE  19           1HE      PHE  19  -4.029  -0.160   0.675
  117    HE2  PHE  19           2HE      PHE  19  -1.036   0.236   3.681
  118    HZ   PHE  19           HZ       PHE  19  -2.369  -1.183   2.178
  119    H    THR  20           H        THR  20  -6.112   5.653   1.974
  120    HA   THR  20           HA       THR  20  -7.872   3.549   2.929
  121    HB   THR  20           HB       THR  20  -8.710   5.896   1.227
  122    HG1  THR  20           1HG      THR  20  -8.162   7.222   2.737
  123   1HG2  THR  20          1HG2      THR  20 -10.465   5.614   3.322
  124   2HG2  THR  20          2HG2      THR  20 -10.713   5.054   1.668
  125   3HG2  THR  20          3HG2      THR  20 -10.073   3.949   2.889
  126    H    PHE  21           H        PHE  21  -8.482   1.892   1.828
  127    HA   PHE  21           HA       PHE  21  -8.502   2.017  -1.117
  128   1HB   PHE  21          1HB       PHE  21  -6.667   0.537   0.017
  129   2HB   PHE  21          2HB       PHE  21  -8.008  -0.525   0.391
  130    HD1  PHE  21           1HD      PHE  21  -8.581   1.198  -2.685
  131    HD2  PHE  21           2HD      PHE  21  -6.578  -2.130  -0.957
  132    HE1  PHE  21           1HE      PHE  21  -8.441   0.120  -4.880
  133    HE2  PHE  21           2HE      PHE  21  -6.434  -3.204  -3.143
  134    HZ   PHE  21           HZ       PHE  21  -7.356  -2.067  -5.131
  135    H    LEU  22           H        LEU  22 -10.296   0.988  -2.028
  136    HA   LEU  22           HA       LEU  22 -12.511   0.676  -2.183
  137   1HB   LEU  22          1HB       LEU  22 -11.439  -1.458  -0.449
  138   2HB   LEU  22          2HB       LEU  22 -12.988  -1.593  -1.265
  139    HG   LEU  22           HG       LEU  22 -11.814  -2.513  -2.943
  140   1HD1  LEU  22          1HD1      LEU  22 -11.207   0.258  -3.263
  141   2HD1  LEU  22          2HD1      LEU  22 -10.083  -0.838  -4.071
  142   3HD1  LEU  22          3HD1      LEU  22 -11.810  -0.921  -4.425
  143   1HD2  LEU  22          1HD2      LEU  22  -9.798  -2.154  -1.051
  144   2HD2  LEU  22          2HD2      LEU  22 -10.015  -3.436  -2.242
  145   3HD2  LEU  22          3HD2      LEU  22  -9.156  -1.960  -2.682
  146    H    GLY  23           H        GLY  23 -11.983   2.584  -0.084
  147   1HA   GLY  23          1HA       GLY  23 -13.504   3.724   1.274
  148   2HA   GLY  23          2HA       GLY  23 -14.487   2.276   1.358
  149    H    ASN  24           H        ASN  24 -11.482   1.153   2.175
  150    HA   ASN  24           HA       ASN  24 -12.061   1.601   5.028
  151   1HB   ASN  24          1HB       ASN  24 -10.454  -0.586   3.697
  152   2HB   ASN  24          2HB       ASN  24 -10.874  -0.505   5.397
  153   1HD2  ASN  24          1HD2      ASN  24 -13.266  -2.321   2.852
  154   2HD2  ASN  24          2HD2      ASN  24 -11.619  -1.895   2.562
  155    H    LYS  25           H        LYS  25 -10.537   2.410   6.387
  156    HA   LYS  25           HA       LYS  25  -8.226   3.675   5.274
  157   1HB   LYS  25          1HB       LYS  25  -9.158   3.380   8.138
  158   2HB   LYS  25          2HB       LYS  25  -7.955   4.493   7.550
  159   1HG   LYS  25          1HG       LYS  25 -10.814   4.535   6.654
  160   2HG   LYS  25          2HG       LYS  25 -10.175   5.526   7.969
  161   1HD   LYS  25          1HD       LYS  25  -9.087   5.565   5.155
  162   2HD   LYS  25          2HD       LYS  25 -10.340   6.667   5.736
  163   1HE   LYS  25          1HE       LYS  25  -8.848   7.625   7.339
  164   2HE   LYS  25          2HE       LYS  25  -7.628   6.387   7.040
  165   1HZ   LYS  25          1HZ       LYS  25  -7.590   7.280   4.683
  166   2HZ   LYS  25          2HZ       LYS  25  -8.453   8.617   5.275
  167   3HZ   LYS  25          3HZ       LYS  25  -6.903   8.270   5.882
  168    H    TYR  26           H        TYR  26  -6.322   2.609   5.004
  169    HA   TYR  26           HA       TYR  26  -5.881   0.203   6.609
  170   1HB   TYR  26          1HB       TYR  26  -4.641   1.106   4.012
  171   2HB   TYR  26          2HB       TYR  26  -4.194  -0.357   4.879
  172    HD1  TYR  26           1HD      TYR  26  -7.436  -0.363   5.633
  173    HD2  TYR  26           2HD      TYR  26  -5.027  -0.645   2.160
  174    HE1  TYR  26           1HE      TYR  26  -9.213  -1.609   4.510
  175    HE2  TYR  26           2HE      TYR  26  -6.793  -1.897   1.025
  176    HH   TYR  26           HH       TYR  26  -8.953  -3.501   2.180
  177    H    GLU  27           H        GLU  27  -4.819   0.553   8.330
  178    HA   GLU  27           HA       GLU  27  -2.793   2.619   8.546
  179   1HB   GLU  27          1HB       GLU  27  -3.937   0.691  10.554
  180   2HB   GLU  27          2HB       GLU  27  -2.800   1.961  10.922
  181   1HG   GLU  27          1HG       GLU  27  -4.383   3.654  10.353
  182   2HG   GLU  27          2HG       GLU  27  -5.507   2.441   9.732
  183    H    SER  28           H        SER  28  -3.037  -0.684   7.916
  184    HA   SER  28           HA       SER  28  -0.140  -1.019   8.187
  185   1HB   SER  28          1HB       SER  28  -0.818  -3.498   8.578
  186   2HB   SER  28          2HB       SER  28  -0.946  -2.382   9.931
  187    HG   SER  28           HG       SER  28  -3.077  -2.511   9.859
  188    H    CYS  29           H        CYS  29   0.464  -3.095   6.749
  189    HA   CYS  29           HA       CYS  29  -0.291  -2.446   4.116
  190   1HB   CYS  29          1HB       CYS  29   0.987  -4.960   5.169
  191   2HB   CYS  29          2HB       CYS  29   0.772  -4.610   3.474
  192    H    THR  30           H        THR  30  -1.305  -3.950   2.609
  193    HA   THR  30           HA       THR  30  -3.437  -5.573   3.806
  194    HB   THR  30           HB       THR  30  -4.329  -3.251   3.308
  195    HG1  THR  30           1HG      THR  30  -5.827  -4.874   3.209
  196   1HG2  THR  30          1HG2      THR  30  -4.744  -3.159   0.649
  197   2HG2  THR  30          2HG2      THR  30  -3.438  -2.311   1.476
  198   3HG2  THR  30          3HG2      THR  30  -3.126  -3.861   0.695
  199    H    SER  31           H        SER  31  -4.712  -6.526   1.851
  200    HA   SER  31           HA       SER  31  -2.892  -7.309  -0.293
  201   1HB   SER  31          1HB       SER  31  -3.947  -9.648  -0.038
  202   2HB   SER  31          2HB       SER  31  -2.712  -9.167   1.139
  203    HG   SER  31           HG       SER  31  -4.203  -8.989   2.676
  204    H    ALA  32           H        ALA  32  -5.272  -5.558   0.364
  205    HA   ALA  32           HA       ALA  32  -7.591  -6.428  -0.929
  206   1HB   ALA  32          1HB       ALA  32  -6.581  -3.979   0.215
  207   2HB   ALA  32          2HB       ALA  32  -7.421  -3.640  -1.297
  208   3HB   ALA  32          3HB       ALA  32  -8.255  -4.491   0.003
  209    H    GLY  33           H        GLY  33  -8.314  -6.350  -2.994
  210   1HA   GLY  33          1HA       GLY  33  -8.297  -5.998  -5.278
  211   2HA   GLY  33          2HA       GLY  33  -6.954  -4.887  -5.053
  212    H    ARG  34           H        ARG  34  -5.911  -7.517  -3.495
  213    HA   ARG  34           HA       ARG  34  -4.632  -8.587  -5.907
  214   1HB   ARG  34          1HB       ARG  34  -3.664  -8.548  -3.049
  215   2HB   ARG  34          2HB       ARG  34  -2.847  -9.363  -4.362
  216   1HG   ARG  34          1HG       ARG  34  -2.951  -6.962  -5.447
  217   2HG   ARG  34          2HG       ARG  34  -3.049  -6.473  -3.763
  218   1HD   ARG  34          1HD       ARG  34  -0.721  -6.541  -4.632
  219   2HD   ARG  34          2HD       ARG  34  -0.982  -7.609  -3.251
  220    HE   ARG  34           HE       ARG  34  -0.518  -9.409  -4.579
  221   1HH1  ARG  34          1HH1      ARG  34  -1.159  -6.659  -6.638
  222   2HH1  ARG  34          2HH1      ARG  34  -0.697  -7.471  -8.100
  223   1HH2  ARG  34          1HH2      ARG  34   0.020 -10.514  -6.509
  224   2HH2  ARG  34          2HH2      ARG  34  -0.027  -9.665  -8.028
  225    H    SER  35           H        SER  35  -5.005  -9.872  -2.633
  226    HA   SER  35           HA       SER  35  -5.725 -11.871  -1.828
  227   1HB   SER  35          1HB       SER  35  -7.479 -11.942  -4.300
  228   2HB   SER  35          2HB       SER  35  -7.703 -12.890  -2.827
  229    HG   SER  35           HG       SER  35  -8.694 -10.527  -3.338
  230    H    ASP  36           H        ASP  36  -3.380 -11.822  -3.374
  231    HA   ASP  36           HA       ASP  36  -3.438 -14.428  -4.718
  232   1HB   ASP  36          1HB       ASP  36  -1.773 -13.642  -6.161
  233   2HB   ASP  36          2HB       ASP  36  -2.866 -12.292  -5.982
  234    H    GLY  37           H        GLY  37  -1.896 -12.407  -2.435
  235   1HA   GLY  37          1HA       GLY  37  -1.045 -13.929  -0.485
  236   2HA   GLY  37          2HA       GLY  37   0.068 -14.483  -1.726
  237    H    LYS  38           H        LYS  38   0.482 -11.997  -3.006
  238    HA   LYS  38           HA       LYS  38   2.502 -10.880  -1.326
  239   1HB   LYS  38          1HB       LYS  38   1.389  -9.868  -3.954
  240   2HB   LYS  38          2HB       LYS  38   2.937  -9.439  -3.234
  241   1HG   LYS  38          1HG       LYS  38   3.840 -11.528  -3.615
  242   2HG   LYS  38          2HG       LYS  38   2.274 -12.270  -3.895
  243   1HD   LYS  38          1HD       LYS  38   2.117 -10.775  -5.948
  244   2HD   LYS  38          2HD       LYS  38   3.831 -10.429  -5.692
  245   1HE   LYS  38          1HE       LYS  38   3.506 -12.235  -7.309
  246   2HE   LYS  38          2HE       LYS  38   4.353 -12.796  -5.867
  247   1HZ   LYS  38          1HZ       LYS  38   1.442 -13.057  -5.843
  248   2HZ   LYS  38          2HZ       LYS  38   2.268 -14.080  -6.917
  249   3HZ   LYS  38          3HZ       LYS  38   2.625 -14.121  -5.261
  250    H    MET  39           H        MET  39   1.983  -9.558   0.337
  251    HA   MET  39           HA       MET  39  -0.387  -7.898   0.183
  252   1HB   MET  39          1HB       MET  39   1.677  -8.146   2.388
  253   2HB   MET  39          2HB       MET  39   0.141  -7.295   2.483
  254   1HG   MET  39          1HG       MET  39  -1.039  -9.415   2.104
  255   2HG   MET  39          2HG       MET  39   0.510 -10.251   2.110
  256   1HE   MET  39          1HE       MET  39  -2.011 -10.947   3.882
  257   2HE   MET  39          2HE       MET  39  -0.530 -11.886   4.064
  258   3HE   MET  39          3HE       MET  39  -1.334 -11.220   5.486
  259    H    TRP  40           H        TRP  40  -0.384  -5.651   0.232
  260    HA   TRP  40           HA       TRP  40   2.207  -4.352  -0.288
  261   1HB   TRP  40          1HB       TRP  40   1.158  -3.060  -2.110
  262   2HB   TRP  40          2HB       TRP  40   1.159  -4.787  -2.457
  263    HD1  TRP  40           HD1      TRP  40  -1.346  -6.040  -1.915
  264    HE1  TRP  40           1HE      TRP  40  -3.702  -5.091  -2.274
  265    HE3  TRP  40           3HE      TRP  40  -0.191  -1.082  -2.208
  266    HZ2  TRP  40           2HZ      TRP  40  -4.904  -2.583  -2.600
  267    HZ3  TRP  40           3HZ      TRP  40  -2.011   0.531  -2.511
  268    HH2  TRP  40           HH2      TRP  40  -4.327  -0.210  -2.713
  269    H    CYS  41           H        CYS  41   1.428  -1.847  -0.758
  270    HA   CYS  41           HA       CYS  41  -0.524  -0.865   1.090
  271   1HB   CYS  41          1HB       CYS  41   1.255   0.585   2.275
  272   2HB   CYS  41          2HB       CYS  41   1.068  -1.083   2.793
  273    H    ALA  42           H        ALA  42  -1.053   1.317   0.619
  274    HA   ALA  42           HA       ALA  42  -0.193   2.162  -1.995
  275   1HB   ALA  42          1HB       ALA  42  -2.530   2.445  -0.937
  276   2HB   ALA  42          2HB       ALA  42  -1.834   3.873  -0.168
  277   3HB   ALA  42          3HB       ALA  42  -1.882   3.751  -1.928
  278    H    THR  43           H        THR  43   0.808   4.120  -2.517
  279    HA   THR  43           HA       THR  43   2.693   4.998  -0.463
  280    HB   THR  43           HB       THR  43   4.017   5.837  -2.305
  281    HG1  THR  43           1HG      THR  43   1.767   6.152  -3.529
  282   1HG2  THR  43          1HG2      THR  43   3.419   3.486  -3.777
  283   2HG2  THR  43          2HG2      THR  43   4.758   3.781  -2.666
  284   3HG2  THR  43          3HG2      THR  43   3.235   3.128  -2.060
  285    H    THR  44           H        THR  44  -0.249   5.799  -1.175
  286    HA   THR  44           HA       THR  44   0.156   8.662  -0.691
  287    HB   THR  44           HB       THR  44  -1.950   9.019  -2.082
  288    HG1  THR  44           1HG      THR  44  -2.861   7.306  -2.848
  289   1HG2  THR  44          1HG2      THR  44  -0.271   8.064  -4.178
  290   2HG2  THR  44          2HG2      THR  44  -0.610   9.722  -3.685
  291   3HG2  THR  44          3HG2      THR  44   0.718   8.834  -2.936
  292    H    ALA  45           H        ALA  45  -1.627   9.644   0.494
  293    HA   ALA  45           HA       ALA  45  -2.577   8.017   2.589
  294   1HB   ALA  45          1HB       ALA  45  -3.308  10.794   1.709
  295   2HB   ALA  45          2HB       ALA  45  -4.049  10.018   3.110
  296   3HB   ALA  45          3HB       ALA  45  -2.309  10.297   3.077
  297    H    ASN  46           H        ASN  46  -3.945   8.847  -0.501
  298    HA   ASN  46           HA       ASN  46  -6.264   7.165   0.148
  299   1HB   ASN  46          1HB       ASN  46  -6.896   9.600  -0.084
  300   2HB   ASN  46          2HB       ASN  46  -6.355   9.517  -1.762
  301   1HD2  ASN  46          1HD2      ASN  46  -9.969   8.235  -0.694
  302   2HD2  ASN  46          2HD2      ASN  46  -8.871   8.988   0.399
  303    H    TYR  47           H        TYR  47  -6.082   5.349  -0.957
  304    HA   TYR  47           HA       TYR  47  -4.506   5.297  -3.394
  305   1HB   TYR  47          1HB       TYR  47  -4.203   3.549  -1.669
  306   2HB   TYR  47          2HB       TYR  47  -5.862   3.019  -1.952
  307    HD1  TYR  47           1HD      TYR  47  -2.490   3.226  -3.411
  308    HD2  TYR  47           2HD      TYR  47  -6.433   1.708  -3.892
  309    HE1  TYR  47           1HE      TYR  47  -1.707   1.800  -5.250
  310    HE2  TYR  47           2HE      TYR  47  -5.653   0.284  -5.732
  311    HH   TYR  47           HH       TYR  47  -3.645   0.474  -7.465
  312    H    ASP  48           H        ASP  48  -7.843   5.106  -2.423
  313    HA   ASP  48           HA       ASP  48  -9.013   3.899  -4.597
  314   1HB   ASP  48          1HB       ASP  48  -9.958   6.116  -2.803
  315   2HB   ASP  48          2HB       ASP  48 -10.969   5.505  -4.107
  316    H    ASP  49           H        ASP  49  -7.915   7.228  -4.265
  317    HA   ASP  49           HA       ASP  49  -8.856   7.888  -6.934
  318   1HB   ASP  49          1HB       ASP  49  -7.631   9.486  -4.695
  319   2HB   ASP  49          2HB       ASP  49  -7.899  10.166  -6.298
  320    H    ASP  50           H        ASP  50  -5.779   8.397  -5.228
  321    HA   ASP  50           HA       ASP  50  -4.277   8.912  -7.538
  322   1HB   ASP  50          1HB       ASP  50  -3.405   8.060  -4.777
  323   2HB   ASP  50          2HB       ASP  50  -2.295   8.599  -6.032
  324    H    ARG  51           H        ARG  51  -5.042   5.865  -6.004
  325    HA   ARG  51           HA       ARG  51  -4.353   3.745  -6.329
  326   1HB   ARG  51          1HB       ARG  51  -4.609   4.647  -9.177
  327   2HB   ARG  51          2HB       ARG  51  -4.737   2.991  -8.594
  328   1HG   ARG  51          1HG       ARG  51  -6.500   4.212  -6.985
  329   2HG   ARG  51          2HG       ARG  51  -6.661   5.202  -8.440
  330   1HD   ARG  51          1HD       ARG  51  -6.629   2.261  -8.735
  331   2HD   ARG  51          2HD       ARG  51  -8.062   2.998  -8.022
  332    HE   ARG  51           HE       ARG  51  -8.644   3.822 -10.082
  333   1HH1  ARG  51          1HH1      ARG  51  -5.362   2.611 -10.275
  334   2HH1  ARG  51          2HH1      ARG  51  -5.172   3.034 -11.948
  335   1HH2  ARG  51          1HH2      ARG  51  -8.394   4.332 -12.310
  336   2HH2  ARG  51          2HH2      ARG  51  -6.879   3.980 -13.095
  337    H    LYS  52           H        LYS  52  -2.091   4.952  -5.637
  338    HA   LYS  52           HA       LYS  52  -0.113   3.800  -7.480
  339   1HB   LYS  52          1HB       LYS  52   0.207   6.122  -5.550
  340   2HB   LYS  52          2HB       LYS  52   1.551   5.352  -6.389
  341   1HG   LYS  52          1HG       LYS  52   1.136   6.447  -8.293
  342   2HG   LYS  52          2HG       LYS  52  -0.601   6.171  -8.182
  343   1HD   LYS  52          1HD       LYS  52  -0.216   8.536  -8.106
  344   2HD   LYS  52          2HD       LYS  52  -0.712   8.015  -6.495
  345   1HE   LYS  52          1HE       LYS  52   1.105   9.561  -6.272
  346   2HE   LYS  52          2HE       LYS  52   1.686   7.952  -5.851
  347   1HZ   LYS  52          1HZ       LYS  52   2.658   7.770  -8.076
  348   2HZ   LYS  52          2HZ       LYS  52   2.114   9.331  -8.452
  349   3HZ   LYS  52          3HZ       LYS  52   3.279   9.107  -7.235
  350    H    TRP  53           H        TRP  53   0.646   1.929  -6.718
  351    HA   TRP  53           HA       TRP  53   0.712   1.587  -3.799
  352   1HB   TRP  53          1HB       TRP  53  -0.105  -0.651  -4.075
  353   2HB   TRP  53          2HB       TRP  53  -1.196   0.458  -4.825
  354    HD1  TRP  53           HD1      TRP  53  -0.667   0.664  -7.714
  355    HE1  TRP  53           1HE      TRP  53  -0.279  -1.356  -9.277
  356    HE3  TRP  53           3HE      TRP  53   0.581  -2.699  -4.198
  357    HZ2  TRP  53           2HZ      TRP  53   0.482  -4.101  -8.988
  358    HZ3  TRP  53           3HZ      TRP  53   1.138  -5.028  -4.864
  359    HH2  TRP  53           HH2      TRP  53   1.090  -5.709  -7.221
  360    H    GLY  54           H        GLY  54   1.756  -0.512  -3.222
  361   1HA   GLY  54          1HA       GLY  54   3.926  -1.571  -4.700
  362   2HA   GLY  54          2HA       GLY  54   4.501  -0.398  -3.512
  363    H    PHE  55           H        PHE  55   4.744  -3.382  -3.621
  364    HA   PHE  55           HA       PHE  55   3.117  -4.643  -1.740
  365   1HB   PHE  55          1HB       PHE  55   5.935  -5.108  -2.678
  366   2HB   PHE  55          2HB       PHE  55   5.169  -6.155  -1.500
  367    HD1  PHE  55           1HD      PHE  55   2.432  -5.443  -3.245
  368    HD2  PHE  55           2HD      PHE  55   6.200  -7.315  -3.905
  369    HE1  PHE  55           1HE      PHE  55   1.439  -6.818  -5.028
  370    HE2  PHE  55           2HE      PHE  55   5.203  -8.687  -5.688
  371    HZ   PHE  55           HZ       PHE  55   2.826  -8.416  -6.266
  372    H    CYS  56           H        CYS  56   3.722  -5.403   0.406
  373    HA   CYS  56           HA       CYS  56   4.483  -3.337   2.187
  374   1HB   CYS  56          1HB       CYS  56   3.222  -5.704   2.550
  375   2HB   CYS  56          2HB       CYS  56   4.853  -6.210   2.976
  376    HA   PRO  57           HA       PRO  57   8.808  -3.598   1.294
  377   1HB   PRO  57          1HB       PRO  57   9.883  -2.097   3.200
  378   2HB   PRO  57          2HB       PRO  57   8.824  -1.397   1.960
  379   1HG   PRO  57          1HG       PRO  57   8.111  -2.426   4.653
  380   2HG   PRO  57          2HG       PRO  57   7.807  -0.786   4.034
  381   1HD   PRO  57          1HD       PRO  57   5.865  -2.611   3.940
  382   2HD   PRO  57          2HD       PRO  57   6.154  -1.579   2.517
  383    H    ASP  58           H        ASP  58  10.864  -3.497   2.892
  384    HA   ASP  58           HA       ASP  58  12.435  -5.011   3.555
  385   1HB   ASP  58          1HB       ASP  58  11.615  -3.697   5.535
  386   2HB   ASP  58          2HB       ASP  58  10.644  -5.101   5.957
  387    H    GLN  59           H        GLN  59  11.451  -6.573   1.876
  388    HA   GLN  59           HA       GLN  59  10.469  -9.001   3.218
  389   1HB   GLN  59          1HB       GLN  59  10.483  -8.384   0.257
  390   2HB   GLN  59          2HB       GLN  59   9.740  -9.775   1.025
  391   1HG   GLN  59          1HG       GLN  59   8.236  -8.172   2.232
  392   2HG   GLN  59          2HG       GLN  59   8.887  -6.904   1.196
  393   1HE2  GLN  59          1HE2      GLN  59   5.805  -8.906  -0.098
  394   2HE2  GLN  59          2HE2      GLN  59   6.267  -8.639   1.544
  395    H    GLY  60           H        GLY  60  11.556 -10.954   2.957
  396   1HA   GLY  60          1HA       GLY  60  14.313 -10.666   1.962
  397   2HA   GLY  60          2HA       GLY  60  13.783 -11.847   3.152
  Start of MODEL   31
    1    H    SER   1           1H       SER   1  11.614   3.614  11.338
    2    HA   SER   1           HA       SER   1  12.702   1.619   9.498
    3   1HB   SER   1          1HB       SER   1  10.418   1.258  11.452
    4   2HB   SER   1          2HB       SER   1  10.976   0.080  10.264
    5    HG   SER   1           HG       SER   1  11.950  -0.507  12.137
    6    H    TRP   2           H        TRP   2  12.239   3.118   7.819
    7    HA   TRP   2           HA       TRP   2   9.392   3.770   7.478
    8   1HB   TRP   2          1HB       TRP   2  11.864   5.032   6.278
    9   2HB   TRP   2          2HB       TRP   2  10.231   5.411   5.738
   10    HD1  TRP   2           HD1      TRP   2  12.354   5.608   8.981
   11    HE1  TRP   2           1HE      TRP   2  11.492   7.594  10.378
   12    HE3  TRP   2           3HE      TRP   2   8.426   7.017   6.033
   13    HZ2  TRP   2           2HZ      TRP   2   9.426   9.513  10.232
   14    HZ3  TRP   2           3HZ      TRP   2   7.053   8.936   6.733
   15    HH2  TRP   2           HH2      TRP   2   7.546  10.156   8.791
   16    H    MET   3           H        MET   3   8.336   2.450   6.232
   17    HA   MET   3           HA       MET   3   9.568   0.493   4.643
   18   1HB   MET   3          1HB       MET   3   7.247  -0.064   3.953
   19   2HB   MET   3          2HB       MET   3   7.481   0.013   5.690
   20   1HG   MET   3          1HG       MET   3   6.364   2.298   4.088
   21   2HG   MET   3          2HG       MET   3   5.353   1.020   4.762
   22   1HE   MET   3          1HE       MET   3   6.522   0.208   7.191
   23   2HE   MET   3          2HE       MET   3   6.617   1.350   8.530
   24   3HE   MET   3          3HE       MET   3   5.047   0.919   7.849
   25    H    SER   4           H        SER   4   9.913   0.250   2.577
   26    HA   SER   4           HA       SER   4   9.311   2.479   0.753
   27   1HB   SER   4          1HB       SER   4  11.457   0.334   0.563
   28   2HB   SER   4          2HB       SER   4  11.156   1.574  -0.657
   29    HG   SER   4           HG       SER   4  12.461   1.755   1.758
   30    H    THR   5           H        THR   5   9.398   1.235  -1.688
   31    HA   THR   5           HA       THR   5   7.379  -0.865  -1.386
   32    HB   THR   5           HB       THR   5   6.485   0.014  -3.573
   33    HG1  THR   5           1HG      THR   5   8.088   1.311  -4.282
   34   1HG2  THR   5          1HG2      THR   5   5.421   2.040  -2.527
   35   2HG2  THR   5          2HG2      THR   5   5.174   0.494  -1.717
   36   3HG2  THR   5          3HG2      THR   5   6.351   1.644  -1.083
   37    H    VAL   6           H        VAL   6   7.169  -2.388  -2.895
   38    HA   VAL   6           HA       VAL   6   9.365  -2.878  -4.809
   39    HB   VAL   6           HB       VAL   6   7.870  -5.243  -3.942
   40   1HG1  VAL   6          1HG1      VAL   6  10.617  -4.492  -4.683
   41   2HG1  VAL   6          2HG1      VAL   6  10.466  -5.858  -3.578
   42   3HG1  VAL   6          3HG1      VAL   6   9.656  -5.898  -5.143
   43   1HG2  VAL   6          1HG2      VAL   6   8.078  -3.913  -1.786
   44   2HG2  VAL   6          2HG2      VAL   6   8.715  -5.558  -1.771
   45   3HG2  VAL   6          3HG2      VAL   6   9.815  -4.185  -1.911
   46    H    GLY   7           H        GLY   7   8.059  -4.996  -6.051
   47   1HA   GLY   7          1HA       GLY   7   6.586  -5.160  -7.872
   48   2HA   GLY   7          2HA       GLY   7   5.449  -5.085  -6.561
   49    H    GLY   8           H        GLY   8   3.864  -3.824  -6.966
   50   1HA   GLY   8          1HA       GLY   8   2.579  -2.170  -7.929
   51   2HA   GLY   8          2HA       GLY   8   3.696  -1.192  -7.011
   52    H    ASN   9           H        ASN   9   3.643   0.549  -8.322
   53    HA   ASN   9           HA       ASN   9   5.140   0.301 -10.808
   54   1HB   ASN   9          1HB       ASN   9   3.573   1.720 -12.069
   55   2HB   ASN   9          2HB       ASN   9   2.853   0.194 -11.604
   56   1HD2  ASN   9          1HD2      ASN   9   1.346   2.694  -8.972
   57   2HD2  ASN   9          2HD2      ASN   9   2.889   1.929  -8.885
   58    H    SER  10           H        SER  10   4.456   1.950  -7.954
   59    HA   SER  10           HA       SER  10   5.244   4.577  -8.725
   60   1HB   SER  10          1HB       SER  10   5.348   3.397  -5.943
   61   2HB   SER  10          2HB       SER  10   5.155   5.086  -6.394
   62    HG   SER  10           HG       SER  10   3.147   4.252  -5.848
   63    H    GLY  11           H        GLY  11   6.933   1.684  -7.950
   64   1HA   GLY  11          1HA       GLY  11   9.239   1.396  -8.422
   65   2HA   GLY  11          2HA       GLY  11   9.469   3.125  -8.208
   66    H    GLY  12           H        GLY  12  10.164   3.868  -6.301
   67   1HA   GLY  12          1HA       GLY  12  10.125   1.986  -4.027
   68   2HA   GLY  12          2HA       GLY  12  11.579   2.879  -4.445
   69    H    ALA  13           H        ALA  13   8.240   4.048  -4.435
   70    HA   ALA  13           HA       ALA  13   9.035   6.279  -2.767
   71   1HB   ALA  13          1HB       ALA  13   7.520   6.526  -4.751
   72   2HB   ALA  13          2HB       ALA  13   6.281   5.679  -3.826
   73   3HB   ALA  13          3HB       ALA  13   6.906   7.226  -3.254
   74    HA   PRO  14           HA       PRO  14   7.823   4.518   1.089
   75   1HB   PRO  14          1HB       PRO  14   7.008   7.240   1.878
   76   2HB   PRO  14          2HB       PRO  14   8.241   6.187   2.579
   77   1HG   PRO  14          1HG       PRO  14   8.869   8.370   1.129
   78   2HG   PRO  14          2HG       PRO  14   9.869   6.907   1.122
   79   1HD   PRO  14          1HD       PRO  14   7.945   7.904  -0.937
   80   2HD   PRO  14          2HD       PRO  14   9.491   7.053  -1.140
   81    H    CYS  15           H        CYS  15   5.977   3.555   1.698
   82    HA   CYS  15           HA       CYS  15   3.491   4.255   0.478
   83   1HB   CYS  15          1HB       CYS  15   4.277   2.255   2.594
   84   2HB   CYS  15          2HB       CYS  15   2.594   2.513   2.153
   85    H    VAL  16           H        VAL  16   2.137   5.786   1.135
   86    HA   VAL  16           HA       VAL  16   2.515   7.199   3.594
   87    HB   VAL  16           HB       VAL  16   0.324   7.448   1.527
   88   1HG1  VAL  16          1HG1      VAL  16   1.122   9.233   3.815
   89   2HG1  VAL  16          2HG1      VAL  16   0.059   9.730   2.501
   90   3HG1  VAL  16          3HG1      VAL  16  -0.423   8.416   3.577
   91   1HG2  VAL  16          1HG2      VAL  16   3.087   8.204   1.487
   92   2HG2  VAL  16          2HG2      VAL  16   1.857   8.405   0.237
   93   3HG2  VAL  16          3HG2      VAL  16   2.075   9.648   1.470
   94    H    PHE  17           H        PHE  17   1.776   6.549   5.493
   95    HA   PHE  17           HA       PHE  17  -0.762   5.080   5.593
   96   1HB   PHE  17          1HB       PHE  17   1.694   4.864   7.327
   97   2HB   PHE  17          2HB       PHE  17   0.152   4.152   7.750
   98    HD1  PHE  17           1HD      PHE  17  -0.872   2.812   5.523
   99    HD2  PHE  17           2HD      PHE  17   3.198   3.372   6.594
  100    HE1  PHE  17           1HE      PHE  17  -0.265   0.786   4.275
  101    HE2  PHE  17           2HE      PHE  17   3.825   1.357   5.348
  102    HZ   PHE  17           HZ       PHE  17   2.098   0.033   4.169
  103    HA   PRO  18           HA       PRO  18  -2.176   4.485   6.869
  104   1HB   PRO  18          1HB       PRO  18  -4.739   5.599   7.474
  105   2HB   PRO  18          2HB       PRO  18  -3.826   4.419   8.414
  106   1HG   PRO  18          1HG       PRO  18  -4.375   6.998   9.239
  107   2HG   PRO  18          2HG       PRO  18  -3.050   6.001   9.860
  108   1HD   PRO  18          1HD       PRO  18  -2.982   8.173   7.799
  109   2HD   PRO  18          2HD       PRO  18  -1.809   7.792   9.079
  110    H    PHE  19           H        PHE  19  -2.989   3.923   4.876
  111    HA   PHE  19           HA       PHE  19  -3.942   6.177   3.236
  112   1HB   PHE  19          1HB       PHE  19  -3.390   4.948   1.251
  113   2HB   PHE  19          2HB       PHE  19  -1.989   4.944   2.304
  114    HD1  PHE  19           1HD      PHE  19  -1.382   2.851   3.520
  115    HD2  PHE  19           2HD      PHE  19  -4.403   2.950   0.525
  116    HE1  PHE  19           1HE      PHE  19  -1.191   0.410   3.239
  117    HE2  PHE  19           2HE      PHE  19  -4.219   0.517   0.241
  118    HZ   PHE  19           HZ       PHE  19  -2.607  -0.759   1.597
  119    H    THR  20           H        THR  20  -5.421   4.948   1.336
  120    HA   THR  20           HA       THR  20  -7.402   3.341   2.772
  121    HB   THR  20           HB       THR  20  -8.026   5.895   1.240
  122    HG1  THR  20           1HG      THR  20  -7.270   6.331   3.329
  123   1HG2  THR  20          1HG2      THR  20 -10.288   5.290   2.595
  124   2HG2  THR  20          2HG2      THR  20 -10.009   4.952   0.887
  125   3HG2  THR  20          3HG2      THR  20  -9.737   3.691   2.090
  126    H    PHE  21           H        PHE  21  -7.956   1.654   1.588
  127    HA   PHE  21           HA       PHE  21  -7.754   1.892  -1.345
  128   1HB   PHE  21          1HB       PHE  21  -6.020   0.350  -0.285
  129   2HB   PHE  21          2HB       PHE  21  -7.363  -0.651   0.230
  130    HD1  PHE  21           1HD      PHE  21  -5.903   0.839  -2.847
  131    HD2  PHE  21           2HD      PHE  21  -8.187  -2.330  -1.166
  132    HE1  PHE  21           1HE      PHE  21  -5.803  -0.348  -4.978
  133    HE2  PHE  21           2HE      PHE  21  -8.083  -3.529  -3.297
  134    HZ   PHE  21           HZ       PHE  21  -6.894  -2.544  -5.222
  135    H    LEU  22           H        LEU  22  -9.445   1.304  -2.432
  136    HA   LEU  22           HA       LEU  22 -11.653   1.076  -2.808
  137   1HB   LEU  22          1HB       LEU  22 -10.239  -1.390  -2.062
  138   2HB   LEU  22          2HB       LEU  22 -11.919  -1.505  -2.554
  139    HG   LEU  22           HG       LEU  22 -10.276  -1.879  -4.391
  140   1HD1  LEU  22          1HD1      LEU  22 -12.236   0.338  -4.443
  141   2HD1  LEU  22          2HD1      LEU  22 -11.345  -0.142  -5.891
  142   3HD1  LEU  22          3HD1      LEU  22 -12.383  -1.305  -5.076
  143   1HD2  LEU  22          1HD2      LEU  22  -8.631  -0.200  -3.650
  144   2HD2  LEU  22          2HD2      LEU  22  -9.086  -0.055  -5.347
  145   3HD2  LEU  22          3HD2      LEU  22  -9.757   1.060  -4.157
  146    H    GLY  23           H        GLY  23 -11.670   2.289  -0.455
  147   1HA   GLY  23          1HA       GLY  23 -13.534   2.751   0.924
  148   2HA   GLY  23          2HA       GLY  23 -14.029   1.079   0.780
  149    H    ASN  24           H        ASN  24 -10.931   0.575   1.646
  150    HA   ASN  24           HA       ASN  24 -11.673   0.707   4.493
  151   1HB   ASN  24          1HB       ASN  24  -9.649  -1.086   3.158
  152   2HB   ASN  24          2HB       ASN  24 -10.195  -1.176   4.829
  153   1HD2  ASN  24          1HD2      ASN  24 -12.079  -3.211   2.036
  154   2HD2  ASN  24          2HD2      ASN  24 -10.508  -2.512   1.885
  155    H    LYS  25           H        LYS  25 -10.035   1.178   6.070
  156    HA   LYS  25           HA       LYS  25  -8.059   3.089   5.144
  157   1HB   LYS  25          1HB       LYS  25  -8.849   2.374   7.971
  158   2HB   LYS  25          2HB       LYS  25  -8.046   3.811   7.412
  159   1HG   LYS  25          1HG       LYS  25 -10.896   3.085   6.806
  160   2HG   LYS  25          2HG       LYS  25 -10.369   4.258   8.012
  161   1HD   LYS  25          1HD       LYS  25  -9.367   5.627   6.259
  162   2HD   LYS  25          2HD       LYS  25  -9.871   4.447   5.044
  163   1HE   LYS  25          1HE       LYS  25 -11.689   6.052   6.839
  164   2HE   LYS  25          2HE       LYS  25 -11.399   6.340   5.125
  165   1HZ   LYS  25          1HZ       LYS  25 -12.240   3.647   5.701
  166   2HZ   LYS  25          2HZ       LYS  25 -13.385   4.812   6.148
  167   3HZ   LYS  25          3HZ       LYS  25 -12.821   4.745   4.543
  168    H    TYR  26           H        TYR  26  -5.884   2.499   5.075
  169    HA   TYR  26           HA       TYR  26  -5.168   0.044   6.519
  170   1HB   TYR  26          1HB       TYR  26  -4.031   1.081   3.926
  171   2HB   TYR  26          2HB       TYR  26  -3.548  -0.391   4.749
  172    HD1  TYR  26           1HD      TYR  26  -6.465   1.238   3.112
  173    HD2  TYR  26           2HD      TYR  26  -4.645  -2.389   4.347
  174    HE1  TYR  26           1HE      TYR  26  -8.194  -0.024   1.938
  175    HE2  TYR  26           2HE      TYR  26  -6.357  -3.661   3.162
  176    HH   TYR  26           HH       TYR  26  -8.204  -2.621   0.884
  177    H    GLU  27           H        GLU  27  -3.771   0.244   8.025
  178    HA   GLU  27           HA       GLU  27  -2.072   2.625   8.179
  179   1HB   GLU  27          1HB       GLU  27  -3.008   0.603  10.185
  180   2HB   GLU  27          2HB       GLU  27  -1.687   1.684  10.530
  181   1HG   GLU  27          1HG       GLU  27  -3.243   3.589  10.028
  182   2HG   GLU  27          2HG       GLU  27  -4.541   2.395   9.974
  183    H    SER  28           H        SER  28  -2.057  -0.689   7.517
  184    HA   SER  28           HA       SER  28   0.871  -0.717   7.514
  185   1HB   SER  28          1HB       SER  28   0.558  -3.227   7.964
  186   2HB   SER  28          2HB       SER  28   0.310  -2.141   9.327
  187    HG   SER  28           HG       SER  28  -1.496  -3.732   7.953
  188    H    CYS  29           H        CYS  29   1.334  -3.022   6.152
  189    HA   CYS  29           HA       CYS  29   0.496  -2.347   3.525
  190   1HB   CYS  29          1HB       CYS  29   1.832  -4.860   4.540
  191   2HB   CYS  29          2HB       CYS  29   1.625  -4.446   2.852
  192    H    THR  30           H        THR  30  -0.515  -4.020   2.088
  193    HA   THR  30           HA       THR  30  -2.554  -5.636   3.421
  194    HB   THR  30           HB       THR  30  -3.567  -3.364   3.038
  195    HG1  THR  30           1HG      THR  30  -5.041  -4.931   2.987
  196   1HG2  THR  30          1HG2      THR  30  -3.278  -3.990   0.105
  197   2HG2  THR  30          2HG2      THR  30  -3.987  -2.553   0.841
  198   3HG2  THR  30          3HG2      THR  30  -2.254  -2.848   0.970
  199    H    SER  31           H        SER  31  -3.835  -6.845   1.731
  200    HA   SER  31           HA       SER  31  -2.169  -7.439  -0.616
  201   1HB   SER  31          1HB       SER  31  -2.938  -9.807  -0.425
  202   2HB   SER  31          2HB       SER  31  -1.929  -9.289   0.935
  203    HG   SER  31           HG       SER  31  -3.581  -9.481   2.257
  204    H    ALA  32           H        ALA  32  -4.472  -5.715   0.146
  205    HA   ALA  32           HA       ALA  32  -6.885  -6.560  -0.958
  206   1HB   ALA  32          1HB       ALA  32  -6.009  -4.315   0.336
  207   2HB   ALA  32          2HB       ALA  32  -6.260  -3.705  -1.300
  208   3HB   ALA  32          3HB       ALA  32  -7.591  -4.471  -0.432
  209    H    GLY  33           H        GLY  33  -7.690  -6.694  -2.962
  210   1HA   GLY  33          1HA       GLY  33  -7.866  -6.406  -5.250
  211   2HA   GLY  33          2HA       GLY  33  -6.541  -5.255  -5.173
  212    H    ARG  34           H        ARG  34  -5.355  -7.803  -3.586
  213    HA   ARG  34           HA       ARG  34  -4.230  -8.993  -6.035
  214   1HB   ARG  34          1HB       ARG  34  -2.994  -8.772  -3.281
  215   2HB   ARG  34          2HB       ARG  34  -2.244  -9.482  -4.691
  216   1HG   ARG  34          1HG       ARG  34  -2.700  -7.071  -5.692
  217   2HG   ARG  34          2HG       ARG  34  -2.646  -6.636  -3.991
  218   1HD   ARG  34          1HD       ARG  34  -0.442  -6.468  -5.117
  219   2HD   ARG  34          2HD       ARG  34  -0.452  -7.582  -3.748
  220    HE   ARG  34           HE       ARG  34   0.047  -9.287  -5.175
  221   1HH1  ARG  34          1HH1      ARG  34  -1.155  -6.600  -7.041
  222   2HH1  ARG  34          2HH1      ARG  34  -0.873  -7.363  -8.574
  223   1HH2  ARG  34          1HH2      ARG  34   0.394 -10.314  -7.189
  224   2HH2  ARG  34          2HH2      ARG  34   0.011  -9.460  -8.650
  225    H    SER  35           H        SER  35  -4.781  -9.725  -2.629
  226    HA   SER  35           HA       SER  35  -5.320 -11.573  -1.475
  227   1HB   SER  35          1HB       SER  35  -7.162 -12.974  -2.369
  228   2HB   SER  35          2HB       SER  35  -7.505 -11.246  -2.463
  229    HG   SER  35           HG       SER  35  -6.359 -11.841  -4.728
  230    H    ASP  36           H        ASP  36  -2.940 -11.747  -3.176
  231    HA   ASP  36           HA       ASP  36  -2.850 -14.638  -3.656
  232   1HB   ASP  36          1HB       ASP  36  -0.624 -13.905  -4.856
  233   2HB   ASP  36          2HB       ASP  36  -2.166 -13.766  -5.676
  234    H    GLY  37           H        GLY  37  -0.122 -12.556  -3.186
  235   1HA   GLY  37          1HA       GLY  37   0.329 -13.359  -0.491
  236   2HA   GLY  37          2HA       GLY  37   1.413 -14.146  -1.622
  237    H    LYS  38           H        LYS  38   1.163 -11.621  -3.321
  238    HA   LYS  38           HA       LYS  38   3.469 -10.289  -2.240
  239   1HB   LYS  38          1HB       LYS  38   1.768  -9.540  -4.629
  240   2HB   LYS  38          2HB       LYS  38   3.394  -8.975  -4.279
  241   1HG   LYS  38          1HG       LYS  38   4.298 -11.130  -4.614
  242   2HG   LYS  38          2HG       LYS  38   2.699 -11.842  -4.765
  243   1HD   LYS  38          1HD       LYS  38   2.308 -10.611  -6.808
  244   2HD   LYS  38          2HD       LYS  38   3.871  -9.798  -6.648
  245   1HE   LYS  38          1HE       LYS  38   4.972 -12.013  -6.778
  246   2HE   LYS  38          2HE       LYS  38   3.398 -12.752  -7.057
  247   1HZ   LYS  38          1HZ       LYS  38   3.695 -10.667  -8.907
  248   2HZ   LYS  38          2HZ       LYS  38   5.131 -11.585  -8.929
  249   3HZ   LYS  38          3HZ       LYS  38   3.636 -12.344  -9.198
  250    H    MET  39           H        MET  39   2.359  -9.581  -0.210
  251    HA   MET  39           HA       MET  39   0.244  -7.720  -0.301
  252   1HB   MET  39          1HB       MET  39   2.318  -8.207   1.851
  253   2HB   MET  39          2HB       MET  39   0.894  -7.191   2.037
  254   1HG   MET  39          1HG       MET  39  -0.543  -9.123   1.587
  255   2HG   MET  39          2HG       MET  39   0.889 -10.142   1.451
  256   1HE   MET  39          1HE       MET  39   2.457 -10.613   3.055
  257   2HE   MET  39          2HE       MET  39   2.718  -9.472   4.375
  258   3HE   MET  39          3HE       MET  39   1.991 -11.046   4.700
  259    H    TRP  40           H        TRP  40   0.188  -5.594  -0.525
  260    HA   TRP  40           HA       TRP  40   2.719  -4.152  -0.969
  261   1HB   TRP  40          1HB       TRP  40   1.511  -2.888  -2.738
  262   2HB   TRP  40          2HB       TRP  40   1.582  -4.614  -3.098
  263    HD1  TRP  40           HD1      TRP  40  -0.842  -5.992  -2.356
  264    HE1  TRP  40           1HE      TRP  40  -3.256  -5.159  -2.579
  265    HE3  TRP  40           3HE      TRP  40   0.058  -0.997  -2.872
  266    HZ2  TRP  40           2HZ      TRP  40  -4.601  -2.726  -2.912
  267    HZ3  TRP  40           3HZ      TRP  40  -1.856   0.518  -3.122
  268    HH2  TRP  40           HH2      TRP  40  -4.137  -0.335  -3.149
  269    H    CYS  41           H        CYS  41   1.535  -1.668  -1.459
  270    HA   CYS  41           HA       CYS  41  -0.348  -0.854   0.474
  271   1HB   CYS  41          1HB       CYS  41   1.263   0.665   1.764
  272   2HB   CYS  41          2HB       CYS  41   1.239  -1.039   2.193
  273    H    ALA  42           H        ALA  42  -0.812   1.467   0.305
  274    HA   ALA  42           HA       ALA  42  -0.271   2.419  -2.357
  275   1HB   ALA  42          1HB       ALA  42  -2.433   2.687  -0.934
  276   2HB   ALA  42          2HB       ALA  42  -1.604   4.101  -0.284
  277   3HB   ALA  42          3HB       ALA  42  -1.925   3.986  -2.015
  278    H    THR  43           H        THR  43   0.778   4.292  -2.945
  279    HA   THR  43           HA       THR  43   2.772   5.182  -1.001
  280    HB   THR  43           HB       THR  43   4.056   5.922  -2.955
  281    HG1  THR  43           1HG      THR  43   2.977   6.326  -4.706
  282   1HG2  THR  43          1HG2      THR  43   3.724   3.479  -4.178
  283   2HG2  THR  43          2HG2      THR  43   4.816   3.837  -2.842
  284   3HG2  THR  43          3HG2      THR  43   3.207   3.189  -2.517
  285    H    THR  44           H        THR  44  -0.163   5.988  -1.760
  286    HA   THR  44           HA       THR  44   0.298   8.866  -1.443
  287    HB   THR  44           HB       THR  44  -1.776   9.258  -2.777
  288    HG1  THR  44           1HG      THR  44  -2.958   7.625  -3.308
  289   1HG2  THR  44          1HG2      THR  44  -0.282   7.725  -4.750
  290   2HG2  THR  44          2HG2      THR  44  -0.649   9.448  -4.683
  291   3HG2  THR  44          3HG2      THR  44   0.724   8.802  -3.784
  292    H    ALA  45           H        ALA  45  -1.471   9.948  -0.273
  293    HA   ALA  45           HA       ALA  45  -2.245   8.538   2.038
  294   1HB   ALA  45          1HB       ALA  45  -2.886  11.202   0.884
  295   2HB   ALA  45          2HB       ALA  45  -3.890  10.593   2.201
  296   3HB   ALA  45          3HB       ALA  45  -2.151  10.787   2.434
  297    H    ASN  46           H        ASN  46  -4.036   9.393  -0.890
  298    HA   ASN  46           HA       ASN  46  -6.106   7.485  -0.037
  299   1HB   ASN  46          1HB       ASN  46  -6.983   9.799  -0.098
  300   2HB   ASN  46          2HB       ASN  46  -6.493   9.928  -1.786
  301   1HD2  ASN  46          1HD2      ASN  46 -10.016   8.392  -0.796
  302   2HD2  ASN  46          2HD2      ASN  46  -8.962   9.204   0.302
  303    H    TYR  47           H        TYR  47  -5.643   5.682  -1.117
  304    HA   TYR  47           HA       TYR  47  -4.326   5.670  -3.634
  305   1HB   TYR  47          1HB       TYR  47  -4.113   3.820  -1.994
  306   2HB   TYR  47          2HB       TYR  47  -5.795   3.398  -2.290
  307    HD1  TYR  47           1HD      TYR  47  -6.455   2.571  -4.600
  308    HD2  TYR  47           2HD      TYR  47  -2.400   3.075  -3.426
  309    HE1  TYR  47           1HE      TYR  47  -5.731   1.133  -6.467
  310    HE2  TYR  47           2HE      TYR  47  -1.680   1.636  -5.280
  311    HH   TYR  47           HH       TYR  47  -3.730  -0.341  -6.980
  312    H    ASP  48           H        ASP  48  -7.682   5.302  -2.628
  313    HA   ASP  48           HA       ASP  48  -8.903   4.343  -4.859
  314   1HB   ASP  48          1HB       ASP  48  -9.793   6.487  -2.952
  315   2HB   ASP  48          2HB       ASP  48 -10.835   5.891  -4.236
  316    H    ASP  49           H        ASP  49  -7.710   7.629  -4.426
  317    HA   ASP  49           HA       ASP  49  -8.777   8.446  -6.997
  318   1HB   ASP  49          1HB       ASP  49  -7.401   9.870  -4.756
  319   2HB   ASP  49          2HB       ASP  49  -7.500  10.620  -6.341
  320    H    ASP  50           H        ASP  50  -5.520   8.707  -5.537
  321    HA   ASP  50           HA       ASP  50  -4.287   9.124  -8.075
  322   1HB   ASP  50          1HB       ASP  50  -3.152   8.682  -5.322
  323   2HB   ASP  50          2HB       ASP  50  -2.140   8.948  -6.736
  324    H    ARG  51           H        ARG  51  -5.016   6.243  -6.374
  325    HA   ARG  51           HA       ARG  51  -4.222   4.125  -6.439
  326   1HB   ARG  51          1HB       ARG  51  -4.819   4.843  -9.266
  327   2HB   ARG  51          2HB       ARG  51  -4.607   3.185  -8.704
  328   1HG   ARG  51          1HG       ARG  51  -6.387   3.533  -7.080
  329   2HG   ARG  51          2HG       ARG  51  -6.616   5.170  -7.693
  330   1HD   ARG  51          1HD       ARG  51  -6.836   2.678  -9.310
  331   2HD   ARG  51          2HD       ARG  51  -8.197   3.533  -8.576
  332    HE   ARG  51           HE       ARG  51  -6.707   5.337 -10.143
  333   1HH1  ARG  51          1HH1      ARG  51  -8.847   2.597 -10.521
  334   2HH1  ARG  51          2HH1      ARG  51  -9.406   3.093 -12.089
  335   1HH2  ARG  51          1HH2      ARG  51  -7.418   5.981 -12.193
  336   2HH2  ARG  51          2HH2      ARG  51  -8.566   5.007 -13.056
  337    H    LYS  52           H        LYS  52  -1.955   5.203  -5.927
  338    HA   LYS  52           HA       LYS  52  -0.119   4.006  -7.868
  339   1HB   LYS  52          1HB       LYS  52   0.242   6.423  -6.106
  340   2HB   LYS  52          2HB       LYS  52   1.635   5.539  -6.728
  341   1HG   LYS  52          1HG       LYS  52   1.042   5.996  -8.977
  342   2HG   LYS  52          2HG       LYS  52  -0.544   6.608  -8.503
  343   1HD   LYS  52          1HD       LYS  52   0.540   8.505  -7.379
  344   2HD   LYS  52          2HD       LYS  52   2.123   7.878  -7.854
  345   1HE   LYS  52          1HE       LYS  52   1.526   8.099 -10.202
  346   2HE   LYS  52          2HE       LYS  52  -0.073   8.688  -9.758
  347   1HZ   LYS  52          1HZ       LYS  52   1.038  10.580  -8.642
  348   2HZ   LYS  52          2HZ       LYS  52   2.523  10.034  -9.268
  349   3HZ   LYS  52          3HZ       LYS  52   1.293  10.535 -10.325
  350    H    TRP  53           H        TRP  53   0.611   2.157  -7.198
  351    HA   TRP  53           HA       TRP  53   0.793   1.691  -4.305
  352   1HB   TRP  53          1HB       TRP  53  -0.024  -0.525  -4.684
  353   2HB   TRP  53          2HB       TRP  53  -1.121   0.607  -5.366
  354    HD1  TRP  53           HD1      TRP  53  -0.586   0.968  -8.259
  355    HE1  TRP  53           1HE      TRP  53  -0.192  -0.969  -9.923
  356    HE3  TRP  53           3HE      TRP  53   0.613  -2.573  -4.908
  357    HZ2  TRP  53           2HZ      TRP  53   0.540  -3.739  -9.765
  358    HZ3  TRP  53           3HZ      TRP  53   1.145  -4.868  -5.681
  359    HH2  TRP  53           HH2      TRP  53   1.113  -5.436  -8.066
  360    H    GLY  54           H        GLY  54   1.985  -0.233  -3.731
  361   1HA   GLY  54          1HA       GLY  54   4.111  -1.225  -5.357
  362   2HA   GLY  54          2HA       GLY  54   4.679  -0.048  -4.176
  363    H    PHE  55           H        PHE  55   5.108  -3.002  -4.376
  364    HA   PHE  55           HA       PHE  55   3.654  -4.380  -2.428
  365   1HB   PHE  55          1HB       PHE  55   6.413  -4.767  -3.558
  366   2HB   PHE  55          2HB       PHE  55   5.719  -5.865  -2.384
  367    HD1  PHE  55           1HD      PHE  55   2.988  -4.862  -4.171
  368    HD2  PHE  55           2HD      PHE  55   6.538  -7.158  -4.648
  369    HE1  PHE  55           1HE      PHE  55   1.906  -6.166  -5.957
  370    HE2  PHE  55           2HE      PHE  55   5.459  -8.474  -6.428
  371    HZ   PHE  55           HZ       PHE  55   3.135  -7.953  -7.099
  372    H    CYS  56           H        CYS  56   4.502  -5.260  -0.431
  373    HA   CYS  56           HA       CYS  56   5.389  -3.197   1.351
  374   1HB   CYS  56          1HB       CYS  56   3.703  -5.148   1.755
  375   2HB   CYS  56          2HB       CYS  56   5.144  -6.118   2.036
  376    HA   PRO  57           HA       PRO  57   9.740  -4.094   1.040
  377   1HB   PRO  57          1HB       PRO  57  10.630  -2.898   3.233
  378   2HB   PRO  57          2HB       PRO  57   9.953  -1.964   1.888
  379   1HG   PRO  57          1HG       PRO  57   8.572  -2.971   4.333
  380   2HG   PRO  57          2HG       PRO  57   8.650  -1.292   3.761
  381   1HD   PRO  57          1HD       PRO  57   6.522  -2.785   3.212
  382   2HD   PRO  57          2HD       PRO  57   7.223  -1.749   1.946
  383    H    ASP  58           H        ASP  58  11.254  -4.273   3.491
  384    HA   ASP  58           HA       ASP  58  11.380  -7.043   3.820
  385   1HB   ASP  58          1HB       ASP  58  13.140  -5.294   4.452
  386   2HB   ASP  58          2HB       ASP  58  12.230  -5.071   5.942
  387    H    GLN  59           H        GLN  59   9.815  -8.290   4.594
  388    HA   GLN  59           HA       GLN  59   8.092  -7.267   6.749
  389   1HB   GLN  59          1HB       GLN  59   7.617  -9.521   4.793
  390   2HB   GLN  59          2HB       GLN  59   6.463  -8.936   5.980
  391   1HG   GLN  59          1HG       GLN  59   6.243  -6.867   4.853
  392   2HG   GLN  59          2HG       GLN  59   7.608  -7.226   3.799
  393   1HE2  GLN  59          1HE2      GLN  59   5.615  -8.596   1.369
  394   2HE2  GLN  59          2HE2      GLN  59   7.063  -7.777   1.837
  395    H    GLY  60           H        GLY  60   7.009  -9.886   7.287
  396   1HA   GLY  60          1HA       GLY  60   9.241 -11.399   8.415
  397   2HA   GLY  60          2HA       GLY  60   8.075 -10.716   9.545
  Start of MODEL   32
    1    H    SER   1           1H       SER   1  16.841   0.781   7.322
    2    HA   SER   1           HA       SER   1  14.542  -0.373   8.485
    3   1HB   SER   1          1HB       SER   1  14.615   1.820   9.712
    4   2HB   SER   1          2HB       SER   1  14.621   2.648   8.157
    5    HG   SER   1           HG       SER   1  12.536   2.482   8.168
    6    H    TRP   2           H        TRP   2  12.791  -0.215   6.874
    7    HA   TRP   2           HA       TRP   2  13.917  -0.321   4.211
    8   1HB   TRP   2          1HB       TRP   2  12.234  -1.990   5.144
    9   2HB   TRP   2          2HB       TRP   2  11.016  -0.728   4.968
   10    HD1  TRP   2           HD1      TRP   2  10.703   0.207   2.339
   11    HE1  TRP   2           1HE      TRP   2  10.782  -1.135   0.147
   12    HE3  TRP   2           3HE      TRP   2  13.190  -3.945   4.007
   13    HZ2  TRP   2           2HZ      TRP   2  11.733  -3.627  -0.754
   14    HZ3  TRP   2           3HZ      TRP   2  13.641  -5.767   2.409
   15    HH2  TRP   2           HH2      TRP   2  12.927  -5.606   0.079
   16    H    MET   3           H        MET   3  13.772   1.187   2.680
   17    HA   MET   3           HA       MET   3  12.392   3.679   3.296
   18   1HB   MET   3          1HB       MET   3  14.371   3.021   1.127
   19   2HB   MET   3          2HB       MET   3  13.729   4.619   1.479
   20   1HG   MET   3          1HG       MET   3  14.714   4.381   3.784
   21   2HG   MET   3          2HG       MET   3  15.539   2.944   3.180
   22   1HE   MET   3          1HE       MET   3  14.823   6.585   2.839
   23   2HE   MET   3          2HE       MET   3  16.266   7.308   2.128
   24   3HE   MET   3          3HE       MET   3  15.071   6.524   1.095
   25    H    SER   4           H        SER   4  12.886   3.651   0.175
   26    HA   SER   4           HA       SER   4  10.318   3.977  -0.706
   27   1HB   SER   4          1HB       SER   4  12.538   2.801  -2.389
   28   2HB   SER   4          2HB       SER   4  11.154   3.745  -2.951
   29    HG   SER   4           HG       SER   4  13.440   4.725  -2.431
   30    H    THR   5           H        THR   5   8.929   2.695  -2.061
   31    HA   THR   5           HA       THR   5   8.417   0.151  -0.957
   32    HB   THR   5           HB       THR   5   6.684   0.070  -2.839
   33    HG1  THR   5           1HG      THR   5   7.047   2.811  -3.129
   34   1HG2  THR   5          1HG2      THR   5   5.562   2.274  -1.791
   35   2HG2  THR   5          2HG2      THR   5   5.580   0.699  -0.995
   36   3HG2  THR   5          3HG2      THR   5   6.775   1.919  -0.560
   37    H    VAL   6           H        VAL   6   7.731  -1.627  -2.467
   38    HA   VAL   6           HA       VAL   6   9.702  -2.253  -4.529
   39    HB   VAL   6           HB       VAL   6  10.593  -3.639  -2.928
   40   1HG1  VAL   6          1HG1      VAL   6   8.000  -3.286  -1.558
   41   2HG1  VAL   6          2HG1      VAL   6   8.918  -4.738  -1.172
   42   3HG1  VAL   6          3HG1      VAL   6   9.642  -3.148  -0.925
   43   1HG2  VAL   6          1HG2      VAL   6   8.217  -5.158  -3.883
   44   2HG2  VAL   6          2HG2      VAL   6   9.903  -5.318  -4.376
   45   3HG2  VAL   6          3HG2      VAL   6   9.390  -5.878  -2.782
   46    H    GLY   7           H        GLY   7   8.649  -4.040  -5.969
   47   1HA   GLY   7          1HA       GLY   7   6.731  -4.809  -7.092
   48   2HA   GLY   7          2HA       GLY   7   5.880  -4.573  -5.589
   49    H    GLY   8           H        GLY   8   4.058  -3.669  -6.481
   50   1HA   GLY   8          1HA       GLY   8   2.707  -2.060  -7.425
   51   2HA   GLY   8          2HA       GLY   8   3.742  -0.987  -6.516
   52    H    ASN   9           H        ASN   9   3.645   0.689  -7.916
   53    HA   ASN   9           HA       ASN   9   5.271   0.369 -10.302
   54   1HB   ASN   9          1HB       ASN   9   3.742   1.666 -11.724
   55   2HB   ASN   9          2HB       ASN   9   3.040   0.150 -11.213
   56   1HD2  ASN   9          1HD2      ASN   9   1.337   2.785  -8.833
   57   2HD2  ASN   9          2HD2      ASN   9   2.911   2.109  -8.630
   58    H    SER  10           H        SER  10   4.597   1.970  -7.519
   59    HA   SER  10           HA       SER  10   5.603   4.560  -8.409
   60   1HB   SER  10          1HB       SER  10   5.070   3.893  -5.543
   61   2HB   SER  10          2HB       SER  10   4.835   5.407  -6.399
   62    HG   SER  10           HG       SER  10   2.864   4.250  -5.853
   63    H    GLY  11           H        GLY  11   7.497   2.731  -8.840
   64   1HA   GLY  11          1HA       GLY  11   9.164   1.978  -6.729
   65   2HA   GLY  11          2HA       GLY  11   9.681   2.187  -8.397
   66    H    GLY  12           H        GLY  12   9.561   3.566  -5.238
   67   1HA   GLY  12          1HA       GLY  12  11.668   5.007  -4.974
   68   2HA   GLY  12          2HA       GLY  12  10.910   5.985  -6.224
   69    H    ALA  13           H        ALA  13   8.221   5.167  -4.851
   70    HA   ALA  13           HA       ALA  13   8.386   7.309  -2.830
   71   1HB   ALA  13          1HB       ALA  13   6.819   7.652  -4.731
   72   2HB   ALA  13          2HB       ALA  13   5.915   6.239  -4.187
   73   3HB   ALA  13          3HB       ALA  13   6.033   7.664  -3.154
   74    HA   PRO  14           HA       PRO  14   7.484   4.205   0.208
   75   1HB   PRO  14          1HB       PRO  14   7.160   5.808   2.349
   76   2HB   PRO  14          2HB       PRO  14   8.740   5.557   1.598
   77   1HG   PRO  14          1HG       PRO  14   6.928   7.899   1.459
   78   2HG   PRO  14          2HG       PRO  14   8.694   7.836   1.353
   79   1HD   PRO  14          1HD       PRO  14   6.872   8.061  -0.793
   80   2HD   PRO  14          2HD       PRO  14   8.613   7.752  -0.911
   81    H    CYS  15           H        CYS  15   5.800   3.696   1.906
   82    HA   CYS  15           HA       CYS  15   3.195   4.026   0.745
   83   1HB   CYS  15          1HB       CYS  15   3.618   2.985   3.539
   84   2HB   CYS  15          2HB       CYS  15   2.438   2.480   2.339
   85    H    VAL  16           H        VAL  16   1.466   5.246   1.549
   86    HA   VAL  16           HA       VAL  16   2.177   7.205   3.633
   87    HB   VAL  16           HB       VAL  16   0.171   7.493   1.382
   88   1HG1  VAL  16          1HG1      VAL  16   0.774   9.195   3.761
   89   2HG1  VAL  16          2HG1      VAL  16   0.226   9.932   2.256
   90   3HG1  VAL  16          3HG1      VAL  16  -0.789   8.744   3.077
   91   1HG2  VAL  16          1HG2      VAL  16   2.896   7.857   1.296
   92   2HG2  VAL  16          2HG2      VAL  16   1.720   8.588   0.202
   93   3HG2  VAL  16          3HG2      VAL  16   2.282   9.478   1.616
   94    H    PHE  17           H        PHE  17   1.220   6.836   5.519
   95    HA   PHE  17           HA       PHE  17  -1.387   5.500   5.507
   96   1HB   PHE  17          1HB       PHE  17   0.810   5.448   7.575
   97   2HB   PHE  17          2HB       PHE  17  -0.779   4.748   7.803
   98    HD1  PHE  17           1HD      PHE  17  -1.463   3.197   5.619
   99    HD2  PHE  17           2HD      PHE  17   2.434   3.946   7.140
  100    HE1  PHE  17           1HE      PHE  17  -0.672   1.116   4.602
  101    HE2  PHE  17           2HE      PHE  17   3.240   1.853   6.128
  102    HZ   PHE  17           HZ       PHE  17   1.699   0.414   4.839
  103    HA   PRO  18           HA       PRO  18  -2.925   5.065   6.773
  104   1HB   PRO  18          1HB       PRO  18  -5.522   6.243   6.971
  105   2HB   PRO  18          2HB       PRO  18  -4.702   5.241   8.173
  106   1HG   PRO  18          1HG       PRO  18  -5.314   7.936   8.472
  107   2HG   PRO  18          2HG       PRO  18  -4.095   7.060   9.410
  108   1HD   PRO  18          1HD       PRO  18  -3.747   8.865   7.052
  109   2HD   PRO  18          2HD       PRO  18  -2.715   8.667   8.487
  110    H    PHE  19           H        PHE  19  -3.526   4.221   4.792
  111    HA   PHE  19           HA       PHE  19  -4.401   6.215   2.802
  112   1HB   PHE  19          1HB       PHE  19  -3.537   4.883   1.038
  113   2HB   PHE  19          2HB       PHE  19  -2.269   4.992   2.251
  114    HD1  PHE  19           1HD      PHE  19  -1.784   3.015   3.670
  115    HD2  PHE  19           2HD      PHE  19  -4.455   2.819   0.373
  116    HE1  PHE  19           1HE      PHE  19  -1.567   0.558   3.633
  117    HE2  PHE  19           2HE      PHE  19  -4.244   0.376   0.322
  118    HZ   PHE  19           HZ       PHE  19  -2.797  -0.760   1.958
  119    H    THR  20           H        THR  20  -6.345   6.004   1.865
  120    HA   THR  20           HA       THR  20  -7.983   3.805   2.890
  121    HB   THR  20           HB       THR  20  -8.773   6.321   1.369
  122    HG1  THR  20           1HG      THR  20  -7.924   6.669   3.510
  123   1HG2  THR  20          1HG2      THR  20 -10.982   5.657   2.740
  124   2HG2  THR  20          2HG2      THR  20 -10.694   5.206   1.058
  125   3HG2  THR  20          3HG2      THR  20 -10.365   4.051   2.351
  126    H    PHE  21           H        PHE  21  -8.477   2.127   1.738
  127    HA   PHE  21           HA       PHE  21  -8.317   2.279  -1.211
  128   1HB   PHE  21          1HB       PHE  21  -6.478   0.881  -0.062
  129   2HB   PHE  21          2HB       PHE  21  -7.764  -0.189   0.444
  130    HD1  PHE  21           1HD      PHE  21  -6.547   1.391  -2.701
  131    HD2  PHE  21           2HD      PHE  21  -8.201  -2.049  -0.842
  132    HE1  PHE  21           1HE      PHE  21  -6.288   0.144  -4.790
  133    HE2  PHE  21           2HE      PHE  21  -7.945  -3.302  -2.931
  134    HZ   PHE  21           HZ       PHE  21  -6.996  -2.211  -4.919
  135    H    LEU  22           H        LEU  22  -9.994   1.410  -2.260
  136    HA   LEU  22           HA       LEU  22 -12.169   0.928  -2.566
  137   1HB   LEU  22          1HB       LEU  22 -10.596  -1.265  -1.407
  138   2HB   LEU  22          2HB       LEU  22 -12.266  -1.576  -1.848
  139    HG   LEU  22           HG       LEU  22 -10.559  -2.134  -3.600
  140   1HD1  LEU  22          1HD1      LEU  22 -13.024  -1.378  -3.850
  141   2HD1  LEU  22          2HD1      LEU  22 -12.267   0.014  -4.633
  142   3HD1  LEU  22          3HD1      LEU  22 -11.988  -1.616  -5.256
  143   1HD2  LEU  22          1HD2      LEU  22  -9.263   0.031  -3.137
  144   2HD2  LEU  22          2HD2      LEU  22  -9.429  -0.543  -4.797
  145   3HD2  LEU  22          3HD2      LEU  22 -10.458   0.763  -4.207
  146    H    GLY  23           H        GLY  23 -12.274   2.551  -0.510
  147   1HA   GLY  23          1HA       GLY  23 -14.014   3.211   0.883
  148   2HA   GLY  23          2HA       GLY  23 -14.588   1.557   0.905
  149    H    ASN  24           H        ASN  24 -11.477   1.080   1.852
  150    HA   ASN  24           HA       ASN  24 -12.249   1.525   4.666
  151   1HB   ASN  24          1HB       ASN  24 -10.367  -0.539   3.514
  152   2HB   ASN  24          2HB       ASN  24 -10.867  -0.409   5.193
  153   1HD2  ASN  24          1HD2      ASN  24 -12.999  -2.526   2.641
  154   2HD2  ASN  24          2HD2      ASN  24 -11.382  -1.983   2.395
  155    H    LYS  25           H        LYS  25 -10.609   2.092   6.187
  156    HA   LYS  25           HA       LYS  25  -8.498   3.731   5.074
  157   1HB   LYS  25          1HB       LYS  25  -9.470   3.344   7.916
  158   2HB   LYS  25          2HB       LYS  25  -8.411   4.598   7.336
  159   1HG   LYS  25          1HG       LYS  25 -10.113   5.688   6.154
  160   2HG   LYS  25          2HG       LYS  25 -11.180   4.287   6.270
  161   1HD   LYS  25          1HD       LYS  25 -11.264   4.623   8.729
  162   2HD   LYS  25          2HD       LYS  25 -10.309   6.095   8.525
  163   1HE   LYS  25          1HE       LYS  25 -12.720   6.567   8.712
  164   2HE   LYS  25          2HE       LYS  25 -12.057   7.074   7.157
  165   1HZ   LYS  25          1HZ       LYS  25 -13.259   4.398   7.378
  166   2HZ   LYS  25          2HZ       LYS  25 -14.291   5.747   7.281
  167   3HZ   LYS  25          3HZ       LYS  25 -13.177   5.429   6.039
  168    H    TYR  26           H        TYR  26  -6.425   2.892   4.958
  169    HA   TYR  26           HA       TYR  26  -5.876   0.537   6.629
  170   1HB   TYR  26          1HB       TYR  26  -4.588   1.397   4.039
  171   2HB   TYR  26          2HB       TYR  26  -4.194  -0.052   4.952
  172    HD1  TYR  26           1HD      TYR  26  -7.104   1.622   3.318
  173    HD2  TYR  26           2HD      TYR  26  -5.257  -2.046   4.399
  174    HE1  TYR  26           1HE      TYR  26  -8.833   0.402   2.109
  175    HE2  TYR  26           2HE      TYR  26  -6.986  -3.276   3.177
  176    HH   TYR  26           HH       TYR  26  -9.456  -1.596   1.288
  177    H    GLU  27           H        GLU  27  -4.564   0.741   8.185
  178    HA   GLU  27           HA       GLU  27  -2.806   3.058   8.419
  179   1HB   GLU  27          1HB       GLU  27  -3.425   0.898  10.422
  180   2HB   GLU  27          2HB       GLU  27  -2.686   2.445  10.733
  181   1HG   GLU  27          1HG       GLU  27  -4.741   3.592  10.249
  182   2HG   GLU  27          2HG       GLU  27  -5.499   2.073   9.758
  183    H    SER  28           H        SER  28  -2.821  -0.274   7.775
  184    HA   SER  28           HA       SER  28   0.112  -0.352   7.826
  185   1HB   SER  28          1HB       SER  28  -0.315  -2.868   8.261
  186   2HB   SER  28          2HB       SER  28  -0.519  -1.765   9.621
  187    HG   SER  28           HG       SER  28  -2.515  -2.430   9.728
  188    H    CYS  29           H        CYS  29   0.601  -2.634   6.479
  189    HA   CYS  29           HA       CYS  29  -0.142  -1.976   3.822
  190   1HB   CYS  29          1HB       CYS  29   1.138  -4.467   4.953
  191   2HB   CYS  29          2HB       CYS  29   0.911  -4.183   3.242
  192    H    THR  30           H        THR  30  -1.086  -3.735   2.378
  193    HA   THR  30           HA       THR  30  -3.184  -5.302   3.657
  194    HB   THR  30           HB       THR  30  -4.230  -3.055   3.255
  195    HG1  THR  30           1HG      THR  30  -5.693  -4.610   3.121
  196   1HG2  THR  30          1HG2      THR  30  -4.433  -3.360   0.378
  197   2HG2  THR  30          2HG2      THR  30  -4.082  -1.929   1.345
  198   3HG2  THR  30          3HG2      THR  30  -2.781  -3.037   0.905
  199    H    SER  31           H        SER  31  -4.379  -6.555   1.932
  200    HA   SER  31           HA       SER  31  -2.613  -7.163  -0.338
  201   1HB   SER  31          1HB       SER  31  -3.434  -9.539  -0.126
  202   2HB   SER  31          2HB       SER  31  -2.415  -8.992   1.216
  203    HG   SER  31           HG       SER  31  -5.148  -9.584   1.159
  204    H    ALA  32           H        ALA  32  -4.974  -5.470   0.332
  205    HA   ALA  32           HA       ALA  32  -7.321  -6.385  -0.888
  206   1HB   ALA  32          1HB       ALA  32  -6.502  -4.120   0.502
  207   2HB   ALA  32          2HB       ALA  32  -6.893  -3.500  -1.103
  208   3HB   ALA  32          3HB       ALA  32  -8.109  -4.382  -0.179
  209    H    GLY  33           H        GLY  33  -8.086  -6.353  -2.927
  210   1HA   GLY  33          1HA       GLY  33  -8.161  -5.953  -5.206
  211   2HA   GLY  33          2HA       GLY  33  -6.859  -4.791  -5.004
  212    H    ARG  34           H        ARG  34  -5.808  -7.541  -3.554
  213    HA   ARG  34           HA       ARG  34  -4.411  -8.362  -6.005
  214   1HB   ARG  34          1HB       ARG  34  -3.617  -8.781  -3.122
  215   2HB   ARG  34          2HB       ARG  34  -2.678  -9.214  -4.532
  216   1HG   ARG  34          1HG       ARG  34  -3.002  -6.615  -5.032
  217   2HG   ARG  34          2HG       ARG  34  -3.089  -6.591  -3.269
  218   1HD   ARG  34          1HD       ARG  34  -0.786  -6.287  -4.131
  219   2HD   ARG  34          2HD       ARG  34  -0.959  -7.718  -3.109
  220    HE   ARG  34           HE       ARG  34  -0.446  -9.028  -4.907
  221   1HH1  ARG  34          1HH1      ARG  34  -1.351  -5.843  -6.055
  222   2HH1  ARG  34          2HH1      ARG  34  -0.994  -6.198  -7.718
  223   1HH2  ARG  34          1HH2      ARG  34   0.027  -9.497  -7.072
  224   2HH2  ARG  34          2HH2      ARG  34  -0.197  -8.287  -8.296
  225    H    SER  35           H        SER  35  -4.922 -10.020  -2.930
  226    HA   SER  35           HA       SER  35  -5.803 -12.031  -2.370
  227   1HB   SER  35          1HB       SER  35  -7.158 -11.933  -5.082
  228   2HB   SER  35          2HB       SER  35  -7.553 -13.043  -3.768
  229    HG   SER  35           HG       SER  35  -8.796 -10.927  -4.074
  230    H    ASP  36           H        ASP  36  -3.246 -11.747  -3.697
  231    HA   ASP  36           HA       ASP  36  -3.044 -14.365  -4.990
  232   1HB   ASP  36          1HB       ASP  36  -0.753 -13.349  -5.750
  233   2HB   ASP  36          2HB       ASP  36  -2.227 -12.995  -6.626
  234    H    GLY  37           H        GLY  37  -0.513 -12.389  -3.641
  235   1HA   GLY  37          1HA       GLY  37  -0.244 -14.034  -1.321
  236   2HA   GLY  37          2HA       GLY  37   1.028 -14.281  -2.497
  237    H    LYS  38           H        LYS  38   1.135 -11.468  -3.332
  238    HA   LYS  38           HA       LYS  38   2.844 -10.559  -1.202
  239   1HB   LYS  38          1HB       LYS  38   2.096  -8.906  -3.582
  240   2HB   LYS  38          2HB       LYS  38   3.619  -8.961  -2.709
  241   1HG   LYS  38          1HG       LYS  38   2.607 -11.228  -4.382
  242   2HG   LYS  38          2HG       LYS  38   3.602  -9.935  -5.006
  243   1HD   LYS  38          1HD       LYS  38   5.311 -10.492  -3.269
  244   2HD   LYS  38          2HD       LYS  38   4.336 -11.903  -2.847
  245   1HE   LYS  38          1HE       LYS  38   5.626 -11.320  -5.510
  246   2HE   LYS  38          2HE       LYS  38   6.109 -12.562  -4.353
  247   1HZ   LYS  38          1HZ       LYS  38   3.722 -13.419  -4.669
  248   2HZ   LYS  38          2HZ       LYS  38   3.712 -12.476  -6.089
  249   3HZ   LYS  38          3HZ       LYS  38   4.852 -13.715  -5.898
  250    H    MET  39           H        MET  39   2.594  -8.756   0.061
  251    HA   MET  39           HA       MET  39  -0.081  -7.571   0.098
  252   1HB   MET  39          1HB       MET  39   2.045  -7.428   2.250
  253   2HB   MET  39          2HB       MET  39   0.363  -6.944   2.370
  254   1HG   MET  39          1HG       MET  39  -0.326  -9.277   2.073
  255   2HG   MET  39          2HG       MET  39   1.371  -9.747   2.024
  256   1HE   MET  39          1HE       MET  39   2.964  -8.765   3.646
  257   2HE   MET  39          2HE       MET  39   2.496  -7.868   5.093
  258   3HE   MET  39          3HE       MET  39   2.809  -9.601   5.189
  259    H    TRP  40           H        TRP  40  -0.188  -5.209   0.184
  260    HA   TRP  40           HA       TRP  40   2.334  -3.881  -0.553
  261   1HB   TRP  40          1HB       TRP  40   1.165  -2.636  -2.335
  262   2HB   TRP  40          2HB       TRP  40   1.198  -4.373  -2.655
  263    HD1  TRP  40           HD1      TRP  40  -1.259  -5.650  -1.764
  264    HE1  TRP  40           1HE      TRP  40  -3.661  -4.777  -2.087
  265    HE3  TRP  40           3HE      TRP  40  -0.229  -0.727  -2.627
  266    HZ2  TRP  40           2HZ      TRP  40  -4.941  -2.327  -2.598
  267    HZ3  TRP  40           3HZ      TRP  40  -2.102   0.820  -2.989
  268    HH2  TRP  40           HH2      TRP  40  -4.404   0.035  -2.981
  269    H    CYS  41           H        CYS  41   1.491  -1.398  -1.055
  270    HA   CYS  41           HA       CYS  41  -0.267  -0.380   1.007
  271   1HB   CYS  41          1HB       CYS  41   1.523   1.095   1.945
  272   2HB   CYS  41          2HB       CYS  41   1.811  -0.614   2.276
  273    H    ALA  42           H        ALA  42  -0.926   1.784   0.498
  274    HA   ALA  42           HA       ALA  42  -0.404   2.528  -2.250
  275   1HB   ALA  42          1HB       ALA  42  -2.659   2.821  -1.304
  276   2HB   ALA  42          2HB       ALA  42  -2.016   4.010  -0.171
  277   3HB   ALA  42          3HB       ALA  42  -1.987   4.337  -1.906
  278    H    THR  43           H        THR  43   0.585   4.477  -2.916
  279    HA   THR  43           HA       THR  43   2.513   5.455  -0.948
  280    HB   THR  43           HB       THR  43   3.795   6.236  -2.906
  281    HG1  THR  43           1HG      THR  43   2.679   6.518  -4.662
  282   1HG2  THR  43          1HG2      THR  43   3.841   3.806  -4.032
  283   2HG2  THR  43          2HG2      THR  43   4.610   4.180  -2.487
  284   3HG2  THR  43          3HG2      THR  43   3.017   3.426  -2.522
  285    H    THR  44           H        THR  44  -0.373   6.185  -1.451
  286    HA   THR  44           HA       THR  44  -0.021   9.050  -1.134
  287    HB   THR  44           HB       THR  44  -2.081   9.407  -2.595
  288    HG1  THR  44           1HG      THR  44  -2.933   7.720  -3.456
  289   1HG2  THR  44          1HG2      THR  44   0.311   8.396  -4.100
  290   2HG2  THR  44          2HG2      THR  44  -0.903   9.548  -4.657
  291   3HG2  THR  44          3HG2      THR  44   0.204   9.991  -3.356
  292    H    ALA  45           H        ALA  45  -1.786  10.020   0.040
  293    HA   ALA  45           HA       ALA  45  -2.786   8.459   2.128
  294   1HB   ALA  45          1HB       ALA  45  -3.352  11.200   1.132
  295   2HB   ALA  45          2HB       ALA  45  -4.463  10.489   2.303
  296   3HB   ALA  45          3HB       ALA  45  -2.755  10.665   2.702
  297    H    ASN  46           H        ASN  46  -4.334   9.449  -0.885
  298    HA   ASN  46           HA       ASN  46  -6.499   7.553  -0.266
  299   1HB   ASN  46          1HB       ASN  46  -7.299   9.907  -0.328
  300   2HB   ASN  46          2HB       ASN  46  -6.727  10.033  -1.990
  301   1HD2  ASN  46          1HD2      ASN  46 -10.300   8.489  -1.170
  302   2HD2  ASN  46          2HD2      ASN  46  -9.284   9.222   0.014
  303    H    TYR  47           H        TYR  47  -6.033   5.786  -1.344
  304    HA   TYR  47           HA       TYR  47  -4.487   5.757  -3.735
  305   1HB   TYR  47          1HB       TYR  47  -4.518   3.909  -2.056
  306   2HB   TYR  47          2HB       TYR  47  -6.160   3.525  -2.571
  307    HD1  TYR  47           1HD      TYR  47  -2.624   3.487  -3.545
  308    HD2  TYR  47           2HD      TYR  47  -6.578   2.424  -4.672
  309    HE1  TYR  47           1HE      TYR  47  -1.727   2.053  -5.322
  310    HE2  TYR  47           2HE      TYR  47  -5.689   0.977  -6.446
  311    HH   TYR  47           HH       TYR  47  -3.547  -0.247  -6.943
  312    H    ASP  48           H        ASP  48  -7.934   5.383  -3.040
  313    HA   ASP  48           HA       ASP  48  -8.852   4.454  -5.437
  314   1HB   ASP  48          1HB       ASP  48 -10.096   6.437  -3.553
  315   2HB   ASP  48          2HB       ASP  48 -10.951   5.756  -4.931
  316    H    ASP  49           H        ASP  49  -7.986   7.796  -4.697
  317    HA   ASP  49           HA       ASP  49  -8.840   8.662  -7.333
  318   1HB   ASP  49          1HB       ASP  49  -7.923  10.056  -4.859
  319   2HB   ASP  49          2HB       ASP  49  -7.858  10.902  -6.401
  320    H    ASP  50           H        ASP  50  -5.751   8.305  -5.594
  321    HA   ASP  50           HA       ASP  50  -4.345   9.364  -7.919
  322   1HB   ASP  50          1HB       ASP  50  -3.373   8.535  -5.190
  323   2HB   ASP  50          2HB       ASP  50  -2.314   9.102  -6.476
  324    H    ARG  51           H        ARG  51  -5.028   6.311  -6.507
  325    HA   ARG  51           HA       ARG  51  -4.331   4.205  -6.843
  326   1HB   ARG  51          1HB       ARG  51  -4.530   5.164  -9.671
  327   2HB   ARG  51          2HB       ARG  51  -4.639   3.488  -9.134
  328   1HG   ARG  51          1HG       ARG  51  -6.439   4.708  -7.517
  329   2HG   ARG  51          2HG       ARG  51  -6.617   5.637  -9.008
  330   1HD   ARG  51          1HD       ARG  51  -6.693   2.645  -8.843
  331   2HD   ARG  51          2HD       ARG  51  -8.120   3.681  -8.798
  332    HE   ARG  51           HE       ARG  51  -6.524   4.244 -11.085
  333   1HH1  ARG  51          1HH1      ARG  51  -8.820   1.961  -9.798
  334   2HH1  ARG  51          2HH1      ARG  51  -9.360   1.416 -11.349
  335   1HH2  ARG  51          1HH2      ARG  51  -7.243   3.560 -13.152
  336   2HH2  ARG  51          2HH2      ARG  51  -8.462   2.324 -13.261
  337    H    LYS  52           H        LYS  52  -2.107   5.363  -6.064
  338    HA   LYS  52           HA       LYS  52  -0.094   4.152  -7.817
  339   1HB   LYS  52          1HB       LYS  52   0.081   6.633  -6.121
  340   2HB   LYS  52          2HB       LYS  52   1.528   5.703  -6.491
  341   1HG   LYS  52          1HG       LYS  52   1.226   6.032  -8.843
  342   2HG   LYS  52          2HG       LYS  52  -0.339   6.800  -8.581
  343   1HD   LYS  52          1HD       LYS  52   2.309   7.870  -7.594
  344   2HD   LYS  52          2HD       LYS  52   1.479   8.411  -9.055
  345   1HE   LYS  52          1HE       LYS  52  -0.457   9.064  -7.684
  346   2HE   LYS  52          2HE       LYS  52   0.432   8.601  -6.236
  347   1HZ   LYS  52          1HZ       LYS  52   1.751  10.504  -8.015
  348   2HZ   LYS  52          2HZ       LYS  52   0.388  11.073  -7.195
  349   3HZ   LYS  52          3HZ       LYS  52   1.708  10.453  -6.319
  350    H    TRP  53           H        TRP  53   0.708   2.365  -7.005
  351    HA   TRP  53           HA       TRP  53   0.677   2.024  -4.090
  352   1HB   TRP  53          1HB       TRP  53  -0.129  -0.215  -4.388
  353   2HB   TRP  53          2HB       TRP  53  -1.185   0.884  -5.188
  354    HD1  TRP  53           HD1      TRP  53  -0.637   1.073  -8.036
  355    HE1  TRP  53           1HE      TRP  53  -0.149  -0.930  -9.586
  356    HE3  TRP  53           3HE      TRP  53   0.746  -2.223  -4.508
  357    HZ2  TRP  53           2HZ      TRP  53   0.766  -3.619  -9.301
  358    HZ3  TRP  53           3HZ      TRP  53   1.452  -4.518  -5.173
  359    HH2  TRP  53           HH2      TRP  53   1.457  -5.185  -7.536
  360    H    GLY  54           H        GLY  54   1.849   0.137  -3.354
  361   1HA   GLY  54          1HA       GLY  54   4.079  -0.872  -4.873
  362   2HA   GLY  54          2HA       GLY  54   4.554   0.262  -3.610
  363    H    PHE  55           H        PHE  55   4.946  -2.679  -3.898
  364    HA   PHE  55           HA       PHE  55   3.338  -4.098  -2.097
  365   1HB   PHE  55          1HB       PHE  55   6.077  -4.464  -3.252
  366   2HB   PHE  55          2HB       PHE  55   5.518  -5.541  -1.988
  367    HD1  PHE  55           1HD      PHE  55   2.547  -5.028  -3.356
  368    HD2  PHE  55           2HD      PHE  55   6.313  -6.615  -4.531
  369    HE1  PHE  55           1HE      PHE  55   1.418  -6.488  -4.996
  370    HE2  PHE  55           2HE      PHE  55   5.195  -8.079  -6.170
  371    HZ   PHE  55           HZ       PHE  55   2.748  -7.995  -6.412
  372    H    CYS  56           H        CYS  56   3.975  -4.981  -0.040
  373    HA   CYS  56           HA       CYS  56   4.896  -2.988   1.790
  374   1HB   CYS  56          1HB       CYS  56   3.197  -5.022   2.074
  375   2HB   CYS  56          2HB       CYS  56   4.659  -5.900   2.498
  376    HA   PRO  57           HA       PRO  57   9.295  -3.363   2.190
  377   1HB   PRO  57          1HB       PRO  57   9.318  -4.818   4.632
  378   2HB   PRO  57          2HB       PRO  57   9.714  -3.123   4.340
  379   1HG   PRO  57          1HG       PRO  57   7.170  -4.359   5.124
  380   2HG   PRO  57          2HG       PRO  57   7.773  -2.742   5.502
  381   1HD   PRO  57          1HD       PRO  57   5.802  -3.036   3.765
  382   2HD   PRO  57          2HD       PRO  57   7.146  -1.939   3.362
  383    H    ASP  58           H        ASP  58   9.646  -5.942   4.077
  384    HA   ASP  58           HA       ASP  58  10.841  -7.455   1.937
  385   1HB   ASP  58          1HB       ASP  58  11.771  -7.157   4.335
  386   2HB   ASP  58          2HB       ASP  58  10.655  -8.443   4.776
  387    H    GLN  59           H        GLN  59   9.424  -8.458   0.646
  388    HA   GLN  59           HA       GLN  59   7.345 -10.145   1.876
  389   1HB   GLN  59          1HB       GLN  59   7.532  -8.910  -0.875
  390   2HB   GLN  59          2HB       GLN  59   6.324 -10.111  -0.439
  391   1HG   GLN  59          1HG       GLN  59   6.650  -7.507   1.024
  392   2HG   GLN  59          2HG       GLN  59   5.594  -7.698  -0.372
  393   1HE2  GLN  59          1HE2      GLN  59   4.100 -10.379   2.070
  394   2HE2  GLN  59          2HE2      GLN  59   5.423 -10.606   0.982
  395    H    GLY  60           H        GLY  60   8.880 -10.244  -1.309
  396   1HA   GLY  60          1HA       GLY  60  10.651 -12.289  -1.089
  397   2HA   GLY  60          2HA       GLY  60   9.099 -13.112  -1.190
  Start of MODEL   33
    1    H    SER   1           1H       SER   1  16.613   2.607   8.835
    2    HA   SER   1           HA       SER   1  14.530   2.212   8.525
    3   1HB   SER   1          1HB       SER   1  14.256   5.206   8.104
    4   2HB   SER   1          2HB       SER   1  12.973   4.096   8.600
    5    HG   SER   1           HG       SER   1  14.980   5.259  10.087
    6    H    TRP   2           H        TRP   2  13.490   1.300   6.864
    7    HA   TRP   2           HA       TRP   2  13.352   2.695   4.300
    8   1HB   TRP   2          1HB       TRP   2  15.422   1.171   4.371
    9   2HB   TRP   2          2HB       TRP   2  14.288  -0.175   4.374
   10    HD1  TRP   2           HD1      TRP   2  14.812   2.999   2.189
   11    HE1  TRP   2           1HE      TRP   2  14.517   2.315  -0.277
   12    HE3  TRP   2           3HE      TRP   2  13.714  -1.933   2.861
   13    HZ2  TRP   2           2HZ      TRP   2  13.897  -0.023  -1.740
   14    HZ3  TRP   2           3HZ      TRP   2  13.280  -3.329   0.886
   15    HH2  TRP   2           HH2      TRP   2  13.368  -2.392  -1.366
   16    H    MET   3           H        MET   3  11.145   2.861   4.499
   17    HA   MET   3           HA       MET   3   9.661   0.330   4.550
   18   1HB   MET   3          1HB       MET   3   7.728   1.773   5.319
   19   2HB   MET   3          2HB       MET   3   9.006   1.516   6.486
   20   1HG   MET   3          1HG       MET   3   9.893   3.740   6.002
   21   2HG   MET   3          2HG       MET   3   8.624   3.990   4.805
   22   1HE   MET   3          1HE       MET   3   6.207   2.635   6.055
   23   2HE   MET   3          2HE       MET   3   5.430   3.784   7.147
   24   3HE   MET   3          3HE       MET   3   5.934   4.300   5.535
   25    H    SER   4           H        SER   4  10.799   1.231   2.238
   26    HA   SER   4           HA       SER   4   8.898   2.729   0.679
   27   1HB   SER   4          1HB       SER   4  11.363   1.228  -0.228
   28   2HB   SER   4          2HB       SER   4  10.496   2.471  -1.131
   29    HG   SER   4           HG       SER   4  11.927   3.732  -0.199
   30    H    THR   5           H        THR   5   8.728   1.579  -1.720
   31    HA   THR   5           HA       THR   5   7.068  -0.736  -1.164
   32    HB   THR   5           HB       THR   5   6.293  -0.304  -3.533
   33    HG1  THR   5           1HG      THR   5   7.470   2.227  -3.297
   34   1HG2  THR   5          1HG2      THR   5   5.967   2.210  -1.979
   35   2HG2  THR   5          2HG2      THR   5   4.775   1.289  -2.900
   36   3HG2  THR   5          3HG2      THR   5   5.321   0.702  -1.329
   37    H    VAL   6           H        VAL   6   6.999  -2.535  -2.633
   38    HA   VAL   6           HA       VAL   6   9.586  -3.194  -3.874
   39    HB   VAL   6           HB       VAL   6   7.924  -5.392  -2.834
   40   1HG1  VAL   6          1HG1      VAL   6  10.793  -4.881  -3.311
   41   2HG1  VAL   6          2HG1      VAL   6  10.360  -6.066  -2.077
   42   3HG1  VAL   6          3HG1      VAL   6   9.796  -6.271  -3.736
   43   1HG2  VAL   6          1HG2      VAL   6   8.836  -3.289  -1.096
   44   2HG2  VAL   6          2HG2      VAL   6   7.772  -4.655  -0.764
   45   3HG2  VAL   6          3HG2      VAL   6   9.520  -4.851  -0.648
   46    H    GLY   7           H        GLY   7   6.700  -2.466  -4.418
   47   1HA   GLY   7          1HA       GLY   7   6.467  -3.919  -6.879
   48   2HA   GLY   7          2HA       GLY   7   5.184  -4.207  -5.733
   49    H    GLY   8           H        GLY   8   3.768  -3.301  -7.365
   50   1HA   GLY   8          1HA       GLY   8   2.354  -1.562  -7.886
   51   2HA   GLY   8          2HA       GLY   8   3.267  -0.554  -6.782
   52    H    ASN   9           H        ASN   9   2.289   0.539  -9.025
   53    HA   ASN   9           HA       ASN   9   4.207   0.522 -11.157
   54   1HB   ASN   9          1HB       ASN   9   2.875   2.481 -12.017
   55   2HB   ASN   9          2HB       ASN   9   1.978   0.992 -11.811
   56   1HD2  ASN   9          1HD2      ASN   9   1.005   3.059  -8.611
   57   2HD2  ASN   9          2HD2      ASN   9   2.478   2.188  -8.825
   58    H    SER  10           H        SER  10   4.253   1.896  -8.121
   59    HA   SER  10           HA       SER  10   5.586   4.347  -8.812
   60   1HB   SER  10          1HB       SER  10   5.504   3.024  -6.095
   61   2HB   SER  10          2HB       SER  10   5.674   4.738  -6.466
   62    HG   SER  10           HG       SER  10   3.537   4.241  -5.828
   63    H    GLY  11           H        GLY  11   6.518   1.314  -7.193
   64   1HA   GLY  11          1HA       GLY  11   8.532   0.239  -6.983
   65   2HA   GLY  11          2HA       GLY  11   8.895   0.907  -8.561
   66    H    GLY  12           H        GLY  12   9.037   1.595  -5.086
   67   1HA   GLY  12          1HA       GLY  12  11.381   2.245  -4.427
   68   2HA   GLY  12          2HA       GLY  12  11.260   3.442  -5.705
   69    H    ALA  13           H        ALA  13   8.511   4.178  -5.121
   70    HA   ALA  13           HA       ALA  13   9.018   6.175  -3.168
   71   1HB   ALA  13          1HB       ALA  13   7.379   6.224  -5.161
   72   2HB   ALA  13          2HB       ALA  13   6.261   5.416  -4.060
   73   3HB   ALA  13          3HB       ALA  13   6.901   7.009  -3.657
   74    HA   PRO  14           HA       PRO  14   7.749   3.958   0.437
   75   1HB   PRO  14          1HB       PRO  14   7.382   5.999   2.154
   76   2HB   PRO  14          2HB       PRO  14   8.984   5.538   1.573
   77   1HG   PRO  14          1HG       PRO  14   7.259   7.826   0.767
   78   2HG   PRO  14          2HG       PRO  14   9.024   7.737   0.886
   79   1HD   PRO  14          1HD       PRO  14   7.534   7.542  -1.467
   80   2HD   PRO  14          2HD       PRO  14   9.226   7.044  -1.268
   81    H    CYS  15           H        CYS  15   5.931   3.383   1.637
   82    HA   CYS  15           HA       CYS  15   3.411   4.116   0.459
   83   1HB   CYS  15          1HB       CYS  15   4.095   2.322   2.807
   84   2HB   CYS  15          2HB       CYS  15   2.480   2.495   2.126
   85    H    VAL  16           H        VAL  16   1.817   5.406   1.353
   86    HA   VAL  16           HA       VAL  16   2.579   6.937   3.747
   87    HB   VAL  16           HB       VAL  16   0.498   7.633   1.660
   88   1HG1  VAL  16          1HG1      VAL  16   0.426   8.543   4.126
   89   2HG1  VAL  16          2HG1      VAL  16   1.683   9.627   3.533
   90   3HG1  VAL  16          3HG1      VAL  16   0.097   9.599   2.757
   91   1HG2  VAL  16          1HG2      VAL  16   3.249   7.703   1.362
   92   2HG2  VAL  16          2HG2      VAL  16   2.068   8.588   0.395
   93   3HG2  VAL  16          3HG2      VAL  16   2.828   9.365   1.784
   94    H    PHE  17           H        PHE  17   1.583   6.392   5.592
   95    HA   PHE  17           HA       PHE  17  -1.093   5.200   5.426
   96   1HB   PHE  17          1HB       PHE  17   0.960   4.954   7.637
   97   2HB   PHE  17          2HB       PHE  17  -0.619   4.204   7.617
   98    HD1  PHE  17           1HD      PHE  17   2.668   4.229   5.997
   99    HD2  PHE  17           2HD      PHE  17  -1.000   2.154   6.505
  100    HE1  PHE  17           1HE      PHE  17   3.649   2.272   4.890
  101    HE2  PHE  17           2HE      PHE  17  -0.035   0.182   5.406
  102    HZ   PHE  17           HZ       PHE  17   2.302   0.211   4.585
  103    HA   PRO  18           HA       PRO  18  -2.624   4.701   6.827
  104   1HB   PRO  18          1HB       PRO  18  -5.183   5.903   7.145
  105   2HB   PRO  18          2HB       PRO  18  -4.333   4.872   8.295
  106   1HG   PRO  18          1HG       PRO  18  -4.899   7.573   8.650
  107   2HG   PRO  18          2HG       PRO  18  -3.695   6.648   9.562
  108   1HD   PRO  18          1HD       PRO  18  -3.317   8.518   7.269
  109   2HD   PRO  18          2HD       PRO  18  -2.263   8.208   8.665
  110    H    PHE  19           H        PHE  19  -3.230   3.937   4.874
  111    HA   PHE  19           HA       PHE  19  -4.211   5.916   2.922
  112   1HB   PHE  19          1HB       PHE  19  -3.388   4.535   1.138
  113   2HB   PHE  19          2HB       PHE  19  -2.075   4.826   2.272
  114    HD1  PHE  19           1HD      PHE  19  -1.595   2.949   3.986
  115    HD2  PHE  19           2HD      PHE  19  -3.892   2.393   0.452
  116    HE1  PHE  19           1HE      PHE  19  -1.195   0.530   4.112
  117    HE2  PHE  19           2HE      PHE  19  -3.494  -0.032   0.567
  118    HZ   PHE  19           HZ       PHE  19  -2.142  -0.964   2.399
  119    H    THR  20           H        THR  20  -6.204   5.690   2.185
  120    HA   THR  20           HA       THR  20  -7.730   3.402   3.145
  121    HB   THR  20           HB       THR  20  -8.556   6.007   1.828
  122    HG1  THR  20           1HG      THR  20  -7.997   6.494   3.849
  123   1HG2  THR  20          1HG2      THR  20 -10.778   5.066   3.128
  124   2HG2  THR  20          2HG2      THR  20 -10.513   5.066   1.384
  125   3HG2  THR  20          3HG2      THR  20 -10.142   3.625   2.332
  126    H    PHE  21           H        PHE  21  -8.338   1.759   1.955
  127    HA   PHE  21           HA       PHE  21  -8.211   2.012  -0.988
  128   1HB   PHE  21          1HB       PHE  21  -6.430   0.520   0.070
  129   2HB   PHE  21          2HB       PHE  21  -7.744  -0.502   0.602
  130    HD1  PHE  21           1HD      PHE  21  -6.398   0.984  -2.529
  131    HD2  PHE  21           2HD      PHE  21  -8.442  -2.272  -0.715
  132    HE1  PHE  21           1HE      PHE  21  -6.253  -0.259  -4.630
  133    HE2  PHE  21           2HE      PHE  21  -8.298  -3.522  -2.821
  134    HZ   PHE  21           HZ       PHE  21  -7.215  -2.525  -4.788
  135    H    LEU  22           H        LEU  22  -9.920   1.318  -2.047
  136    HA   LEU  22           HA       LEU  22 -12.121   0.956  -2.364
  137   1HB   LEU  22          1HB       LEU  22 -10.606  -1.388  -1.454
  138   2HB   LEU  22          2HB       LEU  22 -12.283  -1.598  -1.912
  139    HG   LEU  22           HG       LEU  22 -10.640  -2.039  -3.731
  140   1HD1  LEU  22          1HD1      LEU  22 -12.667   0.100  -3.956
  141   2HD1  LEU  22          2HD1      LEU  22 -11.834  -0.573  -5.359
  142   3HD1  LEU  22          3HD1      LEU  22 -12.831  -1.614  -4.345
  143   1HD2  LEU  22          1HD2      LEU  22 -10.219   0.911  -3.531
  144   2HD2  LEU  22          2HD2      LEU  22  -8.999  -0.357  -3.402
  145   3HD2  LEU  22          3HD2      LEU  22  -9.802  -0.055  -4.946
  146    H    GLY  23           H        GLY  23 -12.096   2.328  -0.077
  147   1HA   GLY  23          1HA       GLY  23 -13.944   2.824   1.316
  148   2HA   GLY  23          2HA       GLY  23 -14.358   1.126   1.327
  149    H    ASN  24           H        ASN  24 -11.344   0.570   2.152
  150    HA   ASN  24           HA       ASN  24 -11.884   1.205   4.977
  151   1HB   ASN  24          1HB       ASN  24 -10.340  -1.075   3.743
  152   2HB   ASN  24          2HB       ASN  24 -10.512  -0.793   5.471
  153   1HD2  ASN  24          1HD2      ASN  24 -13.342  -2.686   3.408
  154   2HD2  ASN  24          2HD2      ASN  24 -11.797  -2.265   2.771
  155    H    LYS  25           H        LYS  25 -10.440   2.265   6.172
  156    HA   LYS  25           HA       LYS  25  -8.170   3.471   4.920
  157   1HB   LYS  25          1HB       LYS  25  -8.965   3.514   7.833
  158   2HB   LYS  25          2HB       LYS  25  -8.037   4.693   6.948
  159   1HG   LYS  25          1HG       LYS  25  -9.980   5.374   5.681
  160   2HG   LYS  25          2HG       LYS  25 -10.938   4.112   6.468
  161   1HD   LYS  25          1HD       LYS  25 -11.438   6.165   7.569
  162   2HD   LYS  25          2HD       LYS  25 -10.426   5.215   8.660
  163   1HE   LYS  25          1HE       LYS  25  -8.457   6.514   7.717
  164   2HE   LYS  25          2HE       LYS  25  -9.647   7.589   6.982
  165   1HZ   LYS  25          1HZ       LYS  25 -10.584   7.841   9.291
  166   2HZ   LYS  25          2HZ       LYS  25  -9.170   7.081   9.858
  167   3HZ   LYS  25          3HZ       LYS  25  -9.066   8.558   9.020
  168    H    TYR  26           H        TYR  26  -6.115   2.599   4.954
  169    HA   TYR  26           HA       TYR  26  -5.691   0.391   6.833
  170   1HB   TYR  26          1HB       TYR  26  -4.277   0.965   4.234
  171   2HB   TYR  26          2HB       TYR  26  -4.001  -0.420   5.275
  172    HD1  TYR  26           1HD      TYR  26  -7.026  -0.844   5.891
  173    HD2  TYR  26           2HD      TYR  26  -4.832  -0.294   2.296
  174    HE1  TYR  26           1HE      TYR  26  -8.712  -2.122   4.663
  175    HE2  TYR  26           2HE      TYR  26  -6.512  -1.573   1.070
  176    HH   TYR  26           HH       TYR  26  -8.489  -3.598   2.235
  177    H    GLU  27           H        GLU  27  -4.355   0.661   8.387
  178    HA   GLU  27           HA       GLU  27  -2.485   2.907   8.347
  179   1HB   GLU  27          1HB       GLU  27  -3.618   1.236  10.576
  180   2HB   GLU  27          2HB       GLU  27  -2.401   2.462  10.804
  181   1HG   GLU  27          1HG       GLU  27  -3.947   4.158   9.940
  182   2HG   GLU  27          2HG       GLU  27  -5.174   2.912   9.742
  183    H    SER  28           H        SER  28  -2.655  -0.354   7.876
  184    HA   SER  28           HA       SER  28   0.228  -0.651   8.191
  185   1HB   SER  28          1HB       SER  28  -0.443  -3.146   8.632
  186   2HB   SER  28          2HB       SER  28  -0.531  -1.998   9.957
  187    HG   SER  28           HG       SER  28  -2.643  -3.047   8.382
  188    H    CYS  29           H        CYS  29   0.896  -2.670   6.766
  189    HA   CYS  29           HA       CYS  29   0.059  -2.108   4.133
  190   1HB   CYS  29          1HB       CYS  29   1.465  -4.583   5.125
  191   2HB   CYS  29          2HB       CYS  29   1.380  -4.041   3.465
  192    H    THR  30           H        THR  30  -0.913  -3.660   2.664
  193    HA   THR  30           HA       THR  30  -2.843  -5.471   3.937
  194    HB   THR  30           HB       THR  30  -3.958  -3.255   3.532
  195    HG1  THR  30           1HG      THR  30  -5.360  -4.903   3.434
  196   1HG2  THR  30          1HG2      THR  30  -4.447  -2.594   1.231
  197   2HG2  THR  30          2HG2      THR  30  -2.722  -2.512   1.584
  198   3HG2  THR  30          3HG2      THR  30  -3.365  -3.853   0.636
  199    H    SER  31           H        SER  31  -4.052  -6.671   2.125
  200    HA   SER  31           HA       SER  31  -2.264  -7.206  -0.134
  201   1HB   SER  31          1HB       SER  31  -2.930  -9.637   0.070
  202   2HB   SER  31          2HB       SER  31  -1.912  -9.040   1.396
  203    HG   SER  31           HG       SER  31  -4.242 -10.226   1.596
  204    H    ALA  32           H        ALA  32  -4.627  -5.589   0.495
  205    HA   ALA  32           HA       ALA  32  -6.997  -6.580  -0.587
  206   1HB   ALA  32          1HB       ALA  32  -5.983  -4.069   0.393
  207   2HB   ALA  32          2HB       ALA  32  -6.909  -3.794  -1.083
  208   3HB   ALA  32          3HB       ALA  32  -7.655  -4.616   0.287
  209    H    GLY  33           H        GLY  33  -7.877  -6.627  -2.574
  210   1HA   GLY  33          1HA       GLY  33  -8.060  -6.399  -4.864
  211   2HA   GLY  33          2HA       GLY  33  -6.741  -5.238  -4.803
  212    H    ARG  34           H        ARG  34  -5.451  -7.784  -3.258
  213    HA   ARG  34           HA       ARG  34  -4.317  -8.791  -5.769
  214   1HB   ARG  34          1HB       ARG  34  -3.191  -9.190  -3.006
  215   2HB   ARG  34          2HB       ARG  34  -2.390  -9.422  -4.539
  216   1HG   ARG  34          1HG       ARG  34  -2.919  -6.845  -4.815
  217   2HG   ARG  34          2HG       ARG  34  -2.915  -6.923  -3.052
  218   1HD   ARG  34          1HD       ARG  34  -0.697  -6.370  -3.998
  219   2HD   ARG  34          2HD       ARG  34  -0.693  -7.858  -3.045
  220    HE   ARG  34           HE       ARG  34  -0.045  -8.984  -4.921
  221   1HH1  ARG  34          1HH1      ARG  34  -1.519  -5.975  -5.901
  222   2HH1  ARG  34          2HH1      ARG  34  -1.292  -6.254  -7.600
  223   1HH2  ARG  34          1HH2      ARG  34   0.236  -9.373  -7.183
  224   2HH2  ARG  34          2HH2      ARG  34  -0.304  -8.177  -8.324
  225    H    SER  35           H        SER  35  -3.935 -11.035  -6.047
  226    HA   SER  35           HA       SER  35  -5.603 -12.754  -4.338
  227   1HB   SER  35          1HB       SER  35  -6.673 -12.282  -6.551
  228   2HB   SER  35          2HB       SER  35  -5.288 -13.030  -7.342
  229    HG   SER  35           HG       SER  35  -5.849 -14.982  -6.519
  230    H    ASP  36           H        ASP  36  -2.535 -12.066  -5.129
  231    HA   ASP  36           HA       ASP  36  -1.612 -14.803  -5.444
  232   1HB   ASP  36          1HB       ASP  36   0.696 -13.502  -5.271
  233   2HB   ASP  36          2HB       ASP  36  -0.217 -13.588  -6.759
  234    H    GLY  37           H        GLY  37  -0.337 -12.246  -3.453
  235   1HA   GLY  37          1HA       GLY  37  -0.980 -13.171  -0.956
  236   2HA   GLY  37          2HA       GLY  37   0.466 -14.060  -1.398
  237    H    LYS  38           H        LYS  38   1.345 -11.627  -3.001
  238    HA   LYS  38           HA       LYS  38   3.048 -10.515  -1.103
  239   1HB   LYS  38          1HB       LYS  38   2.149  -9.296  -3.722
  240   2HB   LYS  38          2HB       LYS  38   3.605  -8.892  -2.834
  241   1HG   LYS  38          1HG       LYS  38   4.192 -10.245  -4.693
  242   2HG   LYS  38          2HG       LYS  38   4.445 -11.189  -3.240
  243   1HD   LYS  38          1HD       LYS  38   2.655 -12.583  -3.698
  244   2HD   LYS  38          2HD       LYS  38   1.883 -11.413  -4.769
  245   1HE   LYS  38          1HE       LYS  38   4.509 -12.728  -5.418
  246   2HE   LYS  38          2HE       LYS  38   2.955 -13.425  -5.872
  247   1HZ   LYS  38          1HZ       LYS  38   2.504 -11.210  -6.977
  248   2HZ   LYS  38          2HZ       LYS  38   4.151 -10.869  -6.790
  249   3HZ   LYS  38          3HZ       LYS  38   3.657 -12.199  -7.726
  250    H    MET  39           H        MET  39   2.731  -8.956   0.403
  251    HA   MET  39           HA       MET  39   0.206  -7.529   0.341
  252   1HB   MET  39          1HB       MET  39   2.378  -7.479   2.444
  253   2HB   MET  39          2HB       MET  39   0.769  -6.788   2.578
  254   1HG   MET  39          1HG       MET  39  -0.195  -9.044   2.372
  255   2HG   MET  39          2HG       MET  39   1.439  -9.706   2.353
  256   1HE   MET  39          1HE       MET  39  -0.450 -10.876   4.015
  257   2HE   MET  39          2HE       MET  39   0.959 -11.257   5.002
  258   3HE   MET  39          3HE       MET  39  -0.461 -10.516   5.743
  259    H    TRP  40           H        TRP  40   0.036  -5.319   0.211
  260    HA   TRP  40           HA       TRP  40   2.488  -3.850  -0.481
  261   1HB   TRP  40          1HB       TRP  40   1.227  -2.709  -2.274
  262   2HB   TRP  40          2HB       TRP  40   1.335  -4.448  -2.565
  263    HD1  TRP  40           HD1      TRP  40  -1.014  -5.833  -1.625
  264    HE1  TRP  40           1HE      TRP  40  -3.464  -5.099  -1.872
  265    HE3  TRP  40           3HE      TRP  40  -0.294  -0.868  -2.559
  266    HZ2  TRP  40           2HZ      TRP  40  -4.895  -2.737  -2.361
  267    HZ3  TRP  40           3HZ      TRP  40  -2.261   0.559  -2.883
  268    HH2  TRP  40           HH2      TRP  40  -4.510  -0.359  -2.793
  269    H    CYS  41           H        CYS  41   1.354  -1.454  -1.040
  270    HA   CYS  41           HA       CYS  41  -0.524  -0.515   0.849
  271   1HB   CYS  41          1HB       CYS  41   1.293   1.028   1.960
  272   2HB   CYS  41          2HB       CYS  41   0.982  -0.582   2.593
  273    H    ALA  42           H        ALA  42  -1.024   1.717   0.465
  274    HA   ALA  42           HA       ALA  42  -0.357   2.522  -2.205
  275   1HB   ALA  42          1HB       ALA  42  -2.569   2.901  -0.836
  276   2HB   ALA  42          2HB       ALA  42  -1.744   4.381  -0.341
  277   3HB   ALA  42          3HB       ALA  42  -2.037   4.067  -2.052
  278    H    THR  43           H        THR  43   0.672   4.408  -2.851
  279    HA   THR  43           HA       THR  43   2.712   5.315  -0.962
  280    HB   THR  43           HB       THR  43   3.894   6.123  -2.952
  281    HG1  THR  43           1HG      THR  43   2.927   6.345  -4.810
  282   1HG2  THR  43          1HG2      THR  43   2.883   3.406  -3.681
  283   2HG2  THR  43          2HG2      THR  43   4.501   4.081  -3.872
  284   3HG2  THR  43          3HG2      THR  43   3.907   3.654  -2.268
  285    H    THR  44           H        THR  44  -0.247   6.082  -1.499
  286    HA   THR  44           HA       THR  44   0.142   8.963  -1.137
  287    HB   THR  44           HB       THR  44  -2.006   9.307  -2.401
  288    HG1  THR  44           1HG      THR  44  -3.091   7.571  -2.793
  289   1HG2  THR  44          1HG2      THR  44  -0.164   7.929  -4.300
  290   2HG2  THR  44          2HG2      THR  44  -1.097   9.413  -4.505
  291   3HG2  THR  44          3HG2      THR  44   0.347   9.409  -3.491
  292    H    ALA  45           H        ALA  45  -1.439   9.907   0.275
  293    HA   ALA  45           HA       ALA  45  -2.224   8.321   2.446
  294   1HB   ALA  45          1HB       ALA  45  -2.105  11.010   1.952
  295   2HB   ALA  45          2HB       ALA  45  -3.843  10.726   2.079
  296   3HB   ALA  45          3HB       ALA  45  -2.776  10.269   3.404
  297    H    ASN  46           H        ASN  46  -4.004   9.269  -0.442
  298    HA   ASN  46           HA       ASN  46  -6.141   7.424   0.403
  299   1HB   ASN  46          1HB       ASN  46  -6.922   9.792   0.420
  300   2HB   ASN  46          2HB       ASN  46  -6.515   9.912  -1.290
  301   1HD2  ASN  46          1HD2      ASN  46  -9.984   8.365  -0.072
  302   2HD2  ASN  46          2HD2      ASN  46  -8.821   9.052   0.996
  303    H    TYR  47           H        TYR  47  -5.943   5.680  -0.776
  304    HA   TYR  47           HA       TYR  47  -4.556   5.653  -3.274
  305   1HB   TYR  47          1HB       TYR  47  -4.530   3.765  -1.621
  306   2HB   TYR  47          2HB       TYR  47  -6.202   3.430  -2.061
  307    HD1  TYR  47           1HD      TYR  47  -2.721   3.365  -3.228
  308    HD2  TYR  47           2HD      TYR  47  -6.748   2.371  -4.154
  309    HE1  TYR  47           1HE      TYR  47  -1.948   1.954  -5.074
  310    HE2  TYR  47           2HE      TYR  47  -5.974   0.951  -6.002
  311    HH   TYR  47           HH       TYR  47  -3.854  -0.292  -6.615
  312    H    ASP  48           H        ASP  48  -7.956   5.403  -2.321
  313    HA   ASP  48           HA       ASP  48  -9.155   4.547  -4.605
  314   1HB   ASP  48          1HB       ASP  48 -10.021   6.573  -2.574
  315   2HB   ASP  48          2HB       ASP  48 -11.047   6.203  -3.956
  316    H    ASP  49           H        ASP  49  -7.872   7.769  -4.044
  317    HA   ASP  49           HA       ASP  49  -8.934   8.829  -6.503
  318   1HB   ASP  49          1HB       ASP  49  -7.193   9.898  -4.311
  319   2HB   ASP  49          2HB       ASP  49  -7.304  10.762  -5.841
  320    H    ASP  50           H        ASP  50  -5.583   9.035  -5.414
  321    HA   ASP  50           HA       ASP  50  -4.536   9.203  -8.017
  322   1HB   ASP  50          1HB       ASP  50  -3.268   8.821  -5.321
  323   2HB   ASP  50          2HB       ASP  50  -2.305   8.900  -6.793
  324    H    ARG  51           H        ARG  51  -5.225   6.406  -6.120
  325    HA   ARG  51           HA       ARG  51  -4.648   4.236  -6.259
  326   1HB   ARG  51          1HB       ARG  51  -5.009   4.889  -9.158
  327   2HB   ARG  51          2HB       ARG  51  -5.150   3.287  -8.434
  328   1HG   ARG  51          1HG       ARG  51  -6.804   4.637  -6.845
  329   2HG   ARG  51          2HG       ARG  51  -6.986   5.591  -8.321
  330   1HD   ARG  51          1HD       ARG  51  -7.154   2.613  -8.323
  331   2HD   ARG  51          2HD       ARG  51  -8.550   3.619  -7.930
  332    HE   ARG  51           HE       ARG  51  -7.657   4.652 -10.288
  333   1HH1  ARG  51          1HH1      ARG  51  -8.466   1.429  -9.234
  334   2HH1  ARG  51          2HH1      ARG  51  -9.131   0.936 -10.758
  335   1HH2  ARG  51          1HH2      ARG  51  -8.543   4.030 -12.317
  336   2HH2  ARG  51          2HH2      ARG  51  -9.214   2.439 -12.510
  337    H    LYS  52           H        LYS  52  -2.387   5.422  -5.750
  338    HA   LYS  52           HA       LYS  52  -0.447   4.188  -7.561
  339   1HB   LYS  52          1HB       LYS  52  -0.163   6.578  -5.725
  340   2HB   LYS  52          2HB       LYS  52   1.212   5.794  -6.496
  341   1HG   LYS  52          1HG       LYS  52   0.676   6.562  -8.578
  342   2HG   LYS  52          2HG       LYS  52  -1.049   6.639  -8.228
  343   1HD   LYS  52          1HD       LYS  52  -0.638   8.607  -6.798
  344   2HD   LYS  52          2HD       LYS  52   1.069   8.555  -7.258
  345   1HE   LYS  52          1HE       LYS  52   0.550   9.011  -9.540
  346   2HE   LYS  52          2HE       LYS  52  -1.174   8.757  -9.266
  347   1HZ   LYS  52          1HZ       LYS  52  -1.080  10.739  -7.755
  348   2HZ   LYS  52          2HZ       LYS  52   0.495  11.039  -8.329
  349   3HZ   LYS  52          3HZ       LYS  52  -0.825  11.075  -9.400
  350    H    TRP  53           H        TRP  53   0.367   2.391  -6.823
  351    HA   TRP  53           HA       TRP  53   0.489   1.973  -3.918
  352   1HB   TRP  53          1HB       TRP  53  -0.312  -0.254  -4.261
  353   2HB   TRP  53          2HB       TRP  53  -1.392   0.848  -5.036
  354    HD1  TRP  53           HD1      TRP  53  -0.720   1.166  -7.888
  355    HE1  TRP  53           1HE      TRP  53  -0.200  -0.783  -9.499
  356    HE3  TRP  53           3HE      TRP  53   0.391  -2.301  -4.436
  357    HZ2  TRP  53           2HZ      TRP  53   0.576  -3.522  -9.276
  358    HZ3  TRP  53           3HZ      TRP  53   1.017  -4.597  -5.162
  359    HH2  TRP  53           HH2      TRP  53   1.110  -5.182  -7.539
  360    H    GLY  54           H        GLY  54   1.643  -0.117  -3.438
  361   1HA   GLY  54          1HA       GLY  54   3.774  -1.064  -5.021
  362   2HA   GLY  54          2HA       GLY  54   4.381   0.158  -3.904
  363    H    PHE  55           H        PHE  55   5.012  -2.681  -3.864
  364    HA   PHE  55           HA       PHE  55   3.496  -4.029  -1.934
  365   1HB   PHE  55          1HB       PHE  55   6.313  -4.401  -2.898
  366   2HB   PHE  55          2HB       PHE  55   5.543  -5.479  -1.748
  367    HD1  PHE  55           1HD      PHE  55   2.924  -4.501  -3.670
  368    HD2  PHE  55           2HD      PHE  55   6.495  -6.791  -3.967
  369    HE1  PHE  55           1HE      PHE  55   1.923  -5.817  -5.504
  370    HE2  PHE  55           2HE      PHE  55   5.494  -8.111  -5.801
  371    HZ   PHE  55           HZ       PHE  55   3.210  -7.603  -6.575
  372    H    CYS  56           H        CYS  56   4.204  -4.794   0.124
  373    HA   CYS  56           HA       CYS  56   5.004  -2.650   1.877
  374   1HB   CYS  56          1HB       CYS  56   3.250  -4.444   2.373
  375   2HB   CYS  56          2HB       CYS  56   4.581  -5.575   2.550
  376    HA   PRO  57           HA       PRO  57   9.340  -3.569   1.748
  377   1HB   PRO  57          1HB       PRO  57  10.184  -2.438   4.017
  378   2HB   PRO  57          2HB       PRO  57   9.570  -1.469   2.666
  379   1HG   PRO  57          1HG       PRO  57   8.072  -2.523   5.017
  380   2HG   PRO  57          2HG       PRO  57   8.203  -0.826   4.514
  381   1HD   PRO  57          1HD       PRO  57   6.075  -2.215   3.804
  382   2HD   PRO  57          2HD       PRO  57   6.889  -1.210   2.580
  383    H    ASP  58           H        ASP  58  10.863  -3.838   4.118
  384    HA   ASP  58           HA       ASP  58  10.864  -6.644   4.394
  385   1HB   ASP  58          1HB       ASP  58  12.840  -5.080   4.719
  386   2HB   ASP  58          2HB       ASP  58  12.170  -4.710   6.306
  387    H    GLN  59           H        GLN  59   9.375  -7.761   5.376
  388    HA   GLN  59           HA       GLN  59   8.126  -6.703   7.817
  389   1HB   GLN  59          1HB       GLN  59   7.128  -8.907   6.005
  390   2HB   GLN  59          2HB       GLN  59   6.256  -8.168   7.338
  391   1HG   GLN  59          1HG       GLN  59   6.025  -6.134   6.168
  392   2HG   GLN  59          2HG       GLN  59   7.168  -6.646   4.927
  393   1HE2  GLN  59          1HE2      GLN  59   4.729  -7.981   2.911
  394   2HE2  GLN  59          2HE2      GLN  59   6.311  -7.311   3.110
  395    H    GLY  60           H        GLY  60   7.363  -9.895   7.529
  396   1HA   GLY  60          1HA       GLY  60   9.755 -11.017   8.709
  397   2HA   GLY  60          2HA       GLY  60   8.396 -10.867   9.815
  Start of MODEL   34
    1    H    SER   1           1H       SER   1  12.233  10.050   8.594
    2    HA   SER   1           HA       SER   1  13.294   9.919   6.733
    3   1HB   SER   1          1HB       SER   1  14.800   7.967   6.276
    4   2HB   SER   1          2HB       SER   1  15.042   8.680   7.872
    5    HG   SER   1           HG       SER   1  14.701   6.742   8.610
    6    H    TRP   2           H        TRP   2  12.883   9.308   4.572
    7    HA   TRP   2           HA       TRP   2  10.377   7.976   4.168
    8   1HB   TRP   2          1HB       TRP   2  10.596   8.554   1.850
    9   2HB   TRP   2          2HB       TRP   2  11.161   9.931   2.787
   10    HD1  TRP   2           HD1      TRP   2  14.083   9.779   3.127
   11    HE1  TRP   2           1HE      TRP   2  15.781   9.391   1.226
   12    HE3  TRP   2           3HE      TRP   2  10.949   7.683  -0.336
   13    HZ2  TRP   2           2HZ      TRP   2  15.771   8.354  -1.406
   14    HZ3  TRP   2           3HZ      TRP   2  11.870   7.034  -2.523
   15    HH2  TRP   2           HH2      TRP   2  14.235   7.362  -3.047
   16    H    MET   3           H        MET   3   9.969   6.004   3.271
   17    HA   MET   3           HA       MET   3  12.264   4.182   3.125
   18   1HB   MET   3          1HB       MET   3   9.304   3.635   3.470
   19   2HB   MET   3          2HB       MET   3  10.533   2.386   3.336
   20   1HG   MET   3          1HG       MET   3  11.576   3.149   5.383
   21   2HG   MET   3          2HG       MET   3  10.422   4.476   5.503
   22   1HE   MET   3          1HE       MET   3  10.632   0.873   4.706
   23   2HE   MET   3          2HE       MET   3   9.951   0.075   6.123
   24   3HE   MET   3          3HE       MET   3   8.912   0.485   4.757
   25    H    SER   4           H        SER   4  11.567   2.202   1.580
   26    HA   SER   4           HA       SER   4  10.605   3.375  -0.945
   27   1HB   SER   4          1HB       SER   4  12.912   1.422  -0.729
   28   2HB   SER   4          2HB       SER   4  12.308   2.189  -2.195
   29    HG   SER   4           HG       SER   4  12.879   4.079  -0.387
   30    H    THR   5           H        THR   5   9.706   1.795  -2.433
   31    HA   THR   5           HA       THR   5   8.598  -0.487  -0.967
   32    HB   THR   5           HB       THR   5   6.869  -0.377  -2.862
   33    HG1  THR   5           1HG      THR   5   7.462   2.327  -3.092
   34   1HG2  THR   5          1HG2      THR   5   6.534   2.138  -1.399
   35   2HG2  THR   5          2HG2      THR   5   5.469   0.738  -1.528
   36   3HG2  THR   5          3HG2      THR   5   6.818   0.715  -0.395
   37    H    VAL   6           H        VAL   6   7.748  -2.153  -2.600
   38    HA   VAL   6           HA       VAL   6   9.705  -2.844  -4.655
   39    HB   VAL   6           HB       VAL   6  10.426  -4.441  -3.195
   40   1HG1  VAL   6          1HG1      VAL   6   8.026  -3.704  -1.654
   41   2HG1  VAL   6          2HG1      VAL   6   8.657  -5.325  -1.372
   42   3HG1  VAL   6          3HG1      VAL   6   9.696  -3.923  -1.125
   43   1HG2  VAL   6          1HG2      VAL   6   8.804  -5.634  -4.848
   44   2HG2  VAL   6          2HG2      VAL   6   9.524  -6.525  -3.507
   45   3HG2  VAL   6          3HG2      VAL   6   7.865  -5.936  -3.385
   46    H    GLY   7           H        GLY   7   8.512  -4.489  -6.202
   47   1HA   GLY   7          1HA       GLY   7   6.561  -4.955  -7.423
   48   2HA   GLY   7          2HA       GLY   7   5.711  -4.758  -5.922
   49    H    GLY   8           H        GLY   8   3.983  -3.705  -6.866
   50   1HA   GLY   8          1HA       GLY   8   2.754  -1.911  -7.584
   51   2HA   GLY   8          2HA       GLY   8   3.931  -0.971  -6.695
   52    H    ASN   9           H        ASN   9   3.709   0.736  -8.129
   53    HA   ASN   9           HA       ASN   9   5.364   0.480 -10.501
   54   1HB   ASN   9          1HB       ASN   9   3.747   1.583 -11.975
   55   2HB   ASN   9          2HB       ASN   9   3.146   0.040 -11.413
   56   1HD2  ASN   9          1HD2      ASN   9   1.208   2.531  -9.093
   57   2HD2  ASN   9          2HD2      ASN   9   2.803   1.921  -8.841
   58    H    SER  10           H        SER  10   5.222   1.863  -7.797
   59    HA   SER  10           HA       SER  10   5.126   4.659  -8.438
   60   1HB   SER  10          1HB       SER  10   6.183   3.374  -5.920
   61   2HB   SER  10          2HB       SER  10   5.463   4.977  -6.109
   62    HG   SER  10           HG       SER  10   3.738   3.909  -5.476
   63    H    GLY  11           H        GLY  11   7.578   2.176  -8.159
   64   1HA   GLY  11          1HA       GLY  11   9.747   2.260  -8.996
   65   2HA   GLY  11          2HA       GLY  11   9.531   3.971  -9.313
   66    H    GLY  12           H        GLY  12   9.550   5.405  -7.371
   67   1HA   GLY  12          1HA       GLY  12  11.236   4.299  -5.219
   68   2HA   GLY  12          2HA       GLY  12  11.710   5.781  -6.043
   69    H    ALA  13           H        ALA  13   8.763   4.440  -4.557
   70    HA   ALA  13           HA       ALA  13   8.496   6.951  -3.050
   71   1HB   ALA  13          1HB       ALA  13   6.653   5.817  -5.005
   72   2HB   ALA  13          2HB       ALA  13   5.891   6.179  -3.455
   73   3HB   ALA  13          3HB       ALA  13   6.742   7.447  -4.340
   74    HA   PRO  14           HA       PRO  14   7.818   4.142   0.319
   75   1HB   PRO  14          1HB       PRO  14   7.212   5.920   2.229
   76   2HB   PRO  14          2HB       PRO  14   8.833   5.852   1.521
   77   1HG   PRO  14          1HG       PRO  14   6.628   7.798   1.027
   78   2HG   PRO  14          2HG       PRO  14   8.379   8.067   1.055
   79   1HD   PRO  14          1HD       PRO  14   6.788   7.738  -1.228
   80   2HD   PRO  14          2HD       PRO  14   8.554   7.647  -1.169
   81    H    CYS  15           H        CYS  15   6.097   3.738   2.086
   82    HA   CYS  15           HA       CYS  15   3.488   3.745   0.784
   83   1HB   CYS  15          1HB       CYS  15   4.190   2.687   3.544
   84   2HB   CYS  15          2HB       CYS  15   2.777   2.286   2.580
   85    H    VAL  16           H        VAL  16   1.896   5.202   1.269
   86    HA   VAL  16           HA       VAL  16   2.431   7.102   3.430
   87    HB   VAL  16           HB       VAL  16   0.390   7.211   1.190
   88   1HG1  VAL  16          1HG1      VAL  16   1.041   9.281   3.297
   89   2HG1  VAL  16          2HG1      VAL  16  -0.038   9.512   1.922
   90   3HG1  VAL  16          3HG1      VAL  16  -0.456   8.351   3.181
   91   1HG2  VAL  16          1HG2      VAL  16   3.092   7.711   1.109
   92   2HG2  VAL  16          2HG2      VAL  16   1.891   8.325  -0.026
   93   3HG2  VAL  16          3HG2      VAL  16   2.395   9.312   1.352
   94    H    PHE  17           H        PHE  17   1.672   6.451   5.346
   95    HA   PHE  17           HA       PHE  17  -0.925   5.089   5.429
   96   1HB   PHE  17          1HB       PHE  17   1.415   5.060   7.335
   97   2HB   PHE  17          2HB       PHE  17  -0.142   4.353   7.710
   98    HD1  PHE  17           1HD      PHE  17  -0.207   3.621   4.497
   99    HD2  PHE  17           2HD      PHE  17   2.207   2.730   7.874
  100    HE1  PHE  17           1HE      PHE  17   0.529   1.538   3.420
  101    HE2  PHE  17           2HE      PHE  17   2.952   0.645   6.820
  102    HZ   PHE  17           HZ       PHE  17   2.128   0.022   4.575
  103    HA   PRO  18           HA       PRO  18  -2.354   4.564   6.734
  104   1HB   PRO  18          1HB       PRO  18  -4.991   5.591   7.080
  105   2HB   PRO  18          2HB       PRO  18  -4.070   4.605   8.215
  106   1HG   PRO  18          1HG       PRO  18  -4.807   7.254   8.614
  107   2HG   PRO  18          2HG       PRO  18  -3.539   6.394   9.502
  108   1HD   PRO  18          1HD       PRO  18  -3.295   8.321   7.232
  109   2HD   PRO  18          2HD       PRO  18  -2.221   8.064   8.621
  110    H    PHE  19           H        PHE  19  -3.082   3.771   4.777
  111    HA   PHE  19           HA       PHE  19  -3.983   5.811   2.847
  112   1HB   PHE  19          1HB       PHE  19  -3.226   4.439   1.058
  113   2HB   PHE  19          2HB       PHE  19  -1.916   4.550   2.220
  114    HD1  PHE  19           1HD      PHE  19  -1.413   2.584   3.671
  115    HD2  PHE  19           2HD      PHE  19  -4.165   2.364   0.437
  116    HE1  PHE  19           1HE      PHE  19  -1.205   0.130   3.655
  117    HE2  PHE  19           2HE      PHE  19  -3.967  -0.078   0.416
  118    HZ   PHE  19           HZ       PHE  19  -2.468  -1.200   2.026
  119    H    THR  20           H        THR  20  -5.934   5.615   1.885
  120    HA   THR  20           HA       THR  20  -7.614   3.477   2.975
  121    HB   THR  20           HB       THR  20  -8.394   6.000   1.455
  122    HG1  THR  20           1HG      THR  20  -7.426   6.418   3.509
  123   1HG2  THR  20          1HG2      THR  20 -10.419   5.093   3.222
  124   2HG2  THR  20          2HG2      THR  20 -10.485   5.300   1.471
  125   3HG2  THR  20          3HG2      THR  20  -9.965   3.761   2.159
  126    H    PHE  21           H        PHE  21  -8.057   1.770   1.843
  127    HA   PHE  21           HA       PHE  21  -7.920   1.933  -1.107
  128   1HB   PHE  21          1HB       PHE  21  -6.248   0.373   0.060
  129   2HB   PHE  21          2HB       PHE  21  -7.635  -0.577   0.548
  130    HD1  PHE  21           1HD      PHE  21  -6.090   0.832  -2.527
  131    HD2  PHE  21           2HD      PHE  21  -8.394  -2.297  -0.808
  132    HE1  PHE  21           1HE      PHE  21  -5.941  -0.419  -4.620
  133    HE2  PHE  21           2HE      PHE  21  -8.246  -3.552  -2.908
  134    HZ   PHE  21           HZ       PHE  21  -7.023  -2.625  -4.824
  135    H    LEU  22           H        LEU  22  -9.619   1.314  -2.184
  136    HA   LEU  22           HA       LEU  22 -11.835   1.079  -2.563
  137   1HB   LEU  22          1HB       LEU  22 -10.436  -1.362  -1.677
  138   2HB   LEU  22          2HB       LEU  22 -12.109  -1.494  -2.185
  139    HG   LEU  22           HG       LEU  22 -10.440  -1.966  -3.967
  140   1HD1  LEU  22          1HD1      LEU  22 -12.693  -0.239  -3.974
  141   2HD1  LEU  22          2HD1      LEU  22 -11.566   0.173  -5.269
  142   3HD1  LEU  22          3HD1      LEU  22 -12.207  -1.468  -5.146
  143   1HD2  LEU  22          1HD2      LEU  22  -8.861  -0.167  -3.268
  144   2HD2  LEU  22          2HD2      LEU  22  -9.221  -0.247  -4.993
  145   3HD2  LEU  22          3HD2      LEU  22  -9.992   0.981  -3.986
  146    H    GLY  23           H        GLY  23 -11.809   2.389  -0.216
  147   1HA   GLY  23          1HA       GLY  23 -13.710   2.925   1.104
  148   2HA   GLY  23          2HA       GLY  23 -14.187   1.245   1.047
  149    H    ASN  24           H        ASN  24 -11.073   0.820   1.983
  150    HA   ASN  24           HA       ASN  24 -11.852   1.177   4.812
  151   1HB   ASN  24          1HB       ASN  24  -9.918  -0.861   3.709
  152   2HB   ASN  24          2HB       ASN  24 -10.598  -0.792   5.326
  153   1HD2  ASN  24          1HD2      ASN  24 -12.402  -2.892   2.538
  154   2HD2  ASN  24          2HD2      ASN  24 -10.767  -2.337   2.489
  155    H    LYS  25           H        LYS  25 -10.198   1.583   6.370
  156    HA   LYS  25           HA       LYS  25  -8.126   3.355   5.412
  157   1HB   LYS  25          1HB       LYS  25  -9.050   2.618   8.198
  158   2HB   LYS  25          2HB       LYS  25  -7.963   3.911   7.781
  159   1HG   LYS  25          1HG       LYS  25 -10.821   3.760   6.900
  160   2HG   LYS  25          2HG       LYS  25 -10.236   4.689   8.285
  161   1HD   LYS  25          1HD       LYS  25  -8.750   5.935   6.731
  162   2HD   LYS  25          2HD       LYS  25  -9.504   5.081   5.383
  163   1HE   LYS  25          1HE       LYS  25 -10.901   6.888   7.356
  164   2HE   LYS  25          2HE       LYS  25 -10.489   7.296   5.691
  165   1HZ   LYS  25          1HZ       LYS  25 -11.999   4.878   5.795
  166   2HZ   LYS  25          2HZ       LYS  25 -12.827   6.121   6.595
  167   3HZ   LYS  25          3HZ       LYS  25 -12.339   6.330   4.980
  168    H    TYR  26           H        TYR  26  -6.028   2.574   5.158
  169    HA   TYR  26           HA       TYR  26  -5.350   0.160   6.691
  170   1HB   TYR  26          1HB       TYR  26  -4.254   1.067   4.027
  171   2HB   TYR  26          2HB       TYR  26  -3.774  -0.382   4.901
  172    HD1  TYR  26           1HD      TYR  26  -6.673   1.272   3.298
  173    HD2  TYR  26           2HD      TYR  26  -4.955  -2.363   4.639
  174    HE1  TYR  26           1HE      TYR  26  -8.485   0.030   2.228
  175    HE2  TYR  26           2HE      TYR  26  -6.754  -3.624   3.562
  176    HH   TYR  26           HH       TYR  26  -8.484  -2.919   1.399
  177    H    GLU  27           H        GLU  27  -4.149   0.622   8.295
  178    HA   GLU  27           HA       GLU  27  -2.341   2.895   8.283
  179   1HB   GLU  27          1HB       GLU  27  -2.950   0.956  10.498
  180   2HB   GLU  27          2HB       GLU  27  -2.194   2.523  10.640
  181   1HG   GLU  27          1HG       GLU  27  -4.261   3.604   9.935
  182   2HG   GLU  27          2HG       GLU  27  -5.028   2.027   9.777
  183    H    SER  28           H        SER  28  -2.248  -0.332   7.561
  184    HA   SER  28           HA       SER  28   0.653  -0.375   7.682
  185   1HB   SER  28          1HB       SER  28   0.354  -2.860   8.295
  186   2HB   SER  28          2HB       SER  28   0.144  -1.679   9.579
  187    HG   SER  28           HG       SER  28  -1.580  -3.022   9.735
  188    H    CYS  29           H        CYS  29   0.973  -2.919   6.554
  189    HA   CYS  29           HA       CYS  29   0.251  -2.357   3.857
  190   1HB   CYS  29          1HB       CYS  29   1.445  -4.842   5.075
  191   2HB   CYS  29          2HB       CYS  29   1.261  -4.557   3.359
  192    H    THR  30           H        THR  30  -0.778  -4.056   2.496
  193    HA   THR  30           HA       THR  30  -2.877  -5.574   3.833
  194    HB   THR  30           HB       THR  30  -3.905  -3.329   3.383
  195    HG1  THR  30           1HG      THR  30  -5.364  -4.918   3.294
  196   1HG2  THR  30          1HG2      THR  30  -3.943  -3.809   0.474
  197   2HG2  THR  30          2HG2      THR  30  -3.939  -2.293   1.378
  198   3HG2  THR  30          3HG2      THR  30  -2.436  -3.191   1.146
  199    H    SER  31           H        SER  31  -4.172  -6.745   2.069
  200    HA   SER  31           HA       SER  31  -2.448  -7.469  -0.189
  201   1HB   SER  31          1HB       SER  31  -3.319  -9.838   0.120
  202   2HB   SER  31          2HB       SER  31  -2.208  -9.273   1.379
  203    HG   SER  31           HG       SER  31  -4.939  -9.839   1.518
  204    H    ALA  32           H        ALA  32  -4.751  -5.711   0.457
  205    HA   ALA  32           HA       ALA  32  -7.154  -6.621  -0.640
  206   1HB   ALA  32          1HB       ALA  32  -6.608  -4.516   0.792
  207   2HB   ALA  32          2HB       ALA  32  -6.294  -3.749  -0.767
  208   3HB   ALA  32          3HB       ALA  32  -7.889  -4.411  -0.418
  209    H    GLY  33           H        GLY  33  -8.045  -6.575  -2.595
  210   1HA   GLY  33          1HA       GLY  33  -8.255  -6.315  -4.863
  211   2HA   GLY  33          2HA       GLY  33  -6.933  -5.160  -4.798
  212    H    ARG  34           H        ARG  34  -5.758  -7.872  -3.336
  213    HA   ARG  34           HA       ARG  34  -4.555  -8.728  -5.873
  214   1HB   ARG  34          1HB       ARG  34  -3.528  -9.253  -3.088
  215   2HB   ARG  34          2HB       ARG  34  -2.698  -9.531  -4.599
  216   1HG   ARG  34          1HG       ARG  34  -3.175  -6.911  -4.860
  217   2HG   ARG  34          2HG       ARG  34  -3.080  -7.030  -3.101
  218   1HD   ARG  34          1HD       ARG  34  -0.880  -6.551  -4.140
  219   2HD   ARG  34          2HD       ARG  34  -0.891  -8.078  -3.245
  220    HE   ARG  34           HE       ARG  34  -0.537  -9.202  -5.209
  221   1HH1  ARG  34          1HH1      ARG  34  -1.533  -5.922  -5.958
  222   2HH1  ARG  34          2HH1      ARG  34  -1.310  -6.100  -7.670
  223   1HH2  ARG  34          1HH2      ARG  34  -0.179  -9.425  -7.451
  224   2HH2  ARG  34          2HH2      ARG  34  -0.498  -8.088  -8.513
  225    H    SER  35           H        SER  35  -4.472 -10.817  -6.487
  226    HA   SER  35           HA       SER  35  -6.188 -12.684  -4.992
  227   1HB   SER  35          1HB       SER  35  -5.449 -12.754  -7.932
  228   2HB   SER  35          2HB       SER  35  -6.607 -13.801  -7.113
  229    HG   SER  35           HG       SER  35  -8.050 -12.231  -7.094
  230    H    ASP  36           H        ASP  36  -3.004 -11.999  -5.469
  231    HA   ASP  36           HA       ASP  36  -2.149 -14.758  -5.741
  232   1HB   ASP  36          1HB       ASP  36   0.186 -13.582  -5.467
  233   2HB   ASP  36          2HB       ASP  36  -0.668 -13.557  -6.997
  234    H    GLY  37           H        GLY  37  -0.633 -12.381  -3.743
  235   1HA   GLY  37          1HA       GLY  37  -1.458 -13.119  -1.237
  236   2HA   GLY  37          2HA       GLY  37  -0.176 -14.244  -1.640
  237    H    LYS  38           H        LYS  38   0.764 -11.640  -3.306
  238    HA   LYS  38           HA       LYS  38   2.734 -10.901  -1.367
  239   1HB   LYS  38          1HB       LYS  38   2.154  -9.190  -3.744
  240   2HB   LYS  38          2HB       LYS  38   3.702  -9.656  -3.057
  241   1HG   LYS  38          1HG       LYS  38   1.895 -11.504  -4.572
  242   2HG   LYS  38          2HG       LYS  38   3.229 -10.623  -5.276
  243   1HD   LYS  38          1HD       LYS  38   4.764 -11.723  -3.667
  244   2HD   LYS  38          2HD       LYS  38   3.398 -12.679  -3.081
  245   1HE   LYS  38          1HE       LYS  38   3.124 -13.709  -5.243
  246   2HE   LYS  38          2HE       LYS  38   4.356 -12.664  -5.944
  247   1HZ   LYS  38          1HZ       LYS  38   5.295 -14.170  -3.670
  248   2HZ   LYS  38          2HZ       LYS  38   4.778 -15.153  -4.956
  249   3HZ   LYS  38          3HZ       LYS  38   5.985 -13.983  -5.212
  250    H    MET  39           H        MET  39   2.252  -9.564   0.334
  251    HA   MET  39           HA       MET  39  -0.017  -7.831   0.203
  252   1HB   MET  39          1HB       MET  39   2.190  -7.811   2.276
  253   2HB   MET  39          2HB       MET  39   0.588  -7.115   2.421
  254   1HG   MET  39          1HG       MET  39   0.439  -9.055   3.664
  255   2HG   MET  39          2HG       MET  39  -0.283  -9.492   2.116
  256   1HE   MET  39          1HE       MET  39   0.235 -11.511   3.985
  257   2HE   MET  39          2HE       MET  39   0.309 -12.438   2.485
  258   3HE   MET  39          3HE       MET  39   1.588 -12.605   3.685
  259    H    TRP  40           H        TRP  40   0.018  -5.537   0.218
  260    HA   TRP  40           HA       TRP  40   2.547  -4.295  -0.641
  261   1HB   TRP  40          1HB       TRP  40   1.298  -3.058  -2.394
  262   2HB   TRP  40          2HB       TRP  40   1.323  -4.795  -2.686
  263    HD1  TRP  40           HD1      TRP  40  -1.079  -6.084  -1.743
  264    HE1  TRP  40           1HE      TRP  40  -3.493  -5.225  -1.976
  265    HE3  TRP  40           3HE      TRP  40  -0.113  -1.150  -2.614
  266    HZ2  TRP  40           2HZ      TRP  40  -4.803  -2.780  -2.425
  267    HZ3  TRP  40           3HZ      TRP  40  -2.004   0.387  -2.903
  268    HH2  TRP  40           HH2      TRP  40  -4.298  -0.415  -2.816
  269    H    CYS  41           H        CYS  41   1.523  -1.787  -1.197
  270    HA   CYS  41           HA       CYS  41  -0.084  -0.765   0.970
  271   1HB   CYS  41          1HB       CYS  41   1.630   0.643   1.952
  272   2HB   CYS  41          2HB       CYS  41   2.222  -1.017   1.990
  273    H    ALA  42           H        ALA  42  -0.623   1.516   0.550
  274    HA   ALA  42           HA       ALA  42  -0.253   2.172  -2.272
  275   1HB   ALA  42          1HB       ALA  42  -2.496   2.368  -1.035
  276   2HB   ALA  42          2HB       ALA  42  -1.818   3.839  -0.333
  277   3HB   ALA  42          3HB       ALA  42  -2.003   3.703  -2.080
  278    H    THR  43           H        THR  43   0.767   4.033  -2.989
  279    HA   THR  43           HA       THR  43   2.596   5.182  -1.019
  280    HB   THR  43           HB       THR  43   3.970   5.812  -2.945
  281    HG1  THR  43           1HG      THR  43   2.792   6.155  -4.681
  282   1HG2  THR  43          1HG2      THR  43   3.006   2.985  -3.281
  283   2HG2  THR  43          2HG2      THR  43   4.603   3.630  -3.665
  284   3HG2  THR  43          3HG2      THR  43   4.080   3.506  -1.984
  285    H    THR  44           H        THR  44  -0.292   5.820  -1.749
  286    HA   THR  44           HA       THR  44   0.017   8.723  -1.646
  287    HB   THR  44           HB       THR  44  -2.031   8.929  -3.105
  288    HG1  THR  44           1HG      THR  44  -3.018   7.124  -3.493
  289   1HG2  THR  44          1HG2      THR  44   0.205   7.552  -4.559
  290   2HG2  THR  44          2HG2      THR  44  -0.944   8.730  -5.198
  291   3HG2  THR  44          3HG2      THR  44   0.270   9.231  -4.022
  292    H    ALA  45           H        ALA  45  -1.608   9.741  -0.380
  293    HA   ALA  45           HA       ALA  45  -2.537   8.366   1.835
  294   1HB   ALA  45          1HB       ALA  45  -3.027  11.007   0.657
  295   2HB   ALA  45          2HB       ALA  45  -4.325  10.414   1.692
  296   3HB   ALA  45          3HB       ALA  45  -2.685  10.546   2.324
  297    H    ASN  46           H        ASN  46  -4.357   9.219  -1.085
  298    HA   ASN  46           HA       ASN  46  -6.345   7.207  -0.314
  299   1HB   ASN  46          1HB       ASN  46  -7.286   9.512  -0.453
  300   2HB   ASN  46          2HB       ASN  46  -6.771   9.593  -2.140
  301   1HD2  ASN  46          1HD2      ASN  46 -10.255   7.978  -1.194
  302   2HD2  ASN  46          2HD2      ASN  46  -9.279   8.892  -0.107
  303    H    TYR  47           H        TYR  47  -5.987   5.419  -1.378
  304    HA   TYR  47           HA       TYR  47  -4.417   5.313  -3.751
  305   1HB   TYR  47          1HB       TYR  47  -4.470   3.493  -2.056
  306   2HB   TYR  47          2HB       TYR  47  -6.110   3.116  -2.567
  307    HD1  TYR  47           1HD      TYR  47  -2.576   3.028  -3.509
  308    HD2  TYR  47           2HD      TYR  47  -6.527   1.989  -4.672
  309    HE1  TYR  47           1HE      TYR  47  -1.673   1.549  -5.240
  310    HE2  TYR  47           2HE      TYR  47  -5.628   0.502  -6.410
  311    HH   TYR  47           HH       TYR  47  -3.070  -0.783  -6.581
  312    H    ASP  48           H        ASP  48  -7.894   4.996  -3.110
  313    HA   ASP  48           HA       ASP  48  -8.802   4.051  -5.507
  314   1HB   ASP  48          1HB       ASP  48  -9.995   6.058  -3.624
  315   2HB   ASP  48          2HB       ASP  48 -10.835   5.590  -5.094
  316    H    ASP  49           H        ASP  49  -7.753   7.337  -4.829
  317    HA   ASP  49           HA       ASP  49  -8.648   8.345  -7.360
  318   1HB   ASP  49          1HB       ASP  49  -7.078   9.493  -5.080
  319   2HB   ASP  49          2HB       ASP  49  -7.175  10.353  -6.610
  320    H    ASP  50           H        ASP  50  -5.363   8.356  -5.992
  321    HA   ASP  50           HA       ASP  50  -4.170   8.670  -8.566
  322   1HB   ASP  50          1HB       ASP  50  -3.043   8.267  -5.807
  323   2HB   ASP  50          2HB       ASP  50  -2.015   8.356  -7.230
  324    H    ARG  51           H        ARG  51  -4.886   5.879  -6.646
  325    HA   ARG  51           HA       ARG  51  -4.296   3.718  -6.756
  326   1HB   ARG  51          1HB       ARG  51  -4.492   4.318  -9.678
  327   2HB   ARG  51          2HB       ARG  51  -4.666   2.731  -8.927
  328   1HG   ARG  51          1HG       ARG  51  -6.435   4.070  -7.476
  329   2HG   ARG  51          2HG       ARG  51  -6.519   5.033  -8.955
  330   1HD   ARG  51          1HD       ARG  51  -6.718   2.048  -8.891
  331   2HD   ARG  51          2HD       ARG  51  -8.117   3.120  -8.762
  332    HE   ARG  51           HE       ARG  51  -6.655   3.899 -11.014
  333   1HH1  ARG  51          1HH1      ARG  51  -8.529   1.152  -9.947
  334   2HH1  ARG  51          2HH1      ARG  51  -9.050   0.732 -11.543
  335   1HH2  ARG  51          1HH2      ARG  51  -7.306   3.347 -13.097
  336   2HH2  ARG  51          2HH2      ARG  51  -8.338   1.973 -13.352
  337    H    LYS  52           H        LYS  52  -2.070   4.941  -6.137
  338    HA   LYS  52           HA       LYS  52  -0.046   3.681  -7.841
  339   1HB   LYS  52          1HB       LYS  52   0.212   6.094  -6.016
  340   2HB   LYS  52          2HB       LYS  52   1.566   5.323  -6.841
  341   1HG   LYS  52          1HG       LYS  52   0.860   6.020  -8.935
  342   2HG   LYS  52          2HG       LYS  52  -0.798   6.289  -8.398
  343   1HD   LYS  52          1HD       LYS  52   0.014   8.195  -7.035
  344   2HD   LYS  52          2HD       LYS  52   1.626   7.950  -7.716
  345   1HE   LYS  52          1HE       LYS  52   0.868   8.472  -9.913
  346   2HE   LYS  52          2HE       LYS  52  -0.821   8.429  -9.409
  347   1HZ   LYS  52          1HZ       LYS  52  -0.422  10.387  -8.034
  348   2HZ   LYS  52          2HZ       LYS  52   1.200  10.437  -8.540
  349   3HZ   LYS  52          3HZ       LYS  52  -0.052  10.696  -9.661
  350    H    TRP  53           H        TRP  53   0.710   1.890  -7.013
  351    HA   TRP  53           HA       TRP  53   0.719   1.593  -4.091
  352   1HB   TRP  53          1HB       TRP  53  -0.006  -0.693  -4.409
  353   2HB   TRP  53          2HB       TRP  53  -1.118   0.389  -5.154
  354    HD1  TRP  53           HD1      TRP  53  -0.651   0.674  -8.010
  355    HE1  TRP  53           1HE      TRP  53  -0.096  -1.252  -9.636
  356    HE3  TRP  53           3HE      TRP  53   0.910  -2.672  -4.610
  357    HZ2  TRP  53           2HZ      TRP  53   0.889  -3.924  -9.440
  358    HZ3  TRP  53           3HZ      TRP  53   1.659  -4.930  -5.357
  359    HH2  TRP  53           HH2      TRP  53   1.644  -5.529  -7.732
  360    H    GLY  54           H        GLY  54   1.942  -0.270  -3.347
  361   1HA   GLY  54          1HA       GLY  54   4.209  -1.183  -4.885
  362   2HA   GLY  54          2HA       GLY  54   4.635  -0.077  -3.581
  363    H    PHE  55           H        PHE  55   4.929  -3.073  -4.118
  364    HA   PHE  55           HA       PHE  55   3.455  -4.563  -2.289
  365   1HB   PHE  55          1HB       PHE  55   6.090  -4.882  -3.664
  366   2HB   PHE  55          2HB       PHE  55   5.669  -5.996  -2.375
  367    HD1  PHE  55           1HD      PHE  55   2.592  -5.654  -3.240
  368    HD2  PHE  55           2HD      PHE  55   6.193  -6.824  -5.185
  369    HE1  PHE  55           1HE      PHE  55   1.293  -7.075  -4.785
  370    HE2  PHE  55           2HE      PHE  55   4.899  -8.252  -6.724
  371    HZ   PHE  55           HZ       PHE  55   2.452  -8.360  -6.532
  372    H    CYS  56           H        CYS  56   4.148  -5.529  -0.327
  373    HA   CYS  56           HA       CYS  56   5.402  -3.616   1.474
  374   1HB   CYS  56          1HB       CYS  56   3.185  -4.875   1.912
  375   2HB   CYS  56          2HB       CYS  56   4.188  -6.291   2.179
  376    HA   PRO  57           HA       PRO  57   9.309  -5.771   1.695
  377   1HB   PRO  57          1HB       PRO  57  10.055  -5.281   4.213
  378   2HB   PRO  57          2HB       PRO  57  10.049  -4.021   2.970
  379   1HG   PRO  57          1HG       PRO  57   7.921  -4.701   4.946
  380   2HG   PRO  57          2HG       PRO  57   8.661  -3.113   4.652
  381   1HD   PRO  57          1HD       PRO  57   6.324  -3.703   3.560
  382   2HD   PRO  57          2HD       PRO  57   7.569  -2.895   2.576
  383    H    ASP  58           H        ASP  58   9.408  -6.400   4.809
  384    HA   ASP  58           HA       ASP  58   9.453  -9.185   4.608
  385   1HB   ASP  58          1HB       ASP  58  10.544  -8.020   6.454
  386   2HB   ASP  58          2HB       ASP  58   8.979  -7.492   7.067
  387    H    GLN  59           H        GLN  59   7.754 -10.270   3.866
  388    HA   GLN  59           HA       GLN  59   5.073  -9.648   4.847
  389   1HB   GLN  59          1HB       GLN  59   6.029 -11.445   2.616
  390   2HB   GLN  59          2HB       GLN  59   4.343 -11.204   3.035
  391   1HG   GLN  59          1HG       GLN  59   4.443  -8.917   2.392
  392   2HG   GLN  59          2HG       GLN  59   6.195  -8.995   2.204
  393   1HE2  GLN  59          1HE2      GLN  59   5.880  -9.665  -1.159
  394   2HE2  GLN  59          2HE2      GLN  59   6.663  -8.822   0.132
  395    H    GLY  60           H        GLY  60   7.622 -11.678   5.536
  396   1HA   GLY  60          1HA       GLY  60   7.191 -13.012   7.606
  397   2HA   GLY  60          2HA       GLY  60   5.807 -13.667   6.741
  Start of MODEL   35
    1    H    SER   1           1H       SER   1  16.604  -0.524   2.185
    2    HA   SER   1           HA       SER   1  18.468   1.094   2.463
    3   1HB   SER   1          1HB       SER   1  19.193   1.860   0.070
    4   2HB   SER   1          2HB       SER   1  20.002   0.482   0.815
    5    HG   SER   1           HG       SER   1  19.301   0.180  -1.414
    6    H    TRP   2           H        TRP   2  17.160   2.700   2.990
    7    HA   TRP   2           HA       TRP   2  15.685   4.409   2.864
    8   1HB   TRP   2          1HB       TRP   2  16.555   5.090   0.746
    9   2HB   TRP   2          2HB       TRP   2  15.743   3.770  -0.087
   10    HD1  TRP   2           HD1      TRP   2  13.406   4.276  -1.070
   11    HE1  TRP   2           1HE      TRP   2  11.793   6.281  -0.994
   12    HE3  TRP   2           3HE      TRP   2  15.783   7.073   2.474
   13    HZ2  TRP   2           2HZ      TRP   2  11.564   8.730   0.392
   14    HZ3  TRP   2           3HZ      TRP   2  14.799   9.234   3.136
   15    HH2  TRP   2           HH2      TRP   2  12.731  10.039   2.114
   16    H    MET   3           H        MET   3  13.461   4.723   3.026
   17    HA   MET   3           HA       MET   3  11.960   2.317   3.380
   18   1HB   MET   3          1HB       MET   3  10.167   3.827   4.178
   19   2HB   MET   3          2HB       MET   3  11.696   4.099   4.986
   20   1HG   MET   3          1HG       MET   3  12.076   6.092   3.656
   21   2HG   MET   3          2HG       MET   3  10.610   5.777   2.733
   22   1HE   MET   3          1HE       MET   3  10.540   8.191   3.163
   23   2HE   MET   3          2HE       MET   3   9.204   8.699   4.200
   24   3HE   MET   3          3HE       MET   3  10.870   8.879   4.753
   25    H    SER   4           H        SER   4  12.374   2.021   0.868
   26    HA   SER   4           HA       SER   4  10.289   3.278  -0.719
   27   1HB   SER   4          1HB       SER   4  11.641   1.441  -2.297
   28   2HB   SER   4          2HB       SER   4  11.990   3.169  -2.205
   29    HG   SER   4           HG       SER   4  13.877   2.041  -1.765
   30    H    THR   5           H        THR   5   9.319   1.658  -2.402
   31    HA   THR   5           HA       THR   5   8.194  -0.581  -0.879
   32    HB   THR   5           HB       THR   5   6.413  -0.319  -2.806
   33    HG1  THR   5           1HG      THR   5   7.128   2.380  -2.623
   34   1HG2  THR   5          1HG2      THR   5   5.856   1.951  -1.221
   35   2HG2  THR   5          2HG2      THR   5   5.141   0.341  -1.142
   36   3HG2  THR   5          3HG2      THR   5   6.577   0.715  -0.187
   37    H    VAL   6           H        VAL   6   7.282  -2.299  -2.369
   38    HA   VAL   6           HA       VAL   6   9.223  -3.011  -4.490
   39    HB   VAL   6           HB       VAL   6   7.596  -5.225  -3.575
   40   1HG1  VAL   6          1HG1      VAL   6   9.969  -4.938  -4.794
   41   2HG1  VAL   6          2HG1      VAL   6  10.505  -5.286  -3.150
   42   3HG1  VAL   6          3HG1      VAL   6   9.446  -6.419  -3.988
   43   1HG2  VAL   6          1HG2      VAL   6   8.168  -3.612  -1.454
   44   2HG2  VAL   6          2HG2      VAL   6   7.882  -5.349  -1.366
   45   3HG2  VAL   6          3HG2      VAL   6   9.532  -4.736  -1.442
   46    H    GLY   7           H        GLY   7   7.736  -5.009  -5.646
   47   1HA   GLY   7          1HA       GLY   7   6.168  -5.142  -7.381
   48   2HA   GLY   7          2HA       GLY   7   5.091  -4.881  -6.039
   49    H    GLY   8           H        GLY   8   3.608  -3.543  -6.544
   50   1HA   GLY   8          1HA       GLY   8   2.466  -1.854  -7.629
   51   2HA   GLY   8          2HA       GLY   8   3.565  -0.939  -6.632
   52    H    ASN   9           H        ASN   9   3.793   0.797  -7.832
   53    HA   ASN   9           HA       ASN   9   5.481   0.637 -10.166
   54   1HB   ASN   9          1HB       ASN   9   4.015   2.050 -11.579
   55   2HB   ASN   9          2HB       ASN   9   3.350   0.454 -11.306
   56   1HD2  ASN   9          1HD2      ASN   9   1.283   2.604  -8.776
   57   2HD2  ASN   9          2HD2      ASN   9   2.843   1.911  -8.511
   58    H    SER  10           H        SER  10   5.524   1.633  -7.432
   59    HA   SER  10           HA       SER  10   5.512   4.515  -7.602
   60   1HB   SER  10          1HB       SER  10   6.578   3.959  -5.199
   61   2HB   SER  10          2HB       SER  10   4.845   3.942  -5.490
   62    HG   SER  10           HG       SER  10   6.165   1.982  -4.537
   63    H    GLY  11           H        GLY  11   7.853   1.887  -7.559
   64   1HA   GLY  11          1HA       GLY  11  10.067   1.987  -8.322
   65   2HA   GLY  11          2HA       GLY  11   9.933   3.740  -8.396
   66    H    GLY  12           H        GLY  12   9.894   4.896  -6.293
   67   1HA   GLY  12          1HA       GLY  12  11.268   3.407  -4.161
   68   2HA   GLY  12          2HA       GLY  12  11.975   4.901  -4.759
   69    H    ALA  13           H        ALA  13   8.532   4.790  -4.689
   70    HA   ALA  13           HA       ALA  13   8.500   6.852  -2.663
   71   1HB   ALA  13          1HB       ALA  13   6.745   5.939  -4.750
   72   2HB   ALA  13          2HB       ALA  13   5.869   6.123  -3.232
   73   3HB   ALA  13          3HB       ALA  13   6.773   7.484  -3.900
   74    HA   PRO  14           HA       PRO  14   7.525   4.078   0.641
   75   1HB   PRO  14          1HB       PRO  14   6.963   5.942   2.535
   76   2HB   PRO  14          2HB       PRO  14   8.604   5.586   1.987
   77   1HG   PRO  14          1HG       PRO  14   6.895   7.926   1.421
   78   2HG   PRO  14          2HG       PRO  14   8.655   7.792   1.401
   79   1HD   PRO  14          1HD       PRO  14   6.901   7.775  -0.827
   80   2HD   PRO  14          2HD       PRO  14   8.648   7.486  -0.835
   81    H    CYS  15           H        CYS  15   5.723   3.578   2.156
   82    HA   CYS  15           HA       CYS  15   3.193   3.924   0.813
   83   1HB   CYS  15          1HB       CYS  15   3.411   2.728   3.556
   84   2HB   CYS  15          2HB       CYS  15   2.353   2.274   2.230
   85    H    VAL  16           H        VAL  16   1.503   5.234   1.453
   86    HA   VAL  16           HA       VAL  16   2.067   7.130   3.618
   87    HB   VAL  16           HB       VAL  16  -0.095   7.215   1.500
   88   1HG1  VAL  16          1HG1      VAL  16   0.687   9.209   3.623
   89   2HG1  VAL  16          2HG1      VAL  16  -0.340   9.594   2.243
   90   3HG1  VAL  16          3HG1      VAL  16  -0.870   8.403   3.432
   91   1HG2  VAL  16          1HG2      VAL  16   2.684   8.098   1.565
   92   2HG2  VAL  16          2HG2      VAL  16   1.597   7.875   0.193
   93   3HG2  VAL  16          3HG2      VAL  16   1.549   9.374   1.122
   94    H    PHE  17           H        PHE  17   1.409   6.391   5.553
   95    HA   PHE  17           HA       PHE  17  -1.189   5.039   5.685
   96   1HB   PHE  17          1HB       PHE  17   1.214   4.886   7.495
   97   2HB   PHE  17          2HB       PHE  17  -0.351   4.192   7.888
   98    HD1  PHE  17           1HD      PHE  17  -1.297   2.817   5.636
   99    HD2  PHE  17           2HD      PHE  17   2.726   3.312   6.908
  100    HE1  PHE  17           1HE      PHE  17  -0.659   0.749   4.468
  101    HE2  PHE  17           2HE      PHE  17   3.377   1.262   5.743
  102    HZ   PHE  17           HZ       PHE  17   1.678  -0.050   4.494
  103    HA   PRO  18           HA       PRO  18  -2.612   4.544   6.814
  104   1HB   PRO  18          1HB       PRO  18  -5.186   5.438   7.456
  105   2HB   PRO  18          2HB       PRO  18  -4.122   4.493   8.494
  106   1HG   PRO  18          1HG       PRO  18  -4.971   7.155   8.916
  107   2HG   PRO  18          2HG       PRO  18  -3.729   6.281   9.824
  108   1HD   PRO  18          1HD       PRO  18  -3.427   8.259   7.619
  109   2HD   PRO  18          2HD       PRO  18  -2.344   7.912   8.986
  110    H    PHE  19           H        PHE  19  -3.318   4.019   4.805
  111    HA   PHE  19           HA       PHE  19  -4.393   6.237   3.209
  112   1HB   PHE  19          1HB       PHE  19  -3.899   4.976   1.210
  113   2HB   PHE  19          2HB       PHE  19  -2.464   5.077   2.208
  114    HD1  PHE  19           1HD      PHE  19  -1.756   3.035   3.520
  115    HD2  PHE  19           2HD      PHE  19  -4.760   2.924   0.508
  116    HE1  PHE  19           1HE      PHE  19  -1.453   0.602   3.304
  117    HE2  PHE  19           2HE      PHE  19  -4.461   0.496   0.291
  118    HZ   PHE  19           HZ       PHE  19  -2.808  -0.667   1.690
  119    H    THR  20           H        THR  20  -5.863   4.831   1.324
  120    HA   THR  20           HA       THR  20  -7.785   3.289   2.874
  121    HB   THR  20           HB       THR  20  -8.502   5.871   1.457
  122    HG1  THR  20           1HG      THR  20  -7.741   5.398   3.945
  123   1HG2  THR  20          1HG2      THR  20 -10.670   5.122   2.975
  124   2HG2  THR  20          2HG2      THR  20 -10.544   5.052   1.217
  125   3HG2  THR  20          3HG2      THR  20 -10.172   3.626   2.185
  126    H    PHE  21           H        PHE  21  -8.553   1.683   1.787
  127    HA   PHE  21           HA       PHE  21  -8.658   1.831  -1.155
  128   1HB   PHE  21          1HB       PHE  21  -6.727   0.405  -0.111
  129   2HB   PHE  21          2HB       PHE  21  -8.011  -0.706   0.316
  130    HD1  PHE  21           1HD      PHE  21  -8.678   1.003  -2.781
  131    HD2  PHE  21           2HD      PHE  21  -6.619  -2.278  -1.030
  132    HE1  PHE  21           1HE      PHE  21  -8.512  -0.083  -4.966
  133    HE2  PHE  21           2HE      PHE  21  -6.446  -3.359  -3.209
  134    HZ   PHE  21           HZ       PHE  21  -7.385  -2.256  -5.210
  135    H    LEU  22           H        LEU  22 -10.448   0.774  -2.013
  136    HA   LEU  22           HA       LEU  22 -12.657   0.415  -2.099
  137   1HB   LEU  22          1HB       LEU  22 -11.499  -1.761  -0.464
  138   2HB   LEU  22          2HB       LEU  22 -13.048  -1.896  -1.280
  139    HG   LEU  22           HG       LEU  22 -11.859  -2.741  -2.985
  140   1HD1  LEU  22          1HD1      LEU  22 -11.706  -0.021  -3.341
  141   2HD1  LEU  22          2HD1      LEU  22 -10.146  -0.694  -3.798
  142   3HD1  LEU  22          3HD1      LEU  22 -11.621  -1.293  -4.561
  143   1HD2  LEU  22          1HD2      LEU  22  -9.842  -2.393  -1.096
  144   2HD2  LEU  22          2HD2      LEU  22 -10.016  -3.625  -2.342
  145   3HD2  LEU  22          3HD2      LEU  22  -9.211  -2.104  -2.721
  146    H    GLY  23           H        GLY  23 -12.137   2.265   0.013
  147   1HA   GLY  23          1HA       GLY  23 -13.709   3.295   1.412
  148   2HA   GLY  23          2HA       GLY  23 -14.542   1.762   1.575
  149    H    ASN  24           H        ASN  24 -11.558   0.713   2.261
  150    HA   ASN  24           HA       ASN  24 -11.934   1.345   5.105
  151   1HB   ASN  24          1HB       ASN  24 -10.519  -0.962   3.764
  152   2HB   ASN  24          2HB       ASN  24 -10.625  -0.719   5.507
  153   1HD2  ASN  24          1HD2      ASN  24 -13.567  -2.493   3.513
  154   2HD2  ASN  24          2HD2      ASN  24 -12.031  -2.106   2.837
  155    H    LYS  25           H        LYS  25 -10.361   2.280   6.303
  156    HA   LYS  25           HA       LYS  25  -8.137   3.459   4.955
  157   1HB   LYS  25          1HB       LYS  25  -8.900   3.382   7.879
  158   2HB   LYS  25          2HB       LYS  25  -7.748   4.454   7.131
  159   1HG   LYS  25          1HG       LYS  25  -9.409   5.620   5.937
  160   2HG   LYS  25          2HG       LYS  25 -10.624   4.399   6.324
  161   1HD   LYS  25          1HD       LYS  25 -10.451   5.007   8.699
  162   2HD   LYS  25          2HD       LYS  25  -9.283   6.264   8.278
  163   1HE   LYS  25          1HE       LYS  25 -10.955   7.405   6.938
  164   2HE   LYS  25          2HE       LYS  25 -12.123   6.117   7.252
  165   1HZ   LYS  25          1HZ       LYS  25 -11.639   6.731   9.719
  166   2HZ   LYS  25          2HZ       LYS  25 -11.124   8.214   9.066
  167   3HZ   LYS  25          3HZ       LYS  25 -12.717   7.676   8.808
  168    H    TYR  26           H        TYR  26  -6.121   2.541   4.820
  169    HA   TYR  26           HA       TYR  26  -5.645   0.227   6.550
  170   1HB   TYR  26          1HB       TYR  26  -4.410   0.920   3.888
  171   2HB   TYR  26          2HB       TYR  26  -4.032  -0.500   4.856
  172    HD1  TYR  26           1HD      TYR  26  -7.035  -0.862   5.741
  173    HD2  TYR  26           2HD      TYR  26  -5.117  -0.391   1.981
  174    HE1  TYR  26           1HE      TYR  26  -8.838  -2.116   4.667
  175    HE2  TYR  26           2HE      TYR  26  -6.912  -1.644   0.909
  176    HH   TYR  26           HH       TYR  26  -8.858  -3.621   2.272
  177    H    GLU  27           H        GLU  27  -4.452   0.566   8.139
  178    HA   GLU  27           HA       GLU  27  -2.553   2.752   8.243
  179   1HB   GLU  27          1HB       GLU  27  -3.578   0.809  10.292
  180   2HB   GLU  27          2HB       GLU  27  -2.399   2.048  10.635
  181   1HG   GLU  27          1HG       GLU  27  -3.964   3.783  10.086
  182   2HG   GLU  27          2HG       GLU  27  -5.151   2.581   9.578
  183    H    SER  28           H        SER  28  -2.645  -0.606   7.761
  184    HA   SER  28           HA       SER  28   0.282  -0.754   7.877
  185   1HB   SER  28          1HB       SER  28  -0.142  -3.233   8.360
  186   2HB   SER  28          2HB       SER  28  -0.442  -2.117   9.690
  187    HG   SER  28           HG       SER  28  -2.126  -3.845   8.532
  188    H    CYS  29           H        CYS  29   0.745  -3.055   6.528
  189    HA   CYS  29           HA       CYS  29  -0.018  -2.350   3.890
  190   1HB   CYS  29          1HB       CYS  29   1.229  -4.914   4.881
  191   2HB   CYS  29          2HB       CYS  29   1.084  -4.438   3.205
  192    H    THR  30           H        THR  30  -1.101  -3.853   2.416
  193    HA   THR  30           HA       THR  30  -3.188  -5.449   3.719
  194    HB   THR  30           HB       THR  30  -4.162  -3.205   3.258
  195    HG1  THR  30           1HG      THR  30  -5.639  -4.820   3.081
  196   1HG2  THR  30          1HG2      THR  30  -4.540  -3.150   0.530
  197   2HG2  THR  30          2HG2      THR  30  -3.438  -2.116   1.440
  198   3HG2  THR  30          3HG2      THR  30  -2.842  -3.597   0.690
  199    H    SER  31           H        SER  31  -4.454  -6.656   1.993
  200    HA   SER  31           HA       SER  31  -2.734  -7.392  -0.269
  201   1HB   SER  31          1HB       SER  31  -3.611  -9.757   0.053
  202   2HB   SER  31          2HB       SER  31  -2.486  -9.189   1.297
  203    HG   SER  31           HG       SER  31  -4.822 -10.206   1.725
  204    H    ALA  32           H        ALA  32  -5.005  -5.587   0.283
  205    HA   ALA  32           HA       ALA  32  -7.397  -6.564  -0.845
  206   1HB   ALA  32          1HB       ALA  32  -6.343  -3.993   0.080
  207   2HB   ALA  32          2HB       ALA  32  -7.424  -3.835  -1.305
  208   3HB   ALA  32          3HB       ALA  32  -7.985  -4.631   0.164
  209    H    GLY  33           H        GLY  33  -8.209  -6.512  -2.859
  210   1HA   GLY  33          1HA       GLY  33  -8.293  -6.196  -5.144
  211   2HA   GLY  33          2HA       GLY  33  -6.916  -5.110  -5.007
  212    H    ARG  34           H        ARG  34  -5.923  -7.788  -3.455
  213    HA   ARG  34           HA       ARG  34  -4.717  -8.865  -5.904
  214   1HB   ARG  34          1HB       ARG  34  -3.691  -9.142  -3.082
  215   2HB   ARG  34          2HB       ARG  34  -2.860  -9.550  -4.566
  216   1HG   ARG  34          1HG       ARG  34  -3.287  -6.953  -5.039
  217   2HG   ARG  34          2HG       ARG  34  -3.245  -6.929  -3.278
  218   1HD   ARG  34          1HD       ARG  34  -1.049  -6.534  -4.329
  219   2HD   ARG  34          2HD       ARG  34  -1.071  -7.932  -3.248
  220    HE   ARG  34           HE       ARG  34  -0.623  -9.276  -5.039
  221   1HH1  ARG  34          1HH1      ARG  34  -1.704  -6.164  -6.250
  222   2HH1  ARG  34          2HH1      ARG  34  -1.341  -6.545  -7.906
  223   1HH2  ARG  34          1HH2      ARG  34  -0.171  -9.779  -7.191
  224   2HH2  ARG  34          2HH2      ARG  34  -0.426  -8.596  -8.436
  225    H    SER  35           H        SER  35  -4.918 -10.948  -6.402
  226    HA   SER  35           HA       SER  35  -6.610 -12.576  -4.644
  227   1HB   SER  35          1HB       SER  35  -7.316 -12.130  -7.034
  228   2HB   SER  35          2HB       SER  35  -5.927 -13.088  -7.547
  229    HG   SER  35           HG       SER  35  -6.831 -14.847  -6.322
  230    H    ASP  36           H        ASP  36  -3.422 -12.106  -5.154
  231    HA   ASP  36           HA       ASP  36  -2.668 -14.913  -5.139
  232   1HB   ASP  36          1HB       ASP  36  -0.296 -13.784  -5.002
  233   2HB   ASP  36          2HB       ASP  36  -1.161 -13.894  -6.521
  234    H    GLY  37           H        GLY  37  -1.137 -12.327  -3.410
  235   1HA   GLY  37          1HA       GLY  37  -1.956 -12.767  -0.840
  236   2HA   GLY  37          2HA       GLY  37  -0.688 -13.956  -1.102
  237    H    LYS  38           H        LYS  38   0.343 -11.720  -3.076
  238    HA   LYS  38           HA       LYS  38   2.409 -10.746  -1.452
  239   1HB   LYS  38          1HB       LYS  38   1.351  -9.652  -4.071
  240   2HB   LYS  38          2HB       LYS  38   2.917  -9.288  -3.368
  241   1HG   LYS  38          1HG       LYS  38   3.706 -11.440  -3.717
  242   2HG   LYS  38          2HG       LYS  38   2.104 -12.088  -4.023
  243   1HD   LYS  38          1HD       LYS  38   1.990 -10.887  -6.124
  244   2HD   LYS  38          2HD       LYS  38   3.539 -10.105  -5.791
  245   1HE   LYS  38          1HE       LYS  38   4.564 -12.403  -5.716
  246   2HE   LYS  38          2HE       LYS  38   3.029 -13.034  -6.305
  247   1HZ   LYS  38          1HZ       LYS  38   4.660 -10.993  -7.721
  248   2HZ   LYS  38          2HZ       LYS  38   4.698 -12.656  -8.071
  249   3HZ   LYS  38          3HZ       LYS  38   3.265 -11.764  -8.314
  250    H    MET  39           H        MET  39   1.770  -9.604   0.351
  251    HA   MET  39           HA       MET  39  -0.302  -7.673   0.259
  252   1HB   MET  39          1HB       MET  39   1.883  -7.871   2.341
  253   2HB   MET  39          2HB       MET  39   0.295  -7.138   2.504
  254   1HG   MET  39          1HG       MET  39  -0.740  -9.341   2.228
  255   2HG   MET  39          2HG       MET  39   0.868 -10.061   2.154
  256   1HE   MET  39          1HE       MET  39   2.570  -8.819   3.793
  257   2HE   MET  39          2HE       MET  39   2.208  -8.424   5.475
  258   3HE   MET  39          3HE       MET  39   2.480 -10.101   4.997
  259    H    TRP  40           H        TRP  40  -0.233  -5.508   0.045
  260    HA   TRP  40           HA       TRP  40   2.369  -4.271  -0.564
  261   1HB   TRP  40          1HB       TRP  40   1.204  -2.949  -2.327
  262   2HB   TRP  40          2HB       TRP  40   1.225  -4.677  -2.678
  263    HD1  TRP  40           HD1      TRP  40  -1.228  -5.975  -1.892
  264    HE1  TRP  40           1HE      TRP  40  -3.622  -5.090  -2.156
  265    HE3  TRP  40           3HE      TRP  40  -0.203  -1.019  -2.489
  266    HZ2  TRP  40           2HZ      TRP  40  -4.902  -2.630  -2.525
  267    HZ3  TRP  40           3HZ      TRP  40  -2.079   0.537  -2.766
  268    HH2  TRP  40           HH2      TRP  40  -4.383  -0.252  -2.791
  269    H    CYS  41           H        CYS  41   1.486  -1.733  -1.066
  270    HA   CYS  41           HA       CYS  41  -0.219  -0.740   1.037
  271   1HB   CYS  41          1HB       CYS  41   1.523   0.711   2.032
  272   2HB   CYS  41          2HB       CYS  41   1.894  -0.999   2.272
  273    H    ALA  42           H        ALA  42  -0.798   1.491   0.630
  274    HA   ALA  42           HA       ALA  42  -0.347   2.229  -2.142
  275   1HB   ALA  42          1HB       ALA  42  -2.414   2.697  -0.274
  276   2HB   ALA  42          2HB       ALA  42  -1.769   4.264  -0.765
  277   3HB   ALA  42          3HB       ALA  42  -2.357   3.129  -1.983
  278    H    THR  43           H        THR  43   0.575   4.143  -2.835
  279    HA   THR  43           HA       THR  43   2.425   5.295  -0.886
  280    HB   THR  43           HB       THR  43   3.802   5.934  -2.795
  281    HG1  THR  43           1HG      THR  43   2.628   6.313  -4.530
  282   1HG2  THR  43          1HG2      THR  43   3.654   3.427  -3.908
  283   2HG2  THR  43          2HG2      THR  43   4.607   3.879  -2.494
  284   3HG2  THR  43          3HG2      THR  43   2.998   3.184  -2.289
  285    H    THR  44           H        THR  44  -0.486   5.841  -1.716
  286    HA   THR  44           HA       THR  44  -0.237   8.758  -1.678
  287    HB   THR  44           HB       THR  44  -2.348   8.832  -3.057
  288    HG1  THR  44           1HG      THR  44  -3.292   7.029  -3.492
  289   1HG2  THR  44          1HG2      THR  44  -1.085   7.720  -5.166
  290   2HG2  THR  44          2HG2      THR  44  -0.769   9.342  -4.556
  291   3HG2  THR  44          3HG2      THR  44   0.275   8.000  -4.078
  292    H    ALA  45           H        ALA  45  -1.898   9.809  -0.441
  293    HA   ALA  45           HA       ALA  45  -2.704   8.470   1.875
  294   1HB   ALA  45          1HB       ALA  45  -2.672  11.064   1.081
  295   2HB   ALA  45          2HB       ALA  45  -4.404  10.732   1.113
  296   3HB   ALA  45          3HB       ALA  45  -3.430  10.476   2.561
  297    H    ASN  46           H        ASN  46  -4.519   9.158  -1.086
  298    HA   ASN  46           HA       ASN  46  -6.552   7.251  -0.145
  299   1HB   ASN  46          1HB       ASN  46  -7.424   9.581  -0.414
  300   2HB   ASN  46          2HB       ASN  46  -6.970   9.522  -2.113
  301   1HD2  ASN  46          1HD2      ASN  46 -10.459   8.083  -0.875
  302   2HD2  ASN  46          2HD2      ASN  46  -9.375   8.975   0.124
  303    H    TYR  47           H        TYR  47  -6.105   5.385  -1.122
  304    HA   TYR  47           HA       TYR  47  -4.668   5.295  -3.589
  305   1HB   TYR  47          1HB       TYR  47  -4.343   3.597  -1.826
  306   2HB   TYR  47          2HB       TYR  47  -5.994   3.027  -2.088
  307    HD1  TYR  47           1HD      TYR  47  -2.654   3.343  -3.639
  308    HD2  TYR  47           2HD      TYR  47  -6.512   1.572  -3.906
  309    HE1  TYR  47           1HE      TYR  47  -1.853   1.885  -5.443
  310    HE2  TYR  47           2HE      TYR  47  -5.715   0.109  -5.716
  311    HH   TYR  47           HH       TYR  47  -3.836   0.264  -7.506
  312    H    ASP  48           H        ASP  48  -8.041   4.865  -2.683
  313    HA   ASP  48           HA       ASP  48  -9.046   3.634  -4.924
  314   1HB   ASP  48          1HB       ASP  48 -10.196   5.696  -3.079
  315   2HB   ASP  48          2HB       ASP  48 -11.126   5.101  -4.447
  316    H    ASP  49           H        ASP  49  -8.115   6.993  -4.553
  317    HA   ASP  49           HA       ASP  49  -9.159   7.738  -7.141
  318   1HB   ASP  49          1HB       ASP  49  -7.728   9.213  -4.953
  319   2HB   ASP  49          2HB       ASP  49  -7.938   9.940  -6.536
  320    H    ASP  50           H        ASP  50  -5.966   8.481  -5.824
  321    HA   ASP  50           HA       ASP  50  -4.743   8.686  -8.335
  322   1HB   ASP  50          1HB       ASP  50  -3.533   8.404  -5.587
  323   2HB   ASP  50          2HB       ASP  50  -2.622   8.821  -7.036
  324    H    ARG  51           H        ARG  51  -5.321   5.905  -6.439
  325    HA   ARG  51           HA       ARG  51  -4.512   3.808  -6.413
  326   1HB   ARG  51          1HB       ARG  51  -4.862   4.277  -9.346
  327   2HB   ARG  51          2HB       ARG  51  -4.864   2.710  -8.540
  328   1HG   ARG  51          1HG       ARG  51  -6.691   3.818  -7.057
  329   2HG   ARG  51          2HG       ARG  51  -6.876   4.897  -8.438
  330   1HD   ARG  51          1HD       ARG  51  -6.889   1.927  -8.709
  331   2HD   ARG  51          2HD       ARG  51  -8.348   2.843  -8.331
  332    HE   ARG  51           HE       ARG  51  -7.119   2.594 -10.883
  333   1HH1  ARG  51          1HH1      ARG  51  -8.877   4.826  -8.840
  334   2HH1  ARG  51          2HH1      ARG  51  -9.403   5.831 -10.156
  335   1HH2  ARG  51          1HH2      ARG  51  -7.787   3.926 -12.623
  336   2HH2  ARG  51          2HH2      ARG  51  -8.804   5.292 -12.314
  337    H    LYS  52           H        LYS  52  -2.298   5.041  -5.854
  338    HA   LYS  52           HA       LYS  52  -0.336   3.815  -7.649
  339   1HB   LYS  52          1HB       LYS  52  -0.141   6.320  -5.994
  340   2HB   LYS  52          2HB       LYS  52   1.307   5.443  -6.467
  341   1HG   LYS  52          1HG       LYS  52   0.816   5.749  -8.791
  342   2HG   LYS  52          2HG       LYS  52  -0.761   6.426  -8.412
  343   1HD   LYS  52          1HD       LYS  52   0.275   8.363  -7.393
  344   2HD   LYS  52          2HD       LYS  52   1.880   7.663  -7.641
  345   1HE   LYS  52          1HE       LYS  52   1.241   9.391  -9.326
  346   2HE   LYS  52          2HE       LYS  52   1.657   7.820 -10.015
  347   1HZ   LYS  52          1HZ       LYS  52  -0.787   7.349 -10.052
  348   2HZ   LYS  52          2HZ       LYS  52  -1.050   8.978  -9.651
  349   3HZ   LYS  52          3HZ       LYS  52  -0.279   8.573 -11.109
  350    H    TRP  53           H        TRP  53   0.537   2.074  -6.880
  351    HA   TRP  53           HA       TRP  53   0.618   1.713  -3.966
  352   1HB   TRP  53          1HB       TRP  53  -0.120  -0.543  -4.288
  353   2HB   TRP  53          2HB       TRP  53  -1.241   0.543  -5.031
  354    HD1  TRP  53           HD1      TRP  53  -0.659   0.827  -7.922
  355    HE1  TRP  53           1HE      TRP  53  -0.182  -1.149  -9.515
  356    HE3  TRP  53           3HE      TRP  53   0.609  -2.561  -4.454
  357    HZ2  TRP  53           2HZ      TRP  53   0.647  -3.876  -9.266
  358    HZ3  TRP  53           3HZ      TRP  53   1.248  -4.855  -5.150
  359    HH2  TRP  53           HH2      TRP  53   1.268  -5.494  -7.513
  360    H    GLY  54           H        GLY  54   1.817  -0.232  -3.361
  361   1HA   GLY  54          1HA       GLY  54   4.040  -1.108  -4.939
  362   2HA   GLY  54          2HA       GLY  54   4.517   0.003  -3.652
  363    H    PHE  55           H        PHE  55   4.944  -2.973  -4.023
  364    HA   PHE  55           HA       PHE  55   3.376  -4.394  -2.195
  365   1HB   PHE  55          1HB       PHE  55   6.094  -4.785  -3.381
  366   2HB   PHE  55          2HB       PHE  55   5.567  -5.828  -2.075
  367    HD1  PHE  55           1HD      PHE  55   2.612  -5.152  -3.569
  368    HD2  PHE  55           2HD      PHE  55   6.265  -7.169  -4.386
  369    HE1  PHE  55           1HE      PHE  55   1.436  -6.627  -5.153
  370    HE2  PHE  55           2HE      PHE  55   5.098  -8.655  -5.972
  371    HZ   PHE  55           HZ       PHE  55   2.678  -8.357  -6.370
  372    H    CYS  56           H        CYS  56   3.938  -5.232  -0.145
  373    HA   CYS  56           HA       CYS  56   4.879  -3.268   1.700
  374   1HB   CYS  56          1HB       CYS  56   3.102  -5.137   2.075
  375   2HB   CYS  56          2HB       CYS  56   4.485  -6.194   2.322
  376    HA   PRO  57           HA       PRO  57   9.225  -4.241   1.530
  377   1HB   PRO  57          1HB       PRO  57  10.007  -3.379   3.944
  378   2HB   PRO  57          2HB       PRO  57   9.537  -2.263   2.651
  379   1HG   PRO  57          1HG       PRO  57   7.872  -3.388   4.854
  380   2HG   PRO  57          2HG       PRO  57   8.098  -1.675   4.437
  381   1HD   PRO  57          1HD       PRO  57   5.940  -2.969   3.601
  382   2HD   PRO  57          2HD       PRO  57   6.817  -1.914   2.465
  383    H    ASP  58           H        ASP  58  10.555  -4.780   4.076
  384    HA   ASP  58           HA       ASP  58  10.555  -7.578   3.981
  385   1HB   ASP  58          1HB       ASP  58  11.618  -5.608   6.003
  386   2HB   ASP  58          2HB       ASP  58  11.852  -7.336   6.148
  387    H    GLN  59           H        GLN  59   8.373  -8.193   4.214
  388    HA   GLN  59           HA       GLN  59   6.873  -7.589   6.555
  389   1HB   GLN  59          1HB       GLN  59   5.472  -9.490   5.345
  390   2HB   GLN  59          2HB       GLN  59   5.453  -7.832   4.789
  391   1HG   GLN  59          1HG       GLN  59   7.321  -8.520   3.219
  392   2HG   GLN  59          2HG       GLN  59   6.949 -10.184   3.667
  393   1HE2  GLN  59          1HE2      GLN  59   4.895  -8.401   0.799
  394   2HE2  GLN  59          2HE2      GLN  59   6.389  -7.829   1.459
  395    H    GLY  60           H        GLY  60   9.217  -9.904   5.770
  396   1HA   GLY  60          1HA       GLY  60   8.168 -11.884   7.653
  397   2HA   GLY  60          2HA       GLY  60   9.561 -12.091   6.597
  Start of MODEL   36
    1    H    SER   1           1H       SER   1  15.949   7.142   5.647
    2    HA   SER   1           HA       SER   1  14.312   8.222   4.594
    3   1HB   SER   1          1HB       SER   1  14.380   6.122   2.410
    4   2HB   SER   1          2HB       SER   1  13.504   7.651   2.385
    5    HG   SER   1           HG       SER   1  15.583   7.570   1.223
    6    H    TRP   2           H        TRP   2  11.947   7.470   3.867
    7    HA   TRP   2           HA       TRP   2  11.014   5.751   5.967
    8   1HB   TRP   2          1HB       TRP   2   9.780   7.776   5.192
    9   2HB   TRP   2          2HB       TRP   2   9.502   6.987   3.651
   10    HD1  TRP   2           HD1      TRP   2   7.506   5.279   3.499
   11    HE1  TRP   2           1HE      TRP   2   5.607   4.645   5.111
   12    HE3  TRP   2           3HE      TRP   2   9.323   7.424   7.770
   13    HZ2  TRP   2           2HZ      TRP   2   4.982   4.965   7.845
   14    HZ3  TRP   2           3HZ      TRP   2   8.028   7.196   9.848
   15    HH2  TRP   2           HH2      TRP   2   5.894   5.991   9.883
   16    H    MET   3           H        MET   3   9.487   3.920   5.454
   17    HA   MET   3           HA       MET   3  10.751   1.866   4.142
   18   1HB   MET   3          1HB       MET   3   7.794   2.218   4.645
   19   2HB   MET   3          2HB       MET   3   8.534   0.712   4.125
   20   1HG   MET   3          1HG       MET   3   8.205   0.566   6.459
   21   2HG   MET   3          2HG       MET   3   9.934   0.768   6.184
   22   1HE   MET   3          1HE       MET   3   8.695   1.128   9.012
   23   2HE   MET   3          2HE       MET   3  10.401   1.487   8.730
   24   3HE   MET   3          3HE       MET   3   9.380   2.648   9.579
   25    H    SER   4           H        SER   4  11.423   1.960   2.097
   26    HA   SER   4           HA       SER   4   9.904   3.201   0.003
   27   1HB   SER   4          1HB       SER   4  12.340   1.431  -0.289
   28   2HB   SER   4          2HB       SER   4  11.768   2.669  -1.406
   29    HG   SER   4           HG       SER   4  12.132   3.756   1.024
   30    H    THR   5           H        THR   5   9.260   2.048  -1.973
   31    HA   THR   5           HA       THR   5   7.958  -0.438  -1.241
   32    HB   THR   5           HB       THR   5   6.891  -0.050  -3.573
   33    HG1  THR   5           1HG      THR   5   7.607   2.621  -3.070
   34   1HG2  THR   5          1HG2      THR   5   5.282   1.547  -2.680
   35   2HG2  THR   5          2HG2      THR   5   5.634   0.250  -1.537
   36   3HG2  THR   5          3HG2      THR   5   6.348   1.847  -1.309
   37    H    VAL   6           H        VAL   6   7.679  -2.077  -2.766
   38    HA   VAL   6           HA       VAL   6   9.781  -2.643  -4.676
   39    HB   VAL   6           HB       VAL   6  10.688  -4.019  -3.093
   40   1HG1  VAL   6          1HG1      VAL   6   8.039  -3.903  -1.697
   41   2HG1  VAL   6          2HG1      VAL   6   9.309  -5.011  -1.178
   42   3HG1  VAL   6          3HG1      VAL   6   9.595  -3.267  -1.166
   43   1HG2  VAL   6          1HG2      VAL   6   8.315  -5.571  -4.007
   44   2HG2  VAL   6          2HG2      VAL   6  10.008  -5.742  -4.477
   45   3HG2  VAL   6          3HG2      VAL   6   9.479  -6.267  -2.879
   46    H    GLY   7           H        GLY   7   8.808  -4.455  -6.173
   47   1HA   GLY   7          1HA       GLY   7   6.908  -5.278  -7.312
   48   2HA   GLY   7          2HA       GLY   7   6.057  -5.094  -5.806
   49    H    GLY   8           H        GLY   8   4.190  -4.297  -6.759
   50   1HA   GLY   8          1HA       GLY   8   2.767  -2.717  -7.644
   51   2HA   GLY   8          2HA       GLY   8   3.783  -1.602  -6.757
   52    H    ASN   9           H        ASN   9   3.885   0.103  -8.099
   53    HA   ASN   9           HA       ASN   9   5.438  -0.199 -10.522
   54   1HB   ASN   9          1HB       ASN   9   3.814   0.860 -12.002
   55   2HB   ASN   9          2HB       ASN   9   3.205  -0.658 -11.382
   56   1HD2  ASN   9          1HD2      ASN   9   1.336   1.992  -9.159
   57   2HD2  ASN   9          2HD2      ASN   9   2.931   1.390  -8.895
   58    H    SER  10           H        SER  10   5.383   1.282  -7.857
   59    HA   SER  10           HA       SER  10   5.403   4.037  -8.789
   60   1HB   SER  10          1HB       SER  10   5.766   2.949  -5.989
   61   2HB   SER  10          2HB       SER  10   5.474   4.628  -6.447
   62    HG   SER  10           HG       SER  10   3.612   3.187  -5.766
   63    H    GLY  11           H        GLY  11   7.623   1.502  -8.326
   64   1HA   GLY  11          1HA       GLY  11   9.896   1.656  -8.944
   65   2HA   GLY  11          2HA       GLY  11   9.826   3.390  -8.695
   66    H    GLY  12           H        GLY  12   9.756   4.161  -6.474
   67   1HA   GLY  12          1HA       GLY  12  10.590   2.288  -4.409
   68   2HA   GLY  12          2HA       GLY  12  11.793   3.472  -4.887
   69    H    ALA  13           H        ALA  13   8.452   4.347  -4.974
   70    HA   ALA  13           HA       ALA  13   8.830   6.501  -3.151
   71   1HB   ALA  13          1HB       ALA  13   6.618   5.442  -4.788
   72   2HB   ALA  13          2HB       ALA  13   6.148   6.342  -3.345
   73   3HB   ALA  13          3HB       ALA  13   7.174   7.102  -4.562
   74    HA   PRO  14           HA       PRO  14   7.896   4.355   0.589
   75   1HB   PRO  14          1HB       PRO  14   7.231   6.503   2.156
   76   2HB   PRO  14          2HB       PRO  14   8.884   6.026   1.767
   77   1HG   PRO  14          1HG       PRO  14   7.304   8.293   0.769
   78   2HG   PRO  14          2HG       PRO  14   9.058   8.080   0.812
   79   1HD   PRO  14          1HD       PRO  14   7.359   7.822  -1.426
   80   2HD   PRO  14          2HD       PRO  14   9.080   7.416  -1.340
   81    H    CYS  15           H        CYS  15   6.165   3.397   1.537
   82    HA   CYS  15           HA       CYS  15   3.563   3.927   0.486
   83   1HB   CYS  15          1HB       CYS  15   4.473   2.108   2.738
   84   2HB   CYS  15          2HB       CYS  15   2.812   2.197   2.161
   85    H    VAL  16           H        VAL  16   2.098   5.333   1.196
   86    HA   VAL  16           HA       VAL  16   2.591   6.820   3.649
   87    HB   VAL  16           HB       VAL  16   0.481   7.210   1.518
   88   1HG1  VAL  16          1HG1      VAL  16   1.052   8.606   4.062
   89   2HG1  VAL  16          2HG1      VAL  16   0.676   9.617   2.666
   90   3HG1  VAL  16          3HG1      VAL  16  -0.472   8.388   3.201
   91   1HG2  VAL  16          1HG2      VAL  16   3.292   7.914   1.627
   92   2HG2  VAL  16          2HG2      VAL  16   2.159   8.000   0.277
   93   3HG2  VAL  16          3HG2      VAL  16   2.268   9.333   1.424
   94    H    PHE  17           H        PHE  17   1.641   6.328   5.510
   95    HA   PHE  17           HA       PHE  17  -0.885   4.826   5.471
   96   1HB   PHE  17          1HB       PHE  17   1.391   4.753   7.457
   97   2HB   PHE  17          2HB       PHE  17  -0.160   3.986   7.714
   98    HD1  PHE  17           1HD      PHE  17  -0.877   2.449   5.556
   99    HD2  PHE  17           2HD      PHE  17   3.064   3.395   6.835
  100    HE1  PHE  17           1HE      PHE  17  -0.033   0.432   4.440
  101    HE2  PHE  17           2HE      PHE  17   3.927   1.379   5.719
  102    HZ   PHE  17           HZ       PHE  17   2.389  -0.123   4.499
  103    HA   PRO  18           HA       PRO  18  -2.366   4.318   6.664
  104   1HB   PRO  18          1HB       PRO  18  -4.982   5.175   7.111
  105   2HB   PRO  18          2HB       PRO  18  -3.947   4.353   8.279
  106   1HG   PRO  18          1HG       PRO  18  -4.882   7.048   8.361
  107   2HG   PRO  18          2HG       PRO  18  -3.791   6.248   9.498
  108   1HD   PRO  18          1HD       PRO  18  -3.176   8.110   7.298
  109   2HD   PRO  18          2HD       PRO  18  -2.217   7.704   8.733
  110    H    PHE  19           H        PHE  19  -2.928   3.676   4.654
  111    HA   PHE  19           HA       PHE  19  -3.981   5.761   2.861
  112   1HB   PHE  19          1HB       PHE  19  -3.152   4.544   0.995
  113   2HB   PHE  19          2HB       PHE  19  -1.851   4.631   2.171
  114    HD1  PHE  19           1HD      PHE  19  -4.222   2.448   0.449
  115    HD2  PHE  19           2HD      PHE  19  -1.062   2.645   3.286
  116    HE1  PHE  19           1HE      PHE  19  -3.946   0.017   0.295
  117    HE2  PHE  19           2HE      PHE  19  -0.792   0.201   3.152
  118    HZ   PHE  19           HZ       PHE  19  -2.230  -1.113   1.651
  119    H    THR  20           H        THR  20  -5.964   5.566   2.005
  120    HA   THR  20           HA       THR  20  -7.529   3.323   3.014
  121    HB   THR  20           HB       THR  20  -8.441   5.882   1.660
  122    HG1  THR  20           1HG      THR  20  -7.581   6.524   3.554
  123   1HG2  THR  20          1HG2      THR  20 -10.225   4.552   3.558
  124   2HG2  THR  20          2HG2      THR  20 -10.576   5.322   2.010
  125   3HG2  THR  20          3HG2      THR  20  -9.964   3.668   2.054
  126    H    PHE  21           H        PHE  21  -8.236   1.727   1.866
  127    HA   PHE  21           HA       PHE  21  -8.383   1.963  -1.077
  128   1HB   PHE  21          1HB       PHE  21  -6.444   0.517  -0.075
  129   2HB   PHE  21          2HB       PHE  21  -7.721  -0.598   0.352
  130    HD1  PHE  21           1HD      PHE  21  -8.429   1.103  -2.733
  131    HD2  PHE  21           2HD      PHE  21  -6.319  -2.163  -1.009
  132    HE1  PHE  21           1HE      PHE  21  -8.322  -0.002  -4.918
  133    HE2  PHE  21           2HE      PHE  21  -6.207  -3.270  -3.184
  134    HZ   PHE  21           HZ       PHE  21  -7.198  -2.179  -5.170
  135    H    LEU  22           H        LEU  22 -10.199   0.898  -1.950
  136    HA   LEU  22           HA       LEU  22 -12.401   0.484  -2.013
  137   1HB   LEU  22          1HB       LEU  22 -11.205  -1.631  -0.346
  138   2HB   LEU  22          2HB       LEU  22 -12.756  -1.810  -1.143
  139    HG   LEU  22           HG       LEU  22 -11.580  -2.670  -2.832
  140   1HD1  LEU  22          1HD1      LEU  22 -11.246   0.107  -3.193
  141   2HD1  LEU  22          2HD1      LEU  22  -9.906  -0.810  -3.888
  142   3HD1  LEU  22          3HD1      LEU  22 -11.561  -1.160  -4.376
  143   1HD2  LEU  22          1HD2      LEU  22  -9.455  -2.100  -1.037
  144   2HD2  LEU  22          2HD2      LEU  22  -9.790  -3.541  -1.997
  145   3HD2  LEU  22          3HD2      LEU  22  -8.966  -2.166  -2.730
  146    H    GLY  23           H        GLY  23 -11.803   2.338   0.159
  147   1HA   GLY  23          1HA       GLY  23 -13.346   3.379   1.588
  148   2HA   GLY  23          2HA       GLY  23 -14.236   1.875   1.690
  149    H    ASN  24           H        ASN  24 -11.210   0.811   2.327
  150    HA   ASN  24           HA       ASN  24 -11.598   1.267   5.212
  151   1HB   ASN  24          1HB       ASN  24 -10.122  -0.945   3.775
  152   2HB   ASN  24          2HB       ASN  24 -10.337  -0.814   5.514
  153   1HD2  ASN  24          1HD2      ASN  24 -13.101  -2.547   3.261
  154   2HD2  ASN  24          2HD2      ASN  24 -11.515  -2.120   2.725
  155    H    LYS  25           H        LYS  25 -10.023   2.139   6.448
  156    HA   LYS  25           HA       LYS  25  -7.794   3.401   5.183
  157   1HB   LYS  25          1HB       LYS  25  -8.505   3.138   8.106
  158   2HB   LYS  25          2HB       LYS  25  -7.442   4.311   7.377
  159   1HG   LYS  25          1HG       LYS  25  -9.257   5.398   6.268
  160   2HG   LYS  25          2HG       LYS  25 -10.370   4.128   6.788
  161   1HD   LYS  25          1HD       LYS  25 -10.018   4.766   9.113
  162   2HD   LYS  25          2HD       LYS  25  -8.872   6.006   8.599
  163   1HE   LYS  25          1HE       LYS  25 -10.670   7.122   7.339
  164   2HE   LYS  25          2HE       LYS  25 -11.804   5.893   7.910
  165   1HZ   LYS  25          1HZ       LYS  25 -11.274   6.603  10.213
  166   2HZ   LYS  25          2HZ       LYS  25 -10.328   7.870   9.575
  167   3HZ   LYS  25          3HZ       LYS  25 -12.002   7.831   9.283
  168    H    TYR  26           H        TYR  26  -5.825   2.439   4.918
  169    HA   TYR  26           HA       TYR  26  -5.293   0.065   6.544
  170   1HB   TYR  26          1HB       TYR  26  -4.121   0.876   3.888
  171   2HB   TYR  26          2HB       TYR  26  -3.721  -0.585   4.780
  172    HD1  TYR  26           1HD      TYR  26  -6.776  -0.849   5.687
  173    HD2  TYR  26           2HD      TYR  26  -4.780  -0.488   1.958
  174    HE1  TYR  26           1HE      TYR  26  -8.598  -2.062   4.597
  175    HE2  TYR  26           2HE      TYR  26  -6.599  -1.689   0.860
  176    HH   TYR  26           HH       TYR  26  -8.658  -3.585   2.285
  177    H    GLU  27           H        GLU  27  -4.132   0.443   8.166
  178    HA   GLU  27           HA       GLU  27  -2.204   2.593   8.309
  179   1HB   GLU  27          1HB       GLU  27  -2.746   0.503  10.391
  180   2HB   GLU  27          2HB       GLU  27  -2.175   2.138  10.618
  181   1HG   GLU  27          1HG       GLU  27  -4.331   3.037  10.027
  182   2HG   GLU  27          2HG       GLU  27  -4.929   1.419   9.655
  183    H    SER  28           H        SER  28  -2.300  -0.759   7.723
  184    HA   SER  28           HA       SER  28   0.628  -0.881   7.722
  185   1HB   SER  28          1HB       SER  28   0.306  -3.335   8.227
  186   2HB   SER  28          2HB       SER  28  -0.094  -2.261   9.560
  187    HG   SER  28           HG       SER  28  -2.108  -2.913   9.450
  188    H    CYS  29           H        CYS  29   1.047  -3.153   6.343
  189    HA   CYS  29           HA       CYS  29   0.246  -2.460   3.716
  190   1HB   CYS  29          1HB       CYS  29   1.417  -5.054   4.723
  191   2HB   CYS  29          2HB       CYS  29   1.291  -4.583   3.044
  192    H    THR  30           H        THR  30  -0.874  -3.961   2.267
  193    HA   THR  30           HA       THR  30  -2.997  -5.505   3.574
  194    HB   THR  30           HB       THR  30  -3.883  -3.213   3.094
  195    HG1  THR  30           1HG      THR  30  -5.456  -4.684   3.000
  196   1HG2  THR  30          1HG2      THR  30  -4.250  -3.416   0.299
  197   2HG2  THR  30          2HG2      THR  30  -3.406  -2.161   1.206
  198   3HG2  THR  30          3HG2      THR  30  -2.523  -3.572   0.622
  199    H    SER  31           H        SER  31  -4.307  -6.647   1.815
  200    HA   SER  31           HA       SER  31  -2.543  -7.484  -0.377
  201   1HB   SER  31          1HB       SER  31  -3.541  -9.790  -0.076
  202   2HB   SER  31          2HB       SER  31  -2.492  -9.264   1.251
  203    HG   SER  31           HG       SER  31  -4.132  -9.465   2.542
  204    H    ALA  32           H        ALA  32  -4.920  -5.676   0.291
  205    HA   ALA  32           HA       ALA  32  -7.222  -6.550  -1.033
  206   1HB   ALA  32          1HB       ALA  32  -6.311  -4.153   0.230
  207   2HB   ALA  32          2HB       ALA  32  -7.003  -3.723  -1.333
  208   3HB   ALA  32          3HB       ALA  32  -7.968  -4.617  -0.157
  209    H    GLY  33           H        GLY  33  -7.940  -6.456  -3.092
  210   1HA   GLY  33          1HA       GLY  33  -7.934  -5.978  -5.357
  211   2HA   GLY  33          2HA       GLY  33  -6.519  -4.960  -5.102
  212    H    ARG  34           H        ARG  34  -5.500  -7.646  -3.648
  213    HA   ARG  34           HA       ARG  34  -4.403  -8.707  -6.161
  214   1HB   ARG  34          1HB       ARG  34  -3.305  -9.118  -3.386
  215   2HB   ARG  34          2HB       ARG  34  -2.547  -9.538  -4.898
  216   1HG   ARG  34          1HG       ARG  34  -2.798  -6.945  -5.339
  217   2HG   ARG  34          2HG       ARG  34  -2.781  -6.909  -3.577
  218   1HD   ARG  34          1HD       ARG  34  -0.528  -6.665  -4.609
  219   2HD   ARG  34          2HD       ARG  34  -0.654  -8.032  -3.497
  220    HE   ARG  34           HE       ARG  34  -0.154  -9.409  -5.229
  221   1HH1  ARG  34          1HH1      ARG  34  -1.439  -6.439  -6.596
  222   2HH1  ARG  34          2HH1      ARG  34  -1.152  -6.932  -8.237
  223   1HH2  ARG  34          1HH2      ARG  34   0.172 -10.055  -7.398
  224   2HH2  ARG  34          2HH2      ARG  34  -0.231  -8.963  -8.691
  225    H    SER  35           H        SER  35  -4.544 -10.829  -6.675
  226    HA   SER  35           HA       SER  35  -6.249 -12.468  -4.917
  227   1HB   SER  35          1HB       SER  35  -5.796 -12.806  -7.897
  228   2HB   SER  35          2HB       SER  35  -6.975 -13.659  -6.898
  229    HG   SER  35           HG       SER  35  -6.941 -10.904  -7.595
  230    H    ASP  36           H        ASP  36  -3.074 -12.067  -5.563
  231    HA   ASP  36           HA       ASP  36  -2.469 -14.890  -5.837
  232   1HB   ASP  36          1HB       ASP  36  -0.076 -14.079  -5.957
  233   2HB   ASP  36          2HB       ASP  36  -1.126 -13.633  -7.275
  234    H    GLY  37           H        GLY  37  -0.838 -12.476  -3.893
  235   1HA   GLY  37          1HA       GLY  37  -1.565 -13.422  -1.401
  236   2HA   GLY  37          2HA       GLY  37  -0.175 -14.364  -1.890
  237    H    LYS  38           H        LYS  38   1.094 -12.084  -3.305
  238    HA   LYS  38           HA       LYS  38   2.643 -11.109  -1.206
  239   1HB   LYS  38          1HB       LYS  38   2.228  -9.799  -3.893
  240   2HB   LYS  38          2HB       LYS  38   3.624  -9.618  -2.835
  241   1HG   LYS  38          1HG       LYS  38   4.411 -11.104  -4.384
  242   2HG   LYS  38          2HG       LYS  38   3.848 -12.198  -3.136
  243   1HD   LYS  38          1HD       LYS  38   1.813 -12.588  -4.366
  244   2HD   LYS  38          2HD       LYS  38   2.281 -11.399  -5.578
  245   1HE   LYS  38          1HE       LYS  38   4.223 -12.788  -6.170
  246   2HE   LYS  38          2HE       LYS  38   3.714 -13.984  -4.975
  247   1HZ   LYS  38          1HZ       LYS  38   1.766 -13.177  -6.999
  248   2HZ   LYS  38          2HZ       LYS  38   3.055 -14.169  -7.503
  249   3HZ   LYS  38          3HZ       LYS  38   2.015 -14.691  -6.268
  250    H    MET  39           H        MET  39   2.329  -9.525   0.241
  251    HA   MET  39           HA       MET  39  -0.039  -7.881  -0.010
  252   1HB   MET  39          1HB       MET  39   2.023  -7.851   2.202
  253   2HB   MET  39          2HB       MET  39   0.376  -7.239   2.255
  254   1HG   MET  39          1HG       MET  39  -0.500  -9.500   2.068
  255   2HG   MET  39          2HG       MET  39   1.145 -10.131   1.966
  256   1HE   MET  39          1HE       MET  39  -0.410 -11.507   3.511
  257   2HE   MET  39          2HE       MET  39   0.824 -11.751   4.745
  258   3HE   MET  39          3HE       MET  39  -0.763 -11.129   5.198
  259    H    TRP  40           H        TRP  40   0.006  -5.592   0.033
  260    HA   TRP  40           HA       TRP  40   2.582  -4.336  -0.639
  261   1HB   TRP  40          1HB       TRP  40   1.459  -3.081  -2.460
  262   2HB   TRP  40          2HB       TRP  40   1.456  -4.817  -2.771
  263    HD1  TRP  40           HD1      TRP  40  -1.026  -6.065  -2.034
  264    HE1  TRP  40           1HE      TRP  40  -3.403  -5.135  -2.327
  265    HE3  TRP  40           3HE      TRP  40   0.086  -1.115  -2.637
  266    HZ2  TRP  40           2HZ      TRP  40  -4.636  -2.656  -2.715
  267    HZ3  TRP  40           3HZ      TRP  40  -1.762   0.478  -2.927
  268    HH2  TRP  40           HH2      TRP  40  -4.081  -0.285  -2.973
  269    H    CYS  41           H        CYS  41   1.713  -1.817  -1.152
  270    HA   CYS  41           HA       CYS  41  -0.182  -0.844   0.745
  271   1HB   CYS  41          1HB       CYS  41   1.615   0.669   1.865
  272   2HB   CYS  41          2HB       CYS  41   1.416  -0.981   2.442
  273    H    ALA  42           H        ALA  42  -0.806   1.254   0.244
  274    HA   ALA  42           HA       ALA  42  -0.116   2.131  -2.379
  275   1HB   ALA  42          1HB       ALA  42  -2.356   2.453  -1.154
  276   2HB   ALA  42          2HB       ALA  42  -1.574   3.848  -0.403
  277   3HB   ALA  42          3HB       ALA  42  -1.753   3.774  -2.156
  278    H    THR  43           H        THR  43   0.782   4.154  -2.966
  279    HA   THR  43           HA       THR  43   2.815   5.055  -1.060
  280    HB   THR  43           HB       THR  43   3.999   5.866  -3.079
  281    HG1  THR  43           1HG      THR  43   2.828   6.135  -4.800
  282   1HG2  THR  43          1HG2      THR  43   3.866   3.403  -4.226
  283   2HG2  THR  43          2HG2      THR  43   4.859   3.810  -2.826
  284   3HG2  THR  43          3HG2      THR  43   3.274   3.072  -2.598
  285    H    THR  44           H        THR  44  -0.135   5.805  -1.663
  286    HA   THR  44           HA       THR  44   0.256   8.691  -1.351
  287    HB   THR  44           HB       THR  44  -1.833   9.048  -2.687
  288    HG1  THR  44           1HG      THR  44  -2.952   7.366  -3.210
  289   1HG2  THR  44          1HG2      THR  44  -0.828   8.341  -4.948
  290   2HG2  THR  44          2HG2      THR  44   0.030   9.528  -3.966
  291   3HG2  THR  44          3HG2      THR  44   0.572   7.848  -3.993
  292    H    ALA  45           H        ALA  45  -1.493   9.707  -0.115
  293    HA   ALA  45           HA       ALA  45  -2.262   8.226   2.129
  294   1HB   ALA  45          1HB       ALA  45  -2.227  10.857   1.521
  295   2HB   ALA  45          2HB       ALA  45  -3.962  10.536   1.510
  296   3HB   ALA  45          3HB       ALA  45  -3.005  10.176   2.949
  297    H    ASN  46           H        ASN  46  -3.985   8.873  -0.868
  298    HA   ASN  46           HA       ASN  46  -6.056   6.977   0.010
  299   1HB   ASN  46          1HB       ASN  46  -6.934   9.337  -0.132
  300   2HB   ASN  46          2HB       ASN  46  -6.535   9.328  -1.846
  301   1HD2  ASN  46          1HD2      ASN  46  -9.979   7.842  -0.565
  302   2HD2  ASN  46          2HD2      ASN  46  -8.893   8.752   0.413
  303    H    TYR  47           H        TYR  47  -5.759   5.183  -1.103
  304    HA   TYR  47           HA       TYR  47  -4.280   5.176  -3.553
  305   1HB   TYR  47          1HB       TYR  47  -4.055   3.365  -1.909
  306   2HB   TYR  47          2HB       TYR  47  -5.728   2.898  -2.204
  307    HD1  TYR  47           1HD      TYR  47  -2.423   3.264  -3.859
  308    HD2  TYR  47           2HD      TYR  47  -6.263   1.451  -3.973
  309    HE1  TYR  47           1HE      TYR  47  -1.689   1.847  -5.719
  310    HE2  TYR  47           2HE      TYR  47  -5.537   0.032  -5.843
  311    HH   TYR  47           HH       TYR  47  -2.588  -0.621  -6.624
  312    H    ASP  48           H        ASP  48  -7.682   4.980  -2.742
  313    HA   ASP  48           HA       ASP  48  -8.638   3.891  -5.117
  314   1HB   ASP  48          1HB       ASP  48  -9.846   5.764  -3.112
  315   2HB   ASP  48          2HB       ASP  48 -10.737   5.259  -4.542
  316    H    ASP  49           H        ASP  49  -7.711   7.182  -4.353
  317    HA   ASP  49           HA       ASP  49  -8.740   8.307  -6.789
  318   1HB   ASP  49          1HB       ASP  49  -7.051   9.344  -4.538
  319   2HB   ASP  49          2HB       ASP  49  -7.248  10.282  -6.010
  320    H    ASP  50           H        ASP  50  -5.410   8.138  -5.534
  321    HA   ASP  50           HA       ASP  50  -4.259   8.689  -8.068
  322   1HB   ASP  50          1HB       ASP  50  -3.099   7.811  -5.437
  323   2HB   ASP  50          2HB       ASP  50  -2.103   8.077  -6.862
  324    H    ARG  51           H        ARG  51  -4.753   5.671  -6.295
  325    HA   ARG  51           HA       ARG  51  -4.376   3.525  -6.795
  326   1HB   ARG  51          1HB       ARG  51  -4.977   4.606  -9.527
  327   2HB   ARG  51          2HB       ARG  51  -4.852   2.888  -9.161
  328   1HG   ARG  51          1HG       ARG  51  -6.473   4.191  -7.228
  329   2HG   ARG  51          2HG       ARG  51  -7.099   4.502  -8.851
  330   1HD   ARG  51          1HD       ARG  51  -6.305   1.778  -7.889
  331   2HD   ARG  51          2HD       ARG  51  -7.920   2.430  -7.603
  332    HE   ARG  51           HE       ARG  51  -6.867   1.399 -10.078
  333   1HH1  ARG  51          1HH1      ARG  51  -9.173   3.608  -8.668
  334   2HH1  ARG  51          2HH1      ARG  51 -10.234   3.576 -10.038
  335   1HH2  ARG  51          1HH2      ARG  51  -8.249   1.370 -11.885
  336   2HH2  ARG  51          2HH2      ARG  51  -9.710   2.311 -11.871
  337    H    LYS  52           H        LYS  52  -2.074   4.776  -6.298
  338    HA   LYS  52           HA       LYS  52  -0.197   3.492  -8.164
  339   1HB   LYS  52          1HB       LYS  52   0.198   5.974  -6.466
  340   2HB   LYS  52          2HB       LYS  52   1.510   5.132  -7.283
  341   1HG   LYS  52          1HG       LYS  52   1.077   6.189  -9.196
  342   2HG   LYS  52          2HG       LYS  52  -0.611   5.680  -9.147
  343   1HD   LYS  52          1HD       LYS  52  -0.507   8.076  -9.224
  344   2HD   LYS  52          2HD       LYS  52  -1.090   7.573  -7.638
  345   1HE   LYS  52          1HE       LYS  52   1.165   7.884  -6.729
  346   2HE   LYS  52          2HE       LYS  52   1.726   8.408  -8.317
  347   1HZ   LYS  52          1HZ       LYS  52  -0.521   9.795  -6.982
  348   2HZ   LYS  52          2HZ       LYS  52   1.088  10.184  -6.606
  349   3HZ   LYS  52          3HZ       LYS  52   0.522  10.371  -8.193
  350    H    TRP  53           H        TRP  53   0.708   1.755  -7.297
  351    HA   TRP  53           HA       TRP  53   0.861   1.620  -4.364
  352   1HB   TRP  53          1HB       TRP  53   0.063  -0.656  -4.481
  353   2HB   TRP  53          2HB       TRP  53  -1.079   0.416  -5.212
  354    HD1  TRP  53           HD1      TRP  53  -0.736   0.505  -8.129
  355    HE1  TRP  53           1HE      TRP  53  -0.373  -1.571  -9.632
  356    HE3  TRP  53           3HE      TRP  53   0.813  -2.666  -4.564
  357    HZ2  TRP  53           2HZ      TRP  53   0.486  -4.268  -9.280
  358    HZ3  TRP  53           3HZ      TRP  53   1.405  -5.004  -5.170
  359    HH2  TRP  53           HH2      TRP  53   1.242  -5.775  -7.489
  360    H    GLY  54           H        GLY  54   1.991  -0.285  -3.606
  361   1HA   GLY  54          1HA       GLY  54   4.111  -1.406  -5.178
  362   2HA   GLY  54          2HA       GLY  54   4.671  -0.249  -3.970
  363    H    PHE  55           H        PHE  55   5.017  -3.190  -4.144
  364    HA   PHE  55           HA       PHE  55   3.428  -4.557  -2.319
  365   1HB   PHE  55          1HB       PHE  55   6.251  -4.912  -3.273
  366   2HB   PHE  55          2HB       PHE  55   5.560  -5.988  -2.069
  367    HD1  PHE  55           1HD      PHE  55   2.763  -5.362  -3.752
  368    HD2  PHE  55           2HD      PHE  55   6.555  -7.135  -4.486
  369    HE1  PHE  55           1HE      PHE  55   1.765  -6.772  -5.506
  370    HE2  PHE  55           2HE      PHE  55   5.564  -8.548  -6.242
  371    HZ   PHE  55           HZ       PHE  55   3.166  -8.360  -6.760
  372    H    CYS  56           H        CYS  56   4.121  -5.410  -0.220
  373    HA   CYS  56           HA       CYS  56   4.581  -3.361   1.644
  374   1HB   CYS  56          1HB       CYS  56   3.417  -5.643   1.984
  375   2HB   CYS  56          2HB       CYS  56   5.040  -6.287   2.198
  376    HA   PRO  57           HA       PRO  57   9.014  -3.059   1.390
  377   1HB   PRO  57          1HB       PRO  57   9.493  -1.635   3.584
  378   2HB   PRO  57          2HB       PRO  57   8.675  -0.935   2.175
  379   1HG   PRO  57          1HG       PRO  57   7.480  -2.154   4.620
  380   2HG   PRO  57          2HG       PRO  57   7.148  -0.548   3.942
  381   1HD   PRO  57          1HD       PRO  57   5.516  -2.591   3.450
  382   2HD   PRO  57          2HD       PRO  57   5.944  -1.459   2.143
  383    H    ASP  58           H        ASP  58  10.454  -2.759   3.863
  384    HA   ASP  58           HA       ASP  58  11.400  -5.346   4.233
  385   1HB   ASP  58          1HB       ASP  58  12.504  -3.142   4.870
  386   2HB   ASP  58          2HB       ASP  58  11.539  -3.199   6.341
  387    H    GLN  59           H        GLN  59  10.202  -6.996   4.894
  388    HA   GLN  59           HA       GLN  59   8.295  -6.613   7.087
  389   1HB   GLN  59          1HB       GLN  59   8.568  -8.852   5.067
  390   2HB   GLN  59          2HB       GLN  59   7.379  -8.820   6.362
  391   1HG   GLN  59          1HG       GLN  59   6.282  -6.953   5.403
  392   2HG   GLN  59          2HG       GLN  59   7.592  -6.694   4.253
  393   1HE2  GLN  59          1HE2      GLN  59   4.537  -9.084   3.342
  394   2HE2  GLN  59          2HE2      GLN  59   4.590  -8.064   4.738
  395    H    GLY  60           H        GLY  60   9.566  -6.738   8.892
  396   1HA   GLY  60          1HA       GLY  60  11.376  -9.015   9.186
  397   2HA   GLY  60          2HA       GLY  60  11.252  -7.638  10.273
  Start of MODEL   37
    1    H    SER   1           1H       SER   1  19.248   3.300   6.056
    2    HA   SER   1           HA       SER   1  17.299   4.329   6.962
    3   1HB   SER   1          1HB       SER   1  18.154   5.490   4.297
    4   2HB   SER   1          2HB       SER   1  17.553   6.385   5.693
    5    HG   SER   1           HG       SER   1  19.588   6.511   6.225
    6    H    TRP   2           H        TRP   2  16.212   2.079   5.427
    7    HA   TRP   2           HA       TRP   2  14.255   1.387   4.545
    8   1HB   TRP   2          1HB       TRP   2  13.355   4.157   5.355
    9   2HB   TRP   2          2HB       TRP   2  12.272   2.928   4.700
   10    HD1  TRP   2           HD1      TRP   2  12.841   0.399   6.193
   11    HE1  TRP   2           1HE      TRP   2  12.607   0.164   8.747
   12    HE3  TRP   2           3HE      TRP   2  13.235   5.328   7.479
   13    HZ2  TRP   2           2HZ      TRP   2  12.588   1.862  11.007
   14    HZ3  TRP   2           3HZ      TRP   2  13.103   5.939   9.859
   15    HH2  TRP   2           HH2      TRP   2  12.787   4.243  11.582
   16    H    MET   3           H        MET   3  14.720   0.970   2.492
   17    HA   MET   3           HA       MET   3  15.008   3.053   0.543
   18   1HB   MET   3          1HB       MET   3  15.296   1.152  -1.050
   19   2HB   MET   3          2HB       MET   3  16.432   1.158   0.284
   20   1HG   MET   3          1HG       MET   3  13.943  -0.529   0.243
   21   2HG   MET   3          2HG       MET   3  15.494  -1.080  -0.383
   22   1HE   MET   3          1HE       MET   3  15.277  -3.121   1.078
   23   2HE   MET   3          2HE       MET   3  15.396  -3.158   2.837
   24   3HE   MET   3          3HE       MET   3  13.883  -2.677   2.068
   25    H    SER   4           H        SER   4  12.756   3.853   1.060
   26    HA   SER   4           HA       SER   4  10.516   4.068   0.621
   27   1HB   SER   4          1HB       SER   4  11.652   3.282  -2.037
   28   2HB   SER   4          2HB       SER   4  10.115   4.125  -1.808
   29    HG   SER   4           HG       SER   4  11.248   5.905  -1.753
   30    H    THR   5           H        THR   5   9.548   2.473  -1.815
   31    HA   THR   5           HA       THR   5   8.522   0.238  -0.245
   32    HB   THR   5           HB       THR   5   6.853   0.158  -2.203
   33    HG1  THR   5           1HG      THR   5   7.676   1.411  -3.736
   34   1HG2  THR   5          1HG2      THR   5   5.519   2.043  -1.409
   35   2HG2  THR   5          2HG2      THR   5   6.129   1.047  -0.088
   36   3HG2  THR   5          3HG2      THR   5   6.890   2.597  -0.453
   37    H    VAL   6           H        VAL   6   7.791  -1.589  -1.758
   38    HA   VAL   6           HA       VAL   6   9.807  -2.338  -3.718
   39    HB   VAL   6           HB       VAL   6  10.581  -3.711  -2.050
   40   1HG1  VAL   6          1HG1      VAL   6   8.099  -3.046  -0.750
   41   2HG1  VAL   6          2HG1      VAL   6   8.496  -4.747  -0.519
   42   3HG1  VAL   6          3HG1      VAL   6   9.646  -3.500  -0.036
   43   1HG2  VAL   6          1HG2      VAL   6   8.179  -5.273  -2.928
   44   2HG2  VAL   6          2HG2      VAL   6   9.759  -5.240  -3.717
   45   3HG2  VAL   6          3HG2      VAL   6   9.588  -5.943  -2.108
   46    H    GLY   7           H        GLY   7   8.748  -3.990  -5.230
   47   1HA   GLY   7          1HA       GLY   7   6.810  -4.732  -6.358
   48   2HA   GLY   7          2HA       GLY   7   5.946  -4.420  -4.880
   49    H    GLY   8           H        GLY   8   4.201  -3.521  -5.888
   50   1HA   GLY   8          1HA       GLY   8   2.919  -1.881  -6.849
   51   2HA   GLY   8          2HA       GLY   8   3.948  -0.835  -5.898
   52    H    ASN   9           H        ASN   9   3.951   0.855  -7.247
   53    HA   ASN   9           HA       ASN   9   5.738   0.719  -9.500
   54   1HB   ASN   9          1HB       ASN   9   4.159   1.715 -11.125
   55   2HB   ASN   9          2HB       ASN   9   3.713   0.090 -10.651
   56   1HD2  ASN   9          1HD2      ASN   9   1.306   2.349  -8.501
   57   2HD2  ASN   9          2HD2      ASN   9   2.961   2.019  -8.140
   58    H    SER  10           H        SER  10   5.558   2.025  -6.910
   59    HA   SER  10           HA       SER  10   5.049   4.809  -7.344
   60   1HB   SER  10          1HB       SER  10   6.419   4.723  -5.025
   61   2HB   SER  10          2HB       SER  10   4.700   4.362  -5.134
   62    HG   SER  10           HG       SER  10   6.312   2.777  -4.087
   63    H    GLY  11           H        GLY  11   7.890   2.717  -7.286
   64   1HA   GLY  11          1HA       GLY  11   9.917   3.200  -8.390
   65   2HA   GLY  11          2HA       GLY  11   9.437   4.887  -8.478
   66    H    GLY  12           H        GLY  12   9.195   5.902  -6.169
   67   1HA   GLY  12          1HA       GLY  12  11.140   4.846  -4.279
   68   2HA   GLY  12          2HA       GLY  12  11.552   6.386  -5.014
   69    H    ALA  13           H        ALA  13   8.274   5.452  -4.315
   70    HA   ALA  13           HA       ALA  13   8.094   7.647  -2.377
   71   1HB   ALA  13          1HB       ALA  13   6.472   6.941  -4.517
   72   2HB   ALA  13          2HB       ALA  13   5.569   6.416  -3.095
   73   3HB   ALA  13          3HB       ALA  13   6.091   8.095  -3.240
   74    HA   PRO  14           HA       PRO  14   7.442   4.623   0.814
   75   1HB   PRO  14          1HB       PRO  14   6.861   6.281   2.843
   76   2HB   PRO  14          2HB       PRO  14   8.481   6.215   2.141
   77   1HG   PRO  14          1HG       PRO  14   6.362   8.270   1.832
   78   2HG   PRO  14          2HG       PRO  14   8.125   8.450   1.783
   79   1HD   PRO  14          1HD       PRO  14   6.352   8.290  -0.428
   80   2HD   PRO  14          2HD       PRO  14   8.125   8.258  -0.477
   81    H    CYS  15           H        CYS  15   5.735   3.888   2.364
   82    HA   CYS  15           HA       CYS  15   3.136   4.155   1.134
   83   1HB   CYS  15          1HB       CYS  15   4.025   2.533   3.539
   84   2HB   CYS  15          2HB       CYS  15   2.417   2.476   2.828
   85    H    VAL  16           H        VAL  16   1.719   5.665   1.646
   86    HA   VAL  16           HA       VAL  16   2.061   7.316   3.996
   87    HB   VAL  16           HB       VAL  16  -0.069   7.386   1.850
   88   1HG1  VAL  16          1HG1      VAL  16  -0.115   8.636   4.295
   89   2HG1  VAL  16          2HG1      VAL  16   0.546   9.869   3.221
   90   3HG1  VAL  16          3HG1      VAL  16  -1.013   9.127   2.858
   91   1HG2  VAL  16          1HG2      VAL  16   2.519   7.821   1.395
   92   2HG2  VAL  16          2HG2      VAL  16   1.238   8.748   0.605
   93   3HG2  VAL  16          3HG2      VAL  16   2.075   9.417   2.004
   94    H    PHE  17           H        PHE  17   1.216   6.794   5.898
   95    HA   PHE  17           HA       PHE  17  -1.242   5.200   5.963
   96   1HB   PHE  17          1HB       PHE  17   1.094   5.299   7.870
   97   2HB   PHE  17          2HB       PHE  17  -0.444   4.570   8.289
   98    HD1  PHE  17           1HD      PHE  17  -0.595   3.728   5.128
   99    HD2  PHE  17           2HD      PHE  17   1.987   3.042   8.430
  100    HE1  PHE  17           1HE      PHE  17   0.169   1.634   4.098
  101    HE2  PHE  17           2HE      PHE  17   2.762   0.947   7.417
  102    HZ   PHE  17           HZ       PHE  17   1.870   0.222   5.224
  103    HA   PRO  18           HA       PRO  18  -2.777   4.722   6.973
  104   1HB   PRO  18          1HB       PRO  18  -5.431   5.572   7.205
  105   2HB   PRO  18          2HB       PRO  18  -4.487   4.755   8.452
  106   1HG   PRO  18          1HG       PRO  18  -5.439   7.435   8.468
  107   2HG   PRO  18          2HG       PRO  18  -4.406   6.650   9.671
  108   1HD   PRO  18          1HD       PRO  18  -3.684   8.508   7.493
  109   2HD   PRO  18          2HD       PRO  18  -2.826   8.139   9.002
  110    H    PHE  19           H        PHE  19  -3.290   3.997   4.975
  111    HA   PHE  19           HA       PHE  19  -4.160   6.030   3.030
  112   1HB   PHE  19          1HB       PHE  19  -3.391   4.610   1.260
  113   2HB   PHE  19          2HB       PHE  19  -2.094   4.783   2.433
  114    HD1  PHE  19           1HD      PHE  19  -1.717   2.871   4.065
  115    HD2  PHE  19           2HD      PHE  19  -4.126   2.518   0.585
  116    HE1  PHE  19           1HE      PHE  19  -1.448   0.424   4.129
  117    HE2  PHE  19           2HE      PHE  19  -3.858   0.079   0.628
  118    HZ   PHE  19           HZ       PHE  19  -2.510  -0.974   2.411
  119    H    THR  20           H        THR  20  -6.138   5.936   2.198
  120    HA   THR  20           HA       THR  20  -7.849   3.822   3.231
  121    HB   THR  20           HB       THR  20  -8.653   6.243   1.599
  122    HG1  THR  20           1HG      THR  20  -7.927   7.303   3.259
  123   1HG2  THR  20          1HG2      THR  20 -10.639   5.921   3.350
  124   2HG2  THR  20          2HG2      THR  20 -10.627   5.179   1.749
  125   3HG2  THR  20          3HG2      THR  20 -10.144   4.238   3.160
  126    H    PHE  21           H        PHE  21  -8.582   2.177   2.158
  127    HA   PHE  21           HA       PHE  21  -8.660   2.258  -0.787
  128   1HB   PHE  21          1HB       PHE  21  -6.703   0.909   0.267
  129   2HB   PHE  21          2HB       PHE  21  -7.948  -0.215   0.757
  130    HD1  PHE  21           1HD      PHE  21  -8.561   1.409  -2.426
  131    HD2  PHE  21           2HD      PHE  21  -6.692  -1.881  -0.491
  132    HE1  PHE  21           1HE      PHE  21  -8.368   0.234  -4.571
  133    HE2  PHE  21           2HE      PHE  21  -6.502  -3.059  -2.613
  134    HZ   PHE  21           HZ       PHE  21  -7.321  -1.995  -4.686
  135    H    LEU  22           H        LEU  22 -10.434   1.209  -1.641
  136    HA   LEU  22           HA       LEU  22 -12.624   0.768  -1.747
  137   1HB   LEU  22          1HB       LEU  22 -11.368  -1.342  -0.111
  138   2HB   LEU  22          2HB       LEU  22 -12.947  -1.547  -0.855
  139    HG   LEU  22           HG       LEU  22 -11.845  -2.324  -2.636
  140   1HD1  LEU  22          1HD1      LEU  22 -10.522   0.291  -2.883
  141   2HD1  LEU  22          2HD1      LEU  22 -10.601  -0.955  -4.128
  142   3HD1  LEU  22          3HD1      LEU  22 -12.079  -0.160  -3.580
  143   1HD2  LEU  22          1HD2      LEU  22 -10.025  -2.568  -0.800
  144   2HD2  LEU  22          2HD2      LEU  22  -9.793  -3.070  -2.472
  145   3HD2  LEU  22          3HD2      LEU  22  -9.180  -1.508  -1.932
  146    H    GLY  23           H        GLY  23 -12.251   2.668   0.312
  147   1HA   GLY  23          1HA       GLY  23 -13.838   3.652   1.714
  148   2HA   GLY  23          2HA       GLY  23 -14.648   2.105   1.860
  149    H    ASN  24           H        ASN  24 -11.585   1.225   2.581
  150    HA   ASN  24           HA       ASN  24 -12.035   1.805   5.434
  151   1HB   ASN  24          1HB       ASN  24 -10.553  -0.463   4.100
  152   2HB   ASN  24          2HB       ASN  24 -10.686  -0.235   5.834
  153   1HD2  ASN  24          1HD2      ASN  24 -13.561  -2.043   3.762
  154   2HD2  ASN  24          2HD2      ASN  24 -12.043  -1.568   3.101
  155    H    LYS  25           H        LYS  25 -10.454   2.709   6.673
  156    HA   LYS  25           HA       LYS  25  -8.216   3.919   5.354
  157   1HB   LYS  25          1HB       LYS  25  -9.111   3.860   8.242
  158   2HB   LYS  25          2HB       LYS  25  -7.879   4.897   7.573
  159   1HG   LYS  25          1HG       LYS  25  -9.453   6.089   6.245
  160   2HG   LYS  25          2HG       LYS  25 -10.723   4.927   6.648
  161   1HD   LYS  25          1HD       LYS  25 -10.702   5.630   8.948
  162   2HD   LYS  25          2HD       LYS  25  -9.320   6.691   8.653
  163   1HE   LYS  25          1HE       LYS  25 -11.420   7.956   8.736
  164   2HE   LYS  25          2HE       LYS  25 -10.668   8.055   7.145
  165   1HZ   LYS  25          1HZ       LYS  25 -12.218   6.142   6.543
  166   2HZ   LYS  25          2HZ       LYS  25 -13.063   6.524   7.960
  167   3HZ   LYS  25          3HZ       LYS  25 -12.913   7.681   6.723
  168    H    TYR  26           H        TYR  26  -6.281   2.901   5.153
  169    HA   TYR  26           HA       TYR  26  -5.788   0.603   6.903
  170   1HB   TYR  26          1HB       TYR  26  -4.550   1.349   4.256
  171   2HB   TYR  26          2HB       TYR  26  -4.161  -0.087   5.193
  172    HD1  TYR  26           1HD      TYR  26  -7.402  -0.034   5.918
  173    HD2  TYR  26           2HD      TYR  26  -4.966  -0.369   2.465
  174    HE1  TYR  26           1HE      TYR  26  -9.194  -1.253   4.777
  175    HE2  TYR  26           2HE      TYR  26  -6.740  -1.603   1.311
  176    HH   TYR  26           HH       TYR  26  -9.567  -1.609   1.751
  177    H    GLU  27           H        GLU  27  -4.781   1.204   8.588
  178    HA   GLU  27           HA       GLU  27  -2.789   3.287   8.611
  179   1HB   GLU  27          1HB       GLU  27  -3.665   1.486  10.852
  180   2HB   GLU  27          2HB       GLU  27  -2.871   3.037  10.979
  181   1HG   GLU  27          1HG       GLU  27  -4.843   4.088   9.917
  182   2HG   GLU  27          2HG       GLU  27  -5.648   2.525   9.977
  183    H    SER  28           H        SER  28  -2.806   0.038   7.987
  184    HA   SER  28           HA       SER  28   0.080  -0.139   8.300
  185   1HB   SER  28          1HB       SER  28  -0.329  -2.571   8.948
  186   2HB   SER  28          2HB       SER  28  -0.684  -1.374  10.187
  187    HG   SER  28           HG       SER  28  -2.317  -3.191   9.047
  188    H    CYS  29           H        CYS  29   0.382  -2.698   7.158
  189    HA   CYS  29           HA       CYS  29  -0.190  -2.105   4.425
  190   1HB   CYS  29          1HB       CYS  29   0.892  -4.590   5.747
  191   2HB   CYS  29          2HB       CYS  29   0.652  -4.447   4.018
  192    H    THR  30           H        THR  30  -1.193  -3.867   3.053
  193    HA   THR  30           HA       THR  30  -3.435  -5.235   4.293
  194    HB   THR  30           HB       THR  30  -4.298  -2.916   3.767
  195    HG1  THR  30           1HG      THR  30  -5.871  -4.375   3.687
  196   1HG2  THR  30          1HG2      THR  30  -4.662  -3.088   0.998
  197   2HG2  THR  30          2HG2      THR  30  -3.691  -1.913   1.887
  198   3HG2  THR  30          3HG2      THR  30  -2.946  -3.387   1.271
  199    H    SER  31           H        SER  31  -4.681  -6.395   2.478
  200    HA   SER  31           HA       SER  31  -2.873  -7.158   0.298
  201   1HB   SER  31          1HB       SER  31  -3.851  -9.513   0.556
  202   2HB   SER  31          2HB       SER  31  -2.693  -8.994   1.795
  203    HG   SER  31           HG       SER  31  -5.440  -9.488   1.980
  204    H    ALA  32           H        ALA  32  -5.166  -5.345   0.791
  205    HA   ALA  32           HA       ALA  32  -7.508  -6.265  -0.457
  206   1HB   ALA  32          1HB       ALA  32  -6.706  -3.956   0.864
  207   2HB   ALA  32          2HB       ALA  32  -7.042  -3.414  -0.780
  208   3HB   ALA  32          3HB       ALA  32  -8.292  -4.245   0.143
  209    H    GLY  33           H        GLY  33  -8.290  -6.100  -2.476
  210   1HA   GLY  33          1HA       GLY  33  -8.332  -5.804  -4.750
  211   2HA   GLY  33          2HA       GLY  33  -6.977  -4.700  -4.578
  212    H    ARG  34           H        ARG  34  -5.915  -7.403  -3.077
  213    HA   ARG  34           HA       ARG  34  -4.617  -8.295  -5.543
  214   1HB   ARG  34          1HB       ARG  34  -3.788  -8.965  -2.728
  215   2HB   ARG  34          2HB       ARG  34  -2.874  -9.174  -4.198
  216   1HG   ARG  34          1HG       ARG  34  -3.182  -6.569  -4.372
  217   2HG   ARG  34          2HG       ARG  34  -3.351  -6.726  -2.620
  218   1HD   ARG  34          1HD       ARG  34  -1.010  -6.334  -3.227
  219   2HD   ARG  34          2HD       ARG  34  -1.213  -7.939  -2.518
  220    HE   ARG  34           HE       ARG  34  -0.541  -8.859  -4.489
  221   1HH1  ARG  34          1HH1      ARG  34  -1.501  -5.548  -5.068
  222   2HH1  ARG  34          2HH1      ARG  34  -1.015  -5.548  -6.732
  223   1HH2  ARG  34          1HH2      ARG  34   0.104  -8.869  -6.690
  224   2HH2  ARG  34          2HH2      ARG  34  -0.071  -7.434  -7.653
  225    H    SER  35           H        SER  35  -4.838 -10.261  -6.340
  226    HA   SER  35           HA       SER  35  -6.550 -12.149  -4.874
  227   1HB   SER  35          1HB       SER  35  -6.749 -13.197  -7.237
  228   2HB   SER  35          2HB       SER  35  -7.593 -11.676  -6.937
  229    HG   SER  35           HG       SER  35  -5.754 -12.201  -8.781
  230    H    ASP  36           H        ASP  36  -3.431 -11.495  -5.347
  231    HA   ASP  36           HA       ASP  36  -2.479 -14.172  -5.866
  232   1HB   ASP  36          1HB       ASP  36  -0.214 -12.985  -5.447
  233   2HB   ASP  36          2HB       ASP  36  -1.099 -12.634  -6.920
  234    H    GLY  37           H        GLY  37  -1.202 -11.968  -3.483
  235   1HA   GLY  37          1HA       GLY  37  -2.166 -13.144  -1.185
  236   2HA   GLY  37          2HA       GLY  37  -0.750 -14.076  -1.626
  237    H    LYS  38           H        LYS  38   0.626 -11.692  -2.729
  238    HA   LYS  38           HA       LYS  38   2.081 -10.940  -0.489
  239   1HB   LYS  38          1HB       LYS  38   1.726  -9.508  -3.122
  240   2HB   LYS  38          2HB       LYS  38   3.010  -9.193  -1.963
  241   1HG   LYS  38          1HG       LYS  38   3.915 -10.522  -3.673
  242   2HG   LYS  38          2HG       LYS  38   3.755 -11.560  -2.269
  243   1HD   LYS  38          1HD       LYS  38   1.923 -12.695  -3.219
  244   2HD   LYS  38          2HD       LYS  38   1.686 -11.455  -4.453
  245   1HE   LYS  38          1HE       LYS  38   4.061 -13.306  -4.245
  246   2HE   LYS  38          2HE       LYS  38   2.711 -13.491  -5.370
  247   1HZ   LYS  38          1HZ       LYS  38   3.326 -11.215  -6.213
  248   2HZ   LYS  38          2HZ       LYS  38   4.761 -11.335  -5.304
  249   3HZ   LYS  38          3HZ       LYS  38   4.441 -12.447  -6.555
  250    H    MET  39           H        MET  39   2.090  -9.125   0.814
  251    HA   MET  39           HA       MET  39  -0.382  -7.576   0.808
  252   1HB   MET  39          1HB       MET  39   1.753  -7.635   2.945
  253   2HB   MET  39          2HB       MET  39   0.109  -7.037   3.073
  254   1HG   MET  39          1HG       MET  39  -0.791  -9.246   2.904
  255   2HG   MET  39          2HG       MET  39   0.811  -9.914   2.597
  256   1HE   MET  39          1HE       MET  39   0.169 -11.639   4.273
  257   2HE   MET  39          2HE       MET  39   0.286 -11.447   6.023
  258   3HE   MET  39          3HE       MET  39  -1.197 -10.994   5.182
  259    H    TRP  40           H        TRP  40  -0.308  -5.281   0.897
  260    HA   TRP  40           HA       TRP  40   2.279  -4.045   0.244
  261   1HB   TRP  40          1HB       TRP  40   1.215  -2.786  -1.605
  262   2HB   TRP  40          2HB       TRP  40   1.202  -4.522  -1.912
  263    HD1  TRP  40           HD1      TRP  40  -1.282  -5.740  -1.206
  264    HE1  TRP  40           1HE      TRP  40  -3.656  -4.817  -1.569
  265    HE3  TRP  40           3HE      TRP  40  -0.144  -0.814  -1.873
  266    HZ2  TRP  40           2HZ      TRP  40  -4.875  -2.340  -2.037
  267    HZ3  TRP  40           3HZ      TRP  40  -1.981   0.774  -2.252
  268    HH2  TRP  40           HH2      TRP  40  -4.300   0.023  -2.342
  269    H    CYS  41           H        CYS  41   1.569  -1.556  -0.254
  270    HA   CYS  41           HA       CYS  41  -0.406  -0.513   1.546
  271   1HB   CYS  41          1HB       CYS  41   1.393   1.006   2.641
  272   2HB   CYS  41          2HB       CYS  41   1.162  -0.621   3.266
  273    H    ALA  42           H        ALA  42  -1.095   1.492   0.814
  274    HA   ALA  42           HA       ALA  42  -0.200   2.254  -1.775
  275   1HB   ALA  42          1HB       ALA  42  -2.518   2.611  -0.539
  276   2HB   ALA  42          2HB       ALA  42  -1.791   4.183  -0.205
  277   3HB   ALA  42          3HB       ALA  42  -1.985   3.635  -1.871
  278    H    THR  43           H        THR  43   0.708   4.143  -2.451
  279    HA   THR  43           HA       THR  43   2.534   5.350  -0.512
  280    HB   THR  43           HB       THR  43   3.819   6.009  -2.518
  281    HG1  THR  43           1HG      THR  43   2.742   6.090  -4.327
  282   1HG2  THR  43          1HG2      THR  43   3.596   3.328  -3.382
  283   2HG2  THR  43          2HG2      THR  43   4.816   4.041  -2.324
  284   3HG2  THR  43          3HG2      THR  43   3.347   3.347  -1.635
  285    H    THR  44           H        THR  44  -0.410   5.810  -1.469
  286    HA   THR  44           HA       THR  44  -0.245   8.742  -1.505
  287    HB   THR  44           HB       THR  44  -2.325   8.669  -2.925
  288    HG1  THR  44           1HG      THR  44  -2.995   6.562  -2.554
  289   1HG2  THR  44          1HG2      THR  44  -1.214   7.964  -5.031
  290   2HG2  THR  44          2HG2      THR  44  -0.289   9.124  -4.077
  291   3HG2  THR  44          3HG2      THR  44   0.159   7.417  -4.068
  292    H    ALA  45           H        ALA  45  -1.776   9.805  -0.225
  293    HA   ALA  45           HA       ALA  45  -2.705   8.556   2.073
  294   1HB   ALA  45          1HB       ALA  45  -2.415  11.014   1.774
  295   2HB   ALA  45          2HB       ALA  45  -3.906  11.029   0.832
  296   3HB   ALA  45          3HB       ALA  45  -3.943  10.564   2.531
  297    H    ASN  46           H        ASN  46  -4.535   9.388  -0.866
  298    HA   ASN  46           HA       ASN  46  -6.614   7.501   0.018
  299   1HB   ASN  46          1HB       ASN  46  -7.401   9.868  -0.263
  300   2HB   ASN  46          2HB       ASN  46  -6.956   9.767  -1.967
  301   1HD2  ASN  46          1HD2      ASN  46 -10.448   8.371  -0.664
  302   2HD2  ASN  46          2HD2      ASN  46  -9.347   9.265   0.314
  303    H    TYR  47           H        TYR  47  -6.067   5.632  -0.880
  304    HA   TYR  47           HA       TYR  47  -4.731   5.468  -3.398
  305   1HB   TYR  47          1HB       TYR  47  -4.364   3.864  -1.532
  306   2HB   TYR  47          2HB       TYR  47  -5.990   3.240  -1.802
  307    HD1  TYR  47           1HD      TYR  47  -2.599   3.477  -3.177
  308    HD2  TYR  47           2HD      TYR  47  -6.470   1.812  -3.676
  309    HE1  TYR  47           1HE      TYR  47  -1.709   1.924  -4.852
  310    HE2  TYR  47           2HE      TYR  47  -5.591   0.260  -5.355
  311    HH   TYR  47           HH       TYR  47  -2.886   0.631  -6.947
  312    H    ASP  48           H        ASP  48  -8.077   5.212  -2.400
  313    HA   ASP  48           HA       ASP  48  -9.095   3.793  -4.547
  314   1HB   ASP  48          1HB       ASP  48 -10.299   5.943  -2.838
  315   2HB   ASP  48          2HB       ASP  48 -11.207   5.209  -4.154
  316    H    ASP  49           H        ASP  49  -8.281   7.201  -4.337
  317    HA   ASP  49           HA       ASP  49  -9.307   7.763  -6.978
  318   1HB   ASP  49          1HB       ASP  49  -7.880   9.425  -4.914
  319   2HB   ASP  49          2HB       ASP  49  -8.278  10.039  -6.511
  320    H    ASP  50           H        ASP  50  -6.087   7.876  -5.432
  321    HA   ASP  50           HA       ASP  50  -4.751   8.398  -7.913
  322   1HB   ASP  50          1HB       ASP  50  -3.855   7.872  -5.105
  323   2HB   ASP  50          2HB       ASP  50  -2.684   7.877  -6.422
  324    H    ARG  51           H        ARG  51  -4.958   5.552  -5.820
  325    HA   ARG  51           HA       ARG  51  -4.520   3.395  -6.108
  326   1HB   ARG  51          1HB       ARG  51  -4.942   4.034  -9.010
  327   2HB   ARG  51          2HB       ARG  51  -4.947   2.420  -8.303
  328   1HG   ARG  51          1HG       ARG  51  -6.644   4.073  -6.789
  329   2HG   ARG  51          2HG       ARG  51  -7.077   4.251  -8.491
  330   1HD   ARG  51          1HD       ARG  51  -6.615   1.537  -7.373
  331   2HD   ARG  51          2HD       ARG  51  -8.115   2.370  -6.973
  332    HE   ARG  51           HE       ARG  51  -7.505   1.102  -9.428
  333   1HH1  ARG  51          1HH1      ARG  51  -9.070   3.948  -8.129
  334   2HH1  ARG  51          2HH1      ARG  51 -10.151   4.139  -9.473
  335   1HH2  ARG  51          1HH2      ARG  51  -8.915   1.316 -11.192
  336   2HH2  ARG  51          2HH2      ARG  51 -10.057   2.633 -11.238
  337    H    LYS  52           H        LYS  52  -2.295   5.048  -5.861
  338    HA   LYS  52           HA       LYS  52  -0.312   3.631  -7.488
  339   1HB   LYS  52          1HB       LYS  52  -0.138   6.275  -6.038
  340   2HB   LYS  52          2HB       LYS  52   1.297   5.423  -6.605
  341   1HG   LYS  52          1HG       LYS  52   1.026   6.391  -8.579
  342   2HG   LYS  52          2HG       LYS  52  -0.452   5.455  -8.782
  343   1HD   LYS  52          1HD       LYS  52  -1.038   7.704  -9.170
  344   2HD   LYS  52          2HD       LYS  52  -1.652   7.307  -7.561
  345   1HE   LYS  52          1HE       LYS  52   0.174   8.462  -6.518
  346   2HE   LYS  52          2HE       LYS  52   0.984   8.683  -8.070
  347   1HZ   LYS  52          1HZ       LYS  52  -0.930  10.049  -8.780
  348   2HZ   LYS  52          2HZ       LYS  52  -1.584   9.926  -7.224
  349   3HZ   LYS  52          3HZ       LYS  52  -0.098  10.717  -7.453
  350    H    TRP  53           H        TRP  53   0.590   1.990  -6.531
  351    HA   TRP  53           HA       TRP  53   0.699   1.937  -3.587
  352   1HB   TRP  53          1HB       TRP  53   0.053  -0.383  -3.702
  353   2HB   TRP  53          2HB       TRP  53  -1.118   0.591  -4.521
  354    HD1  TRP  53           HD1      TRP  53  -0.695   0.628  -7.407
  355    HE1  TRP  53           1HE      TRP  53  -0.068  -1.414  -8.861
  356    HE3  TRP  53           3HE      TRP  53   1.082  -2.312  -3.743
  357    HZ2  TRP  53           2HZ      TRP  53   1.081  -3.992  -8.441
  358    HZ3  TRP  53           3HZ      TRP  53   1.960  -4.574  -4.295
  359    HH2  TRP  53           HH2      TRP  53   1.952  -5.387  -6.610
  360    H    GLY  54           H        GLY  54   1.883   0.064  -2.779
  361   1HA   GLY  54          1HA       GLY  54   4.216  -0.858  -4.196
  362   2HA   GLY  54          2HA       GLY  54   4.559   0.250  -2.865
  363    H    PHE  55           H        PHE  55   5.046  -2.704  -3.165
  364    HA   PHE  55           HA       PHE  55   3.267  -4.099  -1.494
  365   1HB   PHE  55          1HB       PHE  55   6.042  -4.601  -2.491
  366   2HB   PHE  55          2HB       PHE  55   5.360  -5.640  -1.254
  367    HD1  PHE  55           1HD      PHE  55   2.556  -5.758  -2.158
  368    HD2  PHE  55           2HD      PHE  55   6.187  -5.984  -4.350
  369    HE1  PHE  55           1HE      PHE  55   1.427  -7.143  -3.852
  370    HE2  PHE  55           2HE      PHE  55   5.071  -7.359  -6.062
  371    HZ   PHE  55           HZ       PHE  55   2.688  -7.943  -5.816
  372    H    CYS  56           H        CYS  56   3.878  -5.132   0.554
  373    HA   CYS  56           HA       CYS  56   4.650  -3.200   2.522
  374   1HB   CYS  56          1HB       CYS  56   3.074  -5.362   2.634
  375   2HB   CYS  56          2HB       CYS  56   4.578  -6.156   3.077
  376    HA   PRO  57           HA       PRO  57   9.040  -3.789   2.587
  377   1HB   PRO  57          1HB       PRO  57   9.699  -4.210   5.175
  378   2HB   PRO  57          2HB       PRO  57   9.247  -2.627   4.522
  379   1HG   PRO  57          1HG       PRO  57   7.525  -4.678   5.824
  380   2HG   PRO  57          2HG       PRO  57   7.669  -2.961   6.263
  381   1HD   PRO  57          1HD       PRO  57   5.633  -3.734   4.787
  382   2HD   PRO  57          2HD       PRO  57   6.546  -2.296   4.276
  383    H    ASP  58           H        ASP  58  10.416  -5.337   4.616
  384    HA   ASP  58           HA       ASP  58  10.859  -7.676   3.152
  385   1HB   ASP  58          1HB       ASP  58  12.396  -6.540   4.849
  386   2HB   ASP  58          2HB       ASP  58  11.493  -7.422   6.077
  387    H    GLN  59           H        GLN  59   9.623  -9.375   2.902
  388    HA   GLN  59           HA       GLN  59   7.939 -10.272   5.144
  389   1HB   GLN  59          1HB       GLN  59   7.360 -10.348   2.182
  390   2HB   GLN  59          2HB       GLN  59   6.418 -11.225   3.377
  391   1HG   GLN  59          1HG       GLN  59   5.905  -9.057   4.466
  392   2HG   GLN  59          2HG       GLN  59   6.728  -8.248   3.131
  393   1HE2  GLN  59          1HE2      GLN  59   3.957 -10.187   1.172
  394   2HE2  GLN  59          2HE2      GLN  59   5.500 -10.803   1.644
  395    H    GLY  60           H        GLY  60   7.435 -12.597   5.092
  396   1HA   GLY  60          1HA       GLY  60   9.627 -14.164   3.890
  397   2HA   GLY  60          2HA       GLY  60   9.096 -14.423   5.546
  Start of MODEL   38
    1    H    SER   1           1H       SER   1  13.526   9.489   3.417
    2    HA   SER   1           HA       SER   1  14.142   8.444   5.743
    3   1HB   SER   1          1HB       SER   1  13.068  10.629   5.227
    4   2HB   SER   1          2HB       SER   1  11.521   9.802   5.035
    5    HG   SER   1           HG       SER   1  11.373  10.278   7.106
    6    H    TRP   2           H        TRP   2  10.856   7.942   4.393
    7    HA   TRP   2           HA       TRP   2  10.245   5.905   6.320
    8   1HB   TRP   2          1HB       TRP   2   8.831   6.946   3.875
    9   2HB   TRP   2          2HB       TRP   2   8.217   5.563   4.769
   10    HD1  TRP   2           HD1      TRP   2   6.359   7.945   4.595
   11    HE1  TRP   2           1HE      TRP   2   5.717   9.348   6.651
   12    HE3  TRP   2           3HE      TRP   2  10.334   6.830   7.626
   13    HZ2  TRP   2           2HZ      TRP   2   6.750   9.906   9.216
   14    HZ3  TRP   2           3HZ      TRP   2  10.430   7.845   9.859
   15    HH2  TRP   2           HH2      TRP   2   8.671   9.354  10.637
   16    H    MET   3           H        MET   3   9.003   3.891   5.118
   17    HA   MET   3           HA       MET   3  11.140   2.280   4.164
   18   1HB   MET   3          1HB       MET   3   9.451   0.514   3.972
   19   2HB   MET   3          2HB       MET   3   9.371   1.312   5.530
   20   1HG   MET   3          1HG       MET   3   7.549   1.960   3.228
   21   2HG   MET   3          2HG       MET   3   7.169   0.768   4.468
   22   1HE   MET   3          1HE       MET   3   7.621   1.268   6.853
   23   2HE   MET   3          2HE       MET   3   8.151   2.852   7.422
   24   3HE   MET   3          3HE       MET   3   6.451   2.394   7.539
   25    H    SER   4           H        SER   4  11.447   1.379   2.135
   26    HA   SER   4           HA       SER   4  10.335   2.964  -0.045
   27   1HB   SER   4          1HB       SER   4  12.521   0.861  -0.094
   28   2HB   SER   4          2HB       SER   4  12.090   1.944  -1.418
   29    HG   SER   4           HG       SER   4  13.907   2.450   0.260
   30    H    THR   5           H        THR   5   9.688   1.782  -2.075
   31    HA   THR   5           HA       THR   5   8.132  -0.576  -1.295
   32    HB   THR   5           HB       THR   5   6.850   0.111  -3.444
   33    HG1  THR   5           1HG      THR   5   7.483   2.714  -2.902
   34   1HG2  THR   5          1HG2      THR   5   6.661   1.921  -1.057
   35   2HG2  THR   5          2HG2      THR   5   5.400   1.586  -2.244
   36   3HG2  THR   5          3HG2      THR   5   5.945   0.313  -1.149
   37    H    VAL   6           H        VAL   6   7.841  -2.249  -2.695
   38    HA   VAL   6           HA       VAL   6   9.691  -2.602  -4.926
   39    HB   VAL   6           HB       VAL   6  10.843  -4.019  -3.578
   40   1HG1  VAL   6          1HG1      VAL   6   8.641  -3.508  -1.743
   41   2HG1  VAL   6          2HG1      VAL   6   9.378  -5.096  -1.537
   42   3HG1  VAL   6          3HG1      VAL   6  10.372  -3.641  -1.422
   43   1HG2  VAL   6          1HG2      VAL   6   9.386  -5.586  -4.961
   44   2HG2  VAL   6          2HG2      VAL   6  10.192  -6.260  -3.543
   45   3HG2  VAL   6          3HG2      VAL   6   8.483  -5.843  -3.467
   46    H    GLY   7           H        GLY   7   8.744  -4.472  -6.379
   47   1HA   GLY   7          1HA       GLY   7   6.846  -5.608  -7.220
   48   2HA   GLY   7          2HA       GLY   7   6.009  -5.164  -5.767
   49    H    GLY   8           H        GLY   8   5.113  -3.121  -5.586
   50   1HA   GLY   8          1HA       GLY   8   3.353  -2.334  -7.499
   51   2HA   GLY   8          2HA       GLY   8   3.914  -1.265  -6.237
   52    H    ASN   9           H        ASN   9   3.071  -0.242  -8.592
   53    HA   ASN   9           HA       ASN   9   5.215   0.120 -10.433
   54   1HB   ASN   9          1HB       ASN   9   3.738   1.714 -11.582
   55   2HB   ASN   9          2HB       ASN   9   2.975   0.174 -11.265
   56   1HD2  ASN   9          1HD2      ASN   9   1.560   2.654  -8.506
   57   2HD2  ASN   9          2HD2      ASN   9   3.130   1.937  -8.471
   58    H    SER  10           H        SER  10   4.635   1.576  -7.458
   59    HA   SER  10           HA       SER  10   6.049   4.024  -8.217
   60   1HB   SER  10          1HB       SER  10   5.146   3.470  -5.420
   61   2HB   SER  10          2HB       SER  10   5.230   4.989  -6.292
   62    HG   SER  10           HG       SER  10   3.061   4.025  -5.899
   63    H    GLY  11           H        GLY  11   7.351   1.418  -8.187
   64   1HA   GLY  11          1HA       GLY  11   8.751   0.666  -5.983
   65   2HA   GLY  11          2HA       GLY  11   9.434   0.632  -7.597
   66    H    GLY  12           H        GLY  12   9.406   2.161  -4.535
   67   1HA   GLY  12          1HA       GLY  12  11.704   3.138  -4.084
   68   2HA   GLY  12          2HA       GLY  12  11.369   4.146  -5.484
   69    H    ALA  13           H        ALA  13   8.446   4.352  -4.626
   70    HA   ALA  13           HA       ALA  13   8.895   6.618  -2.858
   71   1HB   ALA  13          1HB       ALA  13   7.410   6.850  -4.807
   72   2HB   ALA  13          2HB       ALA  13   6.318   5.664  -4.094
   73   3HB   ALA  13          3HB       ALA  13   6.589   7.209  -3.288
   74    HA   PRO  14           HA       PRO  14   7.814   4.550   0.872
   75   1HB   PRO  14          1HB       PRO  14   6.829   7.118   1.883
   76   2HB   PRO  14          2HB       PRO  14   8.222   6.167   2.402
   77   1HG   PRO  14          1HG       PRO  14   8.472   8.513   1.076
   78   2HG   PRO  14          2HG       PRO  14   9.645   7.192   0.916
   79   1HD   PRO  14          1HD       PRO  14   7.449   8.017  -0.949
   80   2HD   PRO  14          2HD       PRO  14   9.092   7.450  -1.310
   81    H    CYS  15           H        CYS  15   6.041   3.724   1.950
   82    HA   CYS  15           HA       CYS  15   3.470   4.143   0.689
   83   1HB   CYS  15          1HB       CYS  15   4.352   2.294   2.921
   84   2HB   CYS  15          2HB       CYS  15   2.699   2.376   2.324
   85    H    VAL  16           H        VAL  16   2.149   5.716   1.322
   86    HA   VAL  16           HA       VAL  16   2.512   7.113   3.803
   87    HB   VAL  16           HB       VAL  16   0.331   7.391   1.727
   88   1HG1  VAL  16          1HG1      VAL  16  -0.363   8.280   3.890
   89   2HG1  VAL  16          2HG1      VAL  16   1.113   9.241   3.983
   90   3HG1  VAL  16          3HG1      VAL  16  -0.084   9.584   2.736
   91   1HG2  VAL  16          1HG2      VAL  16   3.048   8.576   2.018
   92   2HG2  VAL  16          2HG2      VAL  16   2.205   8.033   0.568
   93   3HG2  VAL  16          3HG2      VAL  16   1.760   9.561   1.326
   94    H    PHE  17           H        PHE  17   1.691   6.501   5.695
   95    HA   PHE  17           HA       PHE  17  -0.749   4.866   5.706
   96   1HB   PHE  17          1HB       PHE  17   1.655   4.867   7.514
   97   2HB   PHE  17          2HB       PHE  17   0.143   4.112   7.983
   98    HD1  PHE  17           1HD      PHE  17  -0.058   3.477   4.727
   99    HD2  PHE  17           2HD      PHE  17   2.479   2.520   7.993
  100    HE1  PHE  17           1HE      PHE  17   0.679   1.452   3.561
  101    HE2  PHE  17           2HE      PHE  17   3.230   0.489   6.840
  102    HZ   PHE  17           HZ       PHE  17   2.341  -0.065   4.590
  103    HA   PRO  18           HA       PRO  18  -2.171   4.213   6.836
  104   1HB   PRO  18          1HB       PRO  18  -4.788   4.641   7.229
  105   2HB   PRO  18          2HB       PRO  18  -3.683   4.336   8.571
  106   1HG   PRO  18          1HG       PRO  18  -4.876   6.909   7.644
  107   2HG   PRO  18          2HG       PRO  18  -4.529   6.365   9.295
  108   1HD   PRO  18          1HD       PRO  18  -2.940   8.090   7.776
  109   2HD   PRO  18          2HD       PRO  18  -2.419   7.208   9.228
  110    H    PHE  19           H        PHE  19  -2.889   3.510   4.876
  111    HA   PHE  19           HA       PHE  19  -3.815   5.610   3.023
  112   1HB   PHE  19          1HB       PHE  19  -3.088   4.283   1.170
  113   2HB   PHE  19          2HB       PHE  19  -1.750   4.426   2.296
  114    HD1  PHE  19           1HD      PHE  19  -1.373   2.434   3.895
  115    HD2  PHE  19           2HD      PHE  19  -3.737   2.214   0.368
  116    HE1  PHE  19           1HE      PHE  19  -1.093  -0.008   3.863
  117    HE2  PHE  19           2HE      PHE  19  -3.466  -0.226   0.328
  118    HZ   PHE  19           HZ       PHE  19  -2.134  -1.344   2.074
  119    H    THR  20           H        THR  20  -5.819   5.523   2.279
  120    HA   THR  20           HA       THR  20  -7.423   3.273   3.210
  121    HB   THR  20           HB       THR  20  -8.222   5.984   2.118
  122    HG1  THR  20           1HG      THR  20  -7.356   6.147   4.166
  123   1HG2  THR  20          1HG2      THR  20 -10.451   5.378   3.214
  124   2HG2  THR  20          2HG2      THR  20 -10.094   4.689   1.630
  125   3HG2  THR  20          3HG2      THR  20  -9.908   3.706   3.082
  126    H    PHE  21           H        PHE  21  -8.032   1.728   2.003
  127    HA   PHE  21           HA       PHE  21  -8.004   2.051  -0.920
  128   1HB   PHE  21          1HB       PHE  21  -6.545   0.315   0.285
  129   2HB   PHE  21          2HB       PHE  21  -8.037  -0.553   0.581
  130    HD1  PHE  21           1HD      PHE  21  -8.409   1.019  -2.539
  131    HD2  PHE  21           2HD      PHE  21  -6.405  -2.213  -0.642
  132    HE1  PHE  21           1HE      PHE  21  -8.120  -0.093  -4.704
  133    HE2  PHE  21           2HE      PHE  21  -6.126  -3.334  -2.795
  134    HZ   PHE  21           HZ       PHE  21  -6.974  -2.263  -4.850
  135    H    LEU  22           H        LEU  22  -9.631  -0.499  -0.821
  136    HA   LEU  22           HA       LEU  22 -12.054   0.336  -1.623
  137   1HB   LEU  22          1HB       LEU  22 -11.540  -2.266  -0.227
  138   2HB   LEU  22          2HB       LEU  22 -12.831  -1.940  -1.361
  139    HG   LEU  22           HG       LEU  22 -11.376  -3.020  -2.729
  140   1HD1  LEU  22          1HD1      LEU  22 -10.539  -0.192  -2.849
  141   2HD1  LEU  22          2HD1      LEU  22  -9.902  -1.412  -3.953
  142   3HD1  LEU  22          3HD1      LEU  22 -11.632  -1.074  -3.916
  143   1HD2  LEU  22          1HD2      LEU  22  -9.599  -2.511  -0.625
  144   2HD2  LEU  22          2HD2      LEU  22  -9.580  -3.791  -1.838
  145   3HD2  LEU  22          3HD2      LEU  22  -8.803  -2.243  -2.179
  146    H    GLY  23           H        GLY  23 -11.924   1.910   0.389
  147   1HA   GLY  23          1HA       GLY  23 -13.511   2.844   1.838
  148   2HA   GLY  23          2HA       GLY  23 -14.311   1.280   1.934
  149    H    ASN  24           H        ASN  24 -10.972   0.917   2.427
  150    HA   ASN  24           HA       ASN  24 -11.423   1.087   5.338
  151   1HB   ASN  24          1HB       ASN  24  -9.880  -1.036   3.856
  152   2HB   ASN  24          2HB       ASN  24 -10.112  -0.940   5.593
  153   1HD2  ASN  24          1HD2      ASN  24 -12.886  -2.539   3.203
  154   2HD2  ASN  24          2HD2      ASN  24 -11.355  -1.969   2.651
  155    H    LYS  25           H        LYS  25  -9.923   2.020   6.551
  156    HA   LYS  25           HA       LYS  25  -7.704   3.345   5.331
  157   1HB   LYS  25          1HB       LYS  25  -8.543   3.082   8.228
  158   2HB   LYS  25          2HB       LYS  25  -7.424   4.241   7.567
  159   1HG   LYS  25          1HG       LYS  25  -9.126   5.404   6.416
  160   2HG   LYS  25          2HG       LYS  25 -10.289   4.110   6.721
  161   1HD   LYS  25          1HD       LYS  25 -10.164   4.591   9.126
  162   2HD   LYS  25          2HD       LYS  25  -9.036   5.908   8.795
  163   1HE   LYS  25          1HE       LYS  25 -10.726   7.070   7.504
  164   2HE   LYS  25          2HE       LYS  25 -11.846   5.723   7.716
  165   1HZ   LYS  25          1HZ       LYS  25 -11.651   6.137  10.167
  166   2HZ   LYS  25          2HZ       LYS  25 -10.841   7.583   9.797
  167   3HZ   LYS  25          3HZ       LYS  25 -12.445   7.353   9.283
  168    H    TYR  26           H        TYR  26  -5.778   2.312   5.033
  169    HA   TYR  26           HA       TYR  26  -5.239   0.009   6.758
  170   1HB   TYR  26          1HB       TYR  26  -4.060   0.719   4.076
  171   2HB   TYR  26          2HB       TYR  26  -3.697  -0.725   5.009
  172    HD1  TYR  26           1HD      TYR  26  -6.591  -1.213   5.945
  173    HD2  TYR  26           2HD      TYR  26  -4.912  -0.361   2.138
  174    HE1  TYR  26           1HE      TYR  26  -8.427  -2.426   4.869
  175    HE2  TYR  26           2HE      TYR  26  -6.740  -1.564   1.064
  176    HH   TYR  26           HH       TYR  26  -8.684  -3.681   2.482
  177    H    GLU  27           H        GLU  27  -4.075   0.471   8.377
  178    HA   GLU  27           HA       GLU  27  -2.111   2.600   8.389
  179   1HB   GLU  27          1HB       GLU  27  -2.910   0.646  10.538
  180   2HB   GLU  27          2HB       GLU  27  -1.972   2.099  10.759
  181   1HG   GLU  27          1HG       GLU  27  -3.822   3.495  10.335
  182   2HG   GLU  27          2HG       GLU  27  -4.772   2.151   9.701
  183    H    SER  28           H        SER  28  -2.273  -0.697   7.825
  184    HA   SER  28           HA       SER  28   0.639  -0.950   7.935
  185   1HB   SER  28          1HB       SER  28   0.083  -3.435   8.373
  186   2HB   SER  28          2HB       SER  28  -0.102  -2.325   9.727
  187    HG   SER  28           HG       SER  28  -1.957  -3.872   8.524
  188    H    CYS  29           H        CYS  29   1.121  -3.109   6.515
  189    HA   CYS  29           HA       CYS  29   0.283  -2.427   3.898
  190   1HB   CYS  29          1HB       CYS  29   1.562  -4.988   4.834
  191   2HB   CYS  29          2HB       CYS  29   1.480  -4.420   3.181
  192    H    THR  30           H        THR  30  -0.814  -3.884   2.433
  193    HA   THR  30           HA       THR  30  -2.829  -5.600   3.713
  194    HB   THR  30           HB       THR  30  -3.855  -3.354   3.297
  195    HG1  THR  30           1HG      THR  30  -5.320  -4.949   3.128
  196   1HG2  THR  30          1HG2      THR  30  -3.740  -3.824   0.364
  197   2HG2  THR  30          2HG2      THR  30  -3.935  -2.319   1.264
  198   3HG2  THR  30          3HG2      THR  30  -2.348  -3.080   1.146
  199    H    SER  31           H        SER  31  -4.052  -6.801   1.972
  200    HA   SER  31           HA       SER  31  -2.301  -7.418  -0.299
  201   1HB   SER  31          1HB       SER  31  -3.061  -9.799  -0.091
  202   2HB   SER  31          2HB       SER  31  -2.105  -9.245   1.291
  203    HG   SER  31           HG       SER  31  -4.014  -8.995   2.469
  204    H    ALA  32           H        ALA  32  -4.724  -5.755   0.438
  205    HA   ALA  32           HA       ALA  32  -7.043  -6.675  -0.822
  206   1HB   ALA  32          1HB       ALA  32  -5.985  -4.048   0.078
  207   2HB   ALA  32          2HB       ALA  32  -7.293  -4.005  -1.107
  208   3HB   ALA  32          3HB       ALA  32  -7.527  -4.825   0.438
  209    H    GLY  33           H        GLY  33  -7.843  -6.523  -2.872
  210   1HA   GLY  33          1HA       GLY  33  -7.873  -6.122  -5.145
  211   2HA   GLY  33          2HA       GLY  33  -6.556  -4.982  -4.918
  212    H    ARG  34           H        ARG  34  -5.372  -7.603  -3.466
  213    HA   ARG  34           HA       ARG  34  -4.158  -8.592  -5.955
  214   1HB   ARG  34          1HB       ARG  34  -3.089  -8.631  -3.133
  215   2HB   ARG  34          2HB       ARG  34  -2.273  -9.295  -4.530
  216   1HG   ARG  34          1HG       ARG  34  -2.527  -6.851  -5.441
  217   2HG   ARG  34          2HG       ARG  34  -2.671  -6.470  -3.728
  218   1HD   ARG  34          1HD       ARG  34  -0.340  -6.320  -4.528
  219   2HD   ARG  34          2HD       ARG  34  -0.534  -7.549  -3.276
  220    HE   ARG  34           HE       ARG  34   0.080  -9.140  -4.788
  221   1HH1  ARG  34          1HH1      ARG  34  -0.847  -6.245  -6.532
  222   2HH1  ARG  34          2HH1      ARG  34  -0.390  -6.883  -8.083
  223   1HH2  ARG  34          1HH2      ARG  34   0.695  -9.966  -6.820
  224   2HH2  ARG  34          2HH2      ARG  34   0.489  -8.997  -8.246
  225    H    SER  35           H        SER  35  -4.579  -9.795  -2.653
  226    HA   SER  35           HA       SER  35  -5.069 -11.810  -1.780
  227   1HB   SER  35          1HB       SER  35  -7.079 -12.975  -2.717
  228   2HB   SER  35          2HB       SER  35  -7.330 -11.272  -2.353
  229    HG   SER  35           HG       SER  35  -6.488 -11.822  -4.935
  230    H    ASP  36           H        ASP  36  -2.898 -11.751  -3.665
  231    HA   ASP  36           HA       ASP  36  -3.027 -14.443  -4.800
  232   1HB   ASP  36          1HB       ASP  36  -0.772 -13.604  -5.866
  233   2HB   ASP  36          2HB       ASP  36  -2.313 -13.154  -6.563
  234    H    GLY  37           H        GLY  37  -0.300 -12.571  -3.715
  235   1HA   GLY  37          1HA       GLY  37   0.191 -14.366  -1.537
  236   2HA   GLY  37          2HA       GLY  37   1.360 -14.457  -2.833
  237    H    LYS  38           H        LYS  38   1.330 -11.610  -3.441
  238    HA   LYS  38           HA       LYS  38   3.105 -10.779  -1.304
  239   1HB   LYS  38          1HB       LYS  38   2.419  -9.045  -3.635
  240   2HB   LYS  38          2HB       LYS  38   3.956  -9.248  -2.802
  241   1HG   LYS  38          1HG       LYS  38   2.707 -11.323  -4.570
  242   2HG   LYS  38          2HG       LYS  38   3.895 -10.160  -5.096
  243   1HD   LYS  38          1HD       LYS  38   5.493 -11.016  -3.453
  244   2HD   LYS  38          2HD       LYS  38   4.294 -12.201  -2.930
  245   1HE   LYS  38          1HE       LYS  38   4.288 -13.207  -5.145
  246   2HE   LYS  38          2HE       LYS  38   5.454 -12.003  -5.701
  247   1HZ   LYS  38          1HZ       LYS  38   6.325 -13.380  -3.340
  248   2HZ   LYS  38          2HZ       LYS  38   6.059 -14.438  -4.645
  249   3HZ   LYS  38          3HZ       LYS  38   7.133 -13.135  -4.815
  250    H    MET  39           H        MET  39   2.840  -9.049   0.037
  251    HA   MET  39           HA       MET  39   0.197  -7.788   0.034
  252   1HB   MET  39          1HB       MET  39   2.286  -7.866   2.238
  253   2HB   MET  39          2HB       MET  39   0.704  -7.125   2.341
  254   1HG   MET  39          1HG       MET  39   0.527  -9.158   3.477
  255   2HG   MET  39          2HG       MET  39  -0.273  -9.405   1.927
  256   1HE   MET  39          1HE       MET  39  -0.182 -11.585   3.148
  257   2HE   MET  39          2HE       MET  39   0.447 -12.652   1.894
  258   3HE   MET  39          3HE       MET  39   1.265 -12.547   3.454
  259    H    TRP  40           H        TRP  40   0.106  -5.493   0.109
  260    HA   TRP  40           HA       TRP  40   2.643  -4.135  -0.504
  261   1HB   TRP  40          1HB       TRP  40   1.492  -2.878  -2.293
  262   2HB   TRP  40          2HB       TRP  40   1.530  -4.607  -2.634
  263    HD1  TRP  40           HD1      TRP  40  -0.912  -5.931  -1.965
  264    HE1  TRP  40           1HE      TRP  40  -3.312  -5.048  -2.205
  265    HE3  TRP  40           3HE      TRP  40   0.088  -0.949  -2.325
  266    HZ2  TRP  40           2HZ      TRP  40  -4.600  -2.574  -2.481
  267    HZ3  TRP  40           3HZ      TRP  40  -1.792   0.620  -2.557
  268    HH2  TRP  40           HH2      TRP  40  -4.094  -0.184  -2.636
  269    H    CYS  41           H        CYS  41   1.720  -1.650  -0.987
  270    HA   CYS  41           HA       CYS  41  -0.178  -0.712   0.922
  271   1HB   CYS  41          1HB       CYS  41   1.580   0.778   2.083
  272   2HB   CYS  41          2HB       CYS  41   1.443  -0.895   2.601
  273    H    ALA  42           H        ALA  42  -0.825   1.399   0.417
  274    HA   ALA  42           HA       ALA  42  -0.066   2.289  -2.187
  275   1HB   ALA  42          1HB       ALA  42  -1.900   3.408  -0.100
  276   2HB   ALA  42          2HB       ALA  42  -1.527   4.296  -1.577
  277   3HB   ALA  42          3HB       ALA  42  -2.300   2.713  -1.671
  278    H    THR  43           H        THR  43   0.878   4.237  -2.767
  279    HA   THR  43           HA       THR  43   2.779   5.238  -0.782
  280    HB   THR  43           HB       THR  43   4.070   6.013  -2.721
  281    HG1  THR  43           1HG      THR  43   2.745   6.472  -4.351
  282   1HG2  THR  43          1HG2      THR  43   3.606   3.440  -3.856
  283   2HG2  THR  43          2HG2      THR  43   4.957   3.988  -2.860
  284   3HG2  THR  43          3HG2      THR  43   3.509   3.326  -2.099
  285    H    THR  44           H        THR  44  -0.152   5.873  -1.359
  286    HA   THR  44           HA       THR  44   0.100   8.780  -1.155
  287    HB   THR  44           HB       THR  44  -1.952   9.033  -2.540
  288    HG1  THR  44           1HG      THR  44  -3.060   7.306  -2.924
  289   1HG2  THR  44          1HG2      THR  44  -0.209   7.483  -4.349
  290   2HG2  THR  44          2HG2      THR  44  -0.894   9.098  -4.535
  291   3HG2  THR  44          3HG2      THR  44   0.520   8.850  -3.507
  292    H    ALA  45           H        ALA  45  -1.657   9.746   0.067
  293    HA   ALA  45           HA       ALA  45  -2.417   8.232   2.308
  294   1HB   ALA  45          1HB       ALA  45  -3.457  10.868   1.271
  295   2HB   ALA  45          2HB       ALA  45  -3.967  10.158   2.803
  296   3HB   ALA  45          3HB       ALA  45  -2.277  10.595   2.553
  297    H    ASN  46           H        ASN  46  -4.158   9.079  -0.630
  298    HA   ASN  46           HA       ASN  46  -6.251   7.146   0.114
  299   1HB   ASN  46          1HB       ASN  46  -7.117   9.463   0.011
  300   2HB   ASN  46          2HB       ASN  46  -6.541   9.601  -1.649
  301   1HD2  ASN  46          1HD2      ASN  46 -10.098   8.038  -0.839
  302   2HD2  ASN  46          2HD2      ASN  46  -9.091   8.802   0.335
  303    H    TYR  47           H        TYR  47  -5.904   5.366  -0.969
  304    HA   TYR  47           HA       TYR  47  -4.359   5.336  -3.378
  305   1HB   TYR  47          1HB       TYR  47  -4.153   3.559  -1.677
  306   2HB   TYR  47          2HB       TYR  47  -5.809   3.063  -2.022
  307    HD1  TYR  47           1HD      TYR  47  -2.431   3.397  -3.529
  308    HD2  TYR  47           2HD      TYR  47  -6.265   1.578  -3.792
  309    HE1  TYR  47           1HE      TYR  47  -1.602   1.922  -5.302
  310    HE2  TYR  47           2HE      TYR  47  -5.438   0.102  -5.569
  311    HH   TYR  47           HH       TYR  47  -3.377   0.421  -7.395
  312    H    ASP  48           H        ASP  48  -7.767   5.174  -2.643
  313    HA   ASP  48           HA       ASP  48  -8.706   3.995  -4.974
  314   1HB   ASP  48          1HB       ASP  48  -9.947   6.084  -3.206
  315   2HB   ASP  48          2HB       ASP  48 -10.799   5.361  -4.562
  316    H    ASP  49           H        ASP  49  -7.824   7.320  -4.342
  317    HA   ASP  49           HA       ASP  49  -8.744   8.305  -6.863
  318   1HB   ASP  49          1HB       ASP  49  -7.055   9.528  -4.691
  319   2HB   ASP  49          2HB       ASP  49  -7.524  10.386  -6.148
  320    H    ASP  50           H        ASP  50  -5.442   8.180  -5.475
  321    HA   ASP  50           HA       ASP  50  -4.288   8.672  -8.055
  322   1HB   ASP  50          1HB       ASP  50  -3.076   8.150  -5.353
  323   2HB   ASP  50          2HB       ASP  50  -2.114   8.450  -6.796
  324    H    ARG  51           H        ARG  51  -4.856   5.781  -6.196
  325    HA   ARG  51           HA       ARG  51  -4.268   3.632  -6.462
  326   1HB   ARG  51          1HB       ARG  51  -4.494   4.449  -9.335
  327   2HB   ARG  51          2HB       ARG  51  -4.543   2.789  -8.740
  328   1HG   ARG  51          1HG       ARG  51  -6.366   4.108  -7.164
  329   2HG   ARG  51          2HG       ARG  51  -6.619   4.804  -8.776
  330   1HD   ARG  51          1HD       ARG  51  -6.553   1.878  -8.094
  331   2HD   ARG  51          2HD       ARG  51  -8.011   2.838  -8.352
  332    HE   ARG  51           HE       ARG  51  -6.427   3.159 -10.611
  333   1HH1  ARG  51          1HH1      ARG  51  -8.070   0.541  -8.981
  334   2HH1  ARG  51          2HH1      ARG  51  -8.363  -0.356 -10.433
  335   1HH2  ARG  51          1HH2      ARG  51  -6.778   2.003 -12.508
  336   2HH2  ARG  51          2HH2      ARG  51  -7.590   0.463 -12.464
  337    H    LYS  52           H        LYS  52  -2.015   5.007  -5.855
  338    HA   LYS  52           HA       LYS  52  -0.001   3.744  -7.573
  339   1HB   LYS  52          1HB       LYS  52   0.213   6.210  -5.828
  340   2HB   LYS  52          2HB       LYS  52   1.620   5.392  -6.504
  341   1HG   LYS  52          1HG       LYS  52   0.939   5.880  -8.725
  342   2HG   LYS  52          2HG       LYS  52  -0.645   6.428  -8.187
  343   1HD   LYS  52          1HD       LYS  52   0.430   8.300  -7.010
  344   2HD   LYS  52          2HD       LYS  52   2.001   7.767  -7.614
  345   1HE   LYS  52          1HE       LYS  52   1.161   8.052  -9.929
  346   2HE   LYS  52          2HE       LYS  52  -0.356   8.672  -9.273
  347   1HZ   LYS  52          1HZ       LYS  52   2.154   9.960  -8.445
  348   2HZ   LYS  52          2HZ       LYS  52   1.566  10.271 -10.007
  349   3HZ   LYS  52          3HZ       LYS  52   0.602  10.630  -8.648
  350    H    TRP  53           H        TRP  53   0.844   2.013  -6.765
  351    HA   TRP  53           HA       TRP  53   0.882   1.688  -3.843
  352   1HB   TRP  53          1HB       TRP  53   0.177  -0.608  -4.214
  353   2HB   TRP  53          2HB       TRP  53  -0.964   0.506  -4.884
  354    HD1  TRP  53           HD1      TRP  53  -0.630   0.885  -7.746
  355    HE1  TRP  53           1HE      TRP  53  -0.061  -0.954  -9.462
  356    HE3  TRP  53           3HE      TRP  53   1.200  -2.510  -4.534
  357    HZ2  TRP  53           2HZ      TRP  53   1.051  -3.587  -9.412
  358    HZ3  TRP  53           3HZ      TRP  53   2.018  -4.701  -5.397
  359    HH2  TRP  53           HH2      TRP  53   1.941  -5.217  -7.785
  360    H    GLY  54           H        GLY  54   2.072  -0.305  -3.212
  361   1HA   GLY  54          1HA       GLY  54   4.287  -1.231  -4.754
  362   2HA   GLY  54          2HA       GLY  54   4.791  -0.065  -3.530
  363    H    PHE  55           H        PHE  55   5.158  -3.064  -3.801
  364    HA   PHE  55           HA       PHE  55   3.662  -4.432  -1.905
  365   1HB   PHE  55          1HB       PHE  55   6.436  -4.824  -2.989
  366   2HB   PHE  55          2HB       PHE  55   5.752  -5.918  -1.803
  367    HD1  PHE  55           1HD      PHE  55   2.941  -5.109  -3.452
  368    HD2  PHE  55           2HD      PHE  55   6.638  -7.066  -4.216
  369    HE1  PHE  55           1HE      PHE  55   1.881  -6.411  -5.248
  370    HE2  PHE  55           2HE      PHE  55   5.585  -8.367  -6.013
  371    HZ   PHE  55           HZ       PHE  55   3.205  -8.037  -6.540
  372    H    CYS  56           H        CYS  56   4.362  -5.271   0.136
  373    HA   CYS  56           HA       CYS  56   5.141  -3.222   1.942
  374   1HB   CYS  56          1HB       CYS  56   3.573  -5.269   2.286
  375   2HB   CYS  56          2HB       CYS  56   5.062  -6.159   2.580
  376    HA   PRO  57           HA       PRO  57   9.528  -3.936   1.755
  377   1HB   PRO  57          1HB       PRO  57  10.336  -2.537   3.860
  378   2HB   PRO  57          2HB       PRO  57   9.661  -1.727   2.431
  379   1HG   PRO  57          1HG       PRO  57   8.267  -2.577   4.938
  380   2HG   PRO  57          2HG       PRO  57   8.279  -0.958   4.210
  381   1HD   PRO  57          1HD       PRO  57   6.239  -2.643   3.801
  382   2HD   PRO  57          2HD       PRO  57   6.855  -1.636   2.468
  383    H    ASP  58           H        ASP  58   7.501  -5.301   3.636
  384    HA   ASP  58           HA       ASP  58   9.424  -7.093   4.910
  385   1HB   ASP  58          1HB       ASP  58   8.534  -5.373   6.565
  386   2HB   ASP  58          2HB       ASP  58   6.949  -6.097   6.331
  387    H    GLN  59           H        GLN  59   8.900  -8.478   3.157
  388    HA   GLN  59           HA       GLN  59   6.130  -9.390   2.932
  389   1HB   GLN  59          1HB       GLN  59   8.574 -10.127   1.300
  390   2HB   GLN  59          2HB       GLN  59   6.925 -10.624   0.953
  391   1HG   GLN  59          1HG       GLN  59   7.790  -7.750   1.039
  392   2HG   GLN  59          2HG       GLN  59   7.814  -8.730  -0.426
  393   1HE2  GLN  59          1HE2      GLN  59   4.528  -8.067  -1.153
  394   2HE2  GLN  59          2HE2      GLN  59   6.126  -8.495  -1.665
  395    H    GLY  60           H        GLY  60   9.127 -10.326   4.323
  396   1HA   GLY  60          1HA       GLY  60   8.724 -12.125   6.071
  397   2HA   GLY  60          2HA       GLY  60   8.127 -13.079   4.716
  Start of MODEL   39
    1    H    SER   1           1H       SER   1  13.648   3.182   9.372
    2    HA   SER   1           HA       SER   1  14.377   4.156   7.536
    3   1HB   SER   1          1HB       SER   1  16.771   2.289   7.575
    4   2HB   SER   1          2HB       SER   1  16.554   3.696   6.536
    5    HG   SER   1           HG       SER   1  17.015   5.009   8.153
    6    H    TRP   2           H        TRP   2  13.410   3.715   5.642
    7    HA   TRP   2           HA       TRP   2  13.250   0.901   4.786
    8   1HB   TRP   2          1HB       TRP   2  11.058   2.985   4.636
    9   2HB   TRP   2          2HB       TRP   2  10.961   1.364   3.962
   10    HD1  TRP   2           HD1      TRP   2  11.646  -0.556   6.132
   11    HE1  TRP   2           1HE      TRP   2  10.419  -0.667   8.393
   12    HE3  TRP   2           3HE      TRP   2   9.640   4.141   6.195
   13    HZ2  TRP   2           2HZ      TRP   2   8.804   1.011   9.989
   14    HZ3  TRP   2           3HZ      TRP   2   8.253   4.810   8.118
   15    HH2  TRP   2           HH2      TRP   2   7.845   3.274   9.975
   16    H    MET   3           H        MET   3  13.783   0.551   2.672
   17    HA   MET   3           HA       MET   3  14.532   2.899   1.105
   18   1HB   MET   3          1HB       MET   3  15.167  -0.023   0.701
   19   2HB   MET   3          2HB       MET   3  15.782   1.297  -0.281
   20   1HG   MET   3          1HG       MET   3  16.298   0.935   2.662
   21   2HG   MET   3          2HG       MET   3  17.406   0.492   1.370
   22   1HE   MET   3          1HE       MET   3  18.442   1.830   3.472
   23   2HE   MET   3          2HE       MET   3  19.558   2.563   2.319
   24   3HE   MET   3          3HE       MET   3  18.675   3.584   3.453
   25    H    SER   4           H        SER   4  12.274   3.385   0.632
   26    HA   SER   4           HA       SER   4  10.493   3.494  -0.772
   27   1HB   SER   4          1HB       SER   4  12.341   3.539  -2.458
   28   2HB   SER   4          2HB       SER   4  12.186   1.793  -2.623
   29    HG   SER   4           HG       SER   4  10.850   2.405  -4.162
   30    H    THR   5           H        THR   5   9.321   1.754  -2.520
   31    HA   THR   5           HA       THR   5   8.438  -0.400  -0.727
   32    HB   THR   5           HB       THR   5   6.524  -0.420  -2.537
   33    HG1  THR   5           1HG      THR   5   7.302   2.287  -2.734
   34   1HG2  THR   5          1HG2      THR   5   5.885   1.971  -1.217
   35   2HG2  THR   5          2HG2      THR   5   5.345   0.332  -0.852
   36   3HG2  THR   5          3HG2      THR   5   6.799   0.972  -0.086
   37    H    VAL   6           H        VAL   6   7.325  -2.166  -2.215
   38    HA   VAL   6           HA       VAL   6   9.282  -3.050  -4.249
   39    HB   VAL   6           HB       VAL   6   7.672  -5.217  -3.241
   40   1HG1  VAL   6          1HG1      VAL   6  10.184  -4.845  -4.273
   41   2HG1  VAL   6          2HG1      VAL   6  10.501  -5.312  -2.600
   42   3HG1  VAL   6          3HG1      VAL   6   9.532  -6.358  -3.644
   43   1HG2  VAL   6          1HG2      VAL   6   7.608  -3.887  -1.162
   44   2HG2  VAL   6          2HG2      VAL   6   8.466  -5.418  -0.981
   45   3HG2  VAL   6          3HG2      VAL   6   9.373  -3.913  -1.127
   46    H    GLY   7           H        GLY   7   7.865  -4.985  -5.434
   47   1HA   GLY   7          1HA       GLY   7   6.306  -5.130  -7.168
   48   2HA   GLY   7          2HA       GLY   7   5.212  -4.956  -5.826
   49    H    GLY   8           H        GLY   8   3.648  -3.685  -6.415
   50   1HA   GLY   8          1HA       GLY   8   2.469  -1.955  -7.372
   51   2HA   GLY   8          2HA       GLY   8   3.631  -1.019  -6.467
   52    H    ASN   9           H        ASN   9   3.674   0.679  -7.792
   53    HA   ASN   9           HA       ASN   9   5.344   0.437 -10.122
   54   1HB   ASN   9          1HB       ASN   9   3.798   1.551 -11.671
   55   2HB   ASN   9          2HB       ASN   9   3.190  -0.006 -11.155
   56   1HD2  ASN   9          1HD2      ASN   9   1.121   2.486  -8.930
   57   2HD2  ASN   9          2HD2      ASN   9   2.712   1.895  -8.603
   58    H    SER  10           H        SER  10   5.386   1.709  -7.494
   59    HA   SER  10           HA       SER  10   5.093   4.535  -7.885
   60   1HB   SER  10          1HB       SER  10   6.542   4.318  -5.629
   61   2HB   SER  10          2HB       SER  10   4.797   4.109  -5.663
   62    HG   SER  10           HG       SER  10   6.012   2.385  -4.594
   63    H    GLY  11           H        GLY  11   7.868   2.359  -7.353
   64   1HA   GLY  11          1HA       GLY  11   9.886   2.533  -8.643
   65   2HA   GLY  11          2HA       GLY  11   9.524   4.232  -8.905
   66    H    GLY  12           H        GLY  12   9.315   5.480  -6.720
   67   1HA   GLY  12          1HA       GLY  12  11.330   4.532  -4.806
   68   2HA   GLY  12          2HA       GLY  12  11.582   6.091  -5.579
   69    H    ALA  13           H        ALA  13   8.419   4.880  -4.681
   70    HA   ALA  13           HA       ALA  13   8.264   7.018  -2.667
   71   1HB   ALA  13          1HB       ALA  13   6.707   6.873  -4.804
   72   2HB   ALA  13          2HB       ALA  13   5.792   5.788  -3.754
   73   3HB   ALA  13          3HB       ALA  13   6.104   7.448  -3.247
   74    HA   PRO  14           HA       PRO  14   7.563   3.792   0.298
   75   1HB   PRO  14          1HB       PRO  14   7.197   5.371   2.447
   76   2HB   PRO  14          2HB       PRO  14   8.778   5.185   1.686
   77   1HG   PRO  14          1HG       PRO  14   6.893   7.467   1.591
   78   2HG   PRO  14          2HG       PRO  14   8.658   7.454   1.455
   79   1HD   PRO  14          1HD       PRO  14   6.774   7.621  -0.660
   80   2HD   PRO  14          2HD       PRO  14   8.528   7.416  -0.808
   81    H    CYS  15           H        CYS  15   5.897   3.316   2.092
   82    HA   CYS  15           HA       CYS  15   3.266   3.587   0.923
   83   1HB   CYS  15          1HB       CYS  15   3.710   2.489   3.682
   84   2HB   CYS  15          2HB       CYS  15   2.568   1.973   2.452
   85    H    VAL  16           H        VAL  16   1.600   4.881   1.663
   86    HA   VAL  16           HA       VAL  16   2.313   6.833   3.744
   87    HB   VAL  16           HB       VAL  16   0.120   6.964   1.659
   88   1HG1  VAL  16          1HG1      VAL  16  -0.472   8.194   3.695
   89   2HG1  VAL  16          2HG1      VAL  16   1.054   9.069   3.606
   90   3HG1  VAL  16          3HG1      VAL  16  -0.158   9.286   2.344
   91   1HG2  VAL  16          1HG2      VAL  16   2.725   7.222   1.151
   92   2HG2  VAL  16          2HG2      VAL  16   1.492   8.184   0.335
   93   3HG2  VAL  16          3HG2      VAL  16   2.380   8.866   1.696
   94    H    PHE  17           H        PHE  17   1.574   6.341   5.721
   95    HA   PHE  17           HA       PHE  17  -1.048   5.039   5.910
   96   1HB   PHE  17          1HB       PHE  17   1.356   4.818   7.707
   97   2HB   PHE  17          2HB       PHE  17  -0.231   4.195   8.110
   98    HD1  PHE  17           1HD      PHE  17  -1.233   2.846   5.837
   99    HD2  PHE  17           2HD      PHE  17   2.790   3.178   7.168
  100    HE1  PHE  17           1HE      PHE  17  -0.672   0.752   4.686
  101    HE2  PHE  17           2HE      PHE  17   3.370   1.094   6.013
  102    HZ   PHE  17           HZ       PHE  17   1.639  -0.150   4.752
  103    HA   PRO  18           HA       PRO  18  -2.473   4.638   7.037
  104   1HB   PRO  18          1HB       PRO  18  -4.996   5.467   7.627
  105   2HB   PRO  18          2HB       PRO  18  -3.880   4.815   8.824
  106   1HG   PRO  18          1HG       PRO  18  -4.823   7.561   8.463
  107   2HG   PRO  18          2HG       PRO  18  -4.040   6.825   9.870
  108   1HD   PRO  18          1HD       PRO  18  -2.883   8.524   7.841
  109   2HD   PRO  18          2HD       PRO  18  -2.111   7.859   9.291
  110    H    PHE  19           H        PHE  19  -3.323   4.070   5.075
  111    HA   PHE  19           HA       PHE  19  -4.216   6.341   3.412
  112   1HB   PHE  19          1HB       PHE  19  -3.710   5.062   1.428
  113   2HB   PHE  19          2HB       PHE  19  -2.291   5.130   2.453
  114    HD1  PHE  19           1HD      PHE  19  -1.716   3.068   3.829
  115    HD2  PHE  19           2HD      PHE  19  -4.569   3.055   0.676
  116    HE1  PHE  19           1HE      PHE  19  -1.447   0.629   3.591
  117    HE2  PHE  19           2HE      PHE  19  -4.308   0.628   0.433
  118    HZ   PHE  19           HZ       PHE  19  -2.738  -0.595   1.885
  119    H    THR  20           H        THR  20  -5.627   4.994   1.490
  120    HA   THR  20           HA       THR  20  -7.651   3.441   2.905
  121    HB   THR  20           HB       THR  20  -8.252   6.006   1.390
  122    HG1  THR  20           1HG      THR  20  -7.459   6.034   3.702
  123   1HG2  THR  20          1HG2      THR  20 -10.532   5.387   2.722
  124   2HG2  THR  20          2HG2      THR  20 -10.235   5.090   1.007
  125   3HG2  THR  20          3HG2      THR  20  -9.978   3.801   2.182
  126    H    PHE  21           H        PHE  21  -8.209   1.768   1.680
  127    HA   PHE  21           HA       PHE  21  -7.881   2.043  -1.241
  128   1HB   PHE  21          1HB       PHE  21  -6.345   0.358  -0.171
  129   2HB   PHE  21          2HB       PHE  21  -7.768  -0.509   0.364
  130    HD1  PHE  21           1HD      PHE  21  -5.875   0.521  -2.607
  131    HD2  PHE  21           2HD      PHE  21  -9.024  -1.925  -1.129
  132    HE1  PHE  21           1HE      PHE  21  -5.863  -0.724  -4.704
  133    HE2  PHE  21           2HE      PHE  21  -9.017  -3.179  -3.239
  134    HZ   PHE  21           HZ       PHE  21  -7.445  -2.589  -5.030
  135    H    LEU  22           H        LEU  22  -9.563   1.737  -2.400
  136    HA   LEU  22           HA       LEU  22 -11.766   1.713  -2.904
  137   1HB   LEU  22          1HB       LEU  22 -10.624  -0.909  -2.199
  138   2HB   LEU  22          2HB       LEU  22 -12.265  -0.835  -2.807
  139    HG   LEU  22           HG       LEU  22 -10.569  -1.284  -4.554
  140   1HD1  LEU  22          1HD1      LEU  22 -12.687   0.493  -4.533
  141   2HD1  LEU  22          2HD1      LEU  22 -11.403   1.245  -5.480
  142   3HD1  LEU  22          3HD1      LEU  22 -11.998  -0.357  -5.917
  143   1HD2  LEU  22          1HD2      LEU  22  -9.666   1.485  -3.891
  144   2HD2  LEU  22          2HD2      LEU  22  -8.707   0.005  -3.837
  145   3HD2  LEU  22          3HD2      LEU  22  -9.269   0.638  -5.385
  146    H    GLY  23           H        GLY  23 -11.715   2.770  -0.422
  147   1HA   GLY  23          1HA       GLY  23 -13.665   3.309   0.859
  148   2HA   GLY  23          2HA       GLY  23 -14.193   1.652   0.692
  149    H    ASN  24           H        ASN  24 -11.202   0.907   1.643
  150    HA   ASN  24           HA       ASN  24 -11.966   1.220   4.475
  151   1HB   ASN  24          1HB       ASN  24 -10.187  -0.872   3.222
  152   2HB   ASN  24          2HB       ASN  24 -10.740  -0.828   4.888
  153   1HD2  ASN  24          1HD2      ASN  24 -12.896  -2.632   2.107
  154   2HD2  ASN  24          2HD2      ASN  24 -11.260  -2.117   1.915
  155    H    LYS  25           H        LYS  25 -10.623   2.092   5.935
  156    HA   LYS  25           HA       LYS  25  -8.320   3.561   5.100
  157   1HB   LYS  25          1HB       LYS  25  -9.400   2.937   7.858
  158   2HB   LYS  25          2HB       LYS  25  -8.294   4.214   7.443
  159   1HG   LYS  25          1HG       LYS  25 -11.049   4.094   6.298
  160   2HG   LYS  25          2HG       LYS  25 -10.706   4.866   7.844
  161   1HD   LYS  25          1HD       LYS  25  -9.434   5.589   5.207
  162   2HD   LYS  25          2HD       LYS  25 -10.752   6.476   5.981
  163   1HE   LYS  25          1HE       LYS  25  -7.965   6.067   7.082
  164   2HE   LYS  25          2HE       LYS  25  -8.598   7.558   6.384
  165   1HZ   LYS  25          1HZ       LYS  25 -10.263   6.610   8.502
  166   2HZ   LYS  25          2HZ       LYS  25  -8.663   6.825   9.033
  167   3HZ   LYS  25          3HZ       LYS  25  -9.501   8.117   8.318
  168    H    TYR  26           H        TYR  26  -6.252   2.648   4.966
  169    HA   TYR  26           HA       TYR  26  -5.782   0.294   6.654
  170   1HB   TYR  26          1HB       TYR  26  -4.456   1.048   4.054
  171   2HB   TYR  26          2HB       TYR  26  -4.083  -0.365   5.027
  172    HD1  TYR  26           1HD      TYR  26  -7.172  -0.761   5.703
  173    HD2  TYR  26           2HD      TYR  26  -4.916  -0.330   2.144
  174    HE1  TYR  26           1HE      TYR  26  -8.846  -2.070   4.486
  175    HE2  TYR  26           2HE      TYR  26  -6.571  -1.630   0.914
  176    HH   TYR  26           HH       TYR  26  -8.460  -3.603   1.884
  177    H    GLU  27           H        GLU  27  -4.533   0.590   8.254
  178    HA   GLU  27           HA       GLU  27  -2.669   2.837   8.337
  179   1HB   GLU  27          1HB       GLU  27  -3.586   0.971  10.511
  180   2HB   GLU  27          2HB       GLU  27  -2.647   2.424  10.722
  181   1HG   GLU  27          1HG       GLU  27  -4.496   3.788   9.995
  182   2HG   GLU  27          2HG       GLU  27  -5.445   2.345   9.647
  183    H    SER  28           H        SER  28  -2.791  -0.442   7.779
  184    HA   SER  28           HA       SER  28   0.103  -0.708   8.098
  185   1HB   SER  28          1HB       SER  28  -0.429  -3.158   8.586
  186   2HB   SER  28          2HB       SER  28  -0.773  -2.021   9.879
  187    HG   SER  28           HG       SER  28  -2.433  -3.724   8.688
  188    H    CYS  29           H        CYS  29   0.527  -3.064   6.819
  189    HA   CYS  29           HA       CYS  29  -0.067  -2.378   4.122
  190   1HB   CYS  29          1HB       CYS  29   1.143  -4.907   5.247
  191   2HB   CYS  29          2HB       CYS  29   1.084  -4.480   3.550
  192    H    THR  30           H        THR  30  -1.016  -3.998   2.623
  193    HA   THR  30           HA       THR  30  -3.164  -5.604   3.803
  194    HB   THR  30           HB       THR  30  -4.086  -3.295   3.401
  195    HG1  THR  30           1HG      THR  30  -5.616  -4.817   3.264
  196   1HG2  THR  30          1HG2      THR  30  -4.207  -3.634   0.503
  197   2HG2  THR  30          2HG2      THR  30  -3.903  -2.192   1.468
  198   3HG2  THR  30          3HG2      THR  30  -2.584  -3.307   1.113
  199    H    SER  31           H        SER  31  -4.368  -6.738   1.992
  200    HA   SER  31           HA       SER  31  -2.562  -7.336  -0.246
  201   1HB   SER  31          1HB       SER  31  -3.366  -9.692  -0.137
  202   2HB   SER  31          2HB       SER  31  -2.481  -9.204   1.315
  203    HG   SER  31           HG       SER  31  -5.280  -9.546   0.973
  204    H    ALA  32           H        ALA  32  -4.894  -5.585   0.383
  205    HA   ALA  32           HA       ALA  32  -7.250  -6.377  -0.855
  206   1HB   ALA  32          1HB       ALA  32  -6.265  -4.069   0.383
  207   2HB   ALA  32          2HB       ALA  32  -6.721  -3.550  -1.241
  208   3HB   ALA  32          3HB       ALA  32  -7.910  -4.332  -0.198
  209    H    GLY  33           H        GLY  33  -7.979  -6.472  -2.879
  210   1HA   GLY  33          1HA       GLY  33  -8.048  -6.204  -5.176
  211   2HA   GLY  33          2HA       GLY  33  -6.681  -5.107  -5.050
  212    H    ARG  34           H        ARG  34  -5.695  -7.742  -3.392
  213    HA   ARG  34           HA       ARG  34  -4.544  -8.941  -5.819
  214   1HB   ARG  34          1HB       ARG  34  -3.314  -9.020  -3.075
  215   2HB   ARG  34          2HB       ARG  34  -2.584  -9.457  -4.596
  216   1HG   ARG  34          1HG       ARG  34  -2.995  -6.952  -5.201
  217   2HG   ARG  34          2HG       ARG  34  -3.060  -6.759  -3.453
  218   1HD   ARG  34          1HD       ARG  34  -0.797  -6.413  -4.438
  219   2HD   ARG  34          2HD       ARG  34  -0.859  -7.666  -3.193
  220    HE   ARG  34           HE       ARG  34  -0.207  -9.188  -4.765
  221   1HH1  ARG  34          1HH1      ARG  34  -1.465  -6.387  -6.428
  222   2HH1  ARG  34          2HH1      ARG  34  -1.145  -7.024  -8.009
  223   1HH2  ARG  34          1HH2      ARG  34   0.279 -10.000  -6.826
  224   2HH2  ARG  34          2HH2      ARG  34  -0.076  -9.050  -8.233
  225    H    SER  35           H        SER  35  -4.354 -11.149  -5.940
  226    HA   SER  35           HA       SER  35  -5.661 -12.717  -3.821
  227   1HB   SER  35          1HB       SER  35  -6.008 -13.088  -6.811
  228   2HB   SER  35          2HB       SER  35  -6.639 -14.179  -5.578
  229    HG   SER  35           HG       SER  35  -8.299 -12.827  -6.074
  230    H    ASP  36           H        ASP  36  -2.863 -12.025  -5.160
  231    HA   ASP  36           HA       ASP  36  -1.949 -14.721  -5.675
  232   1HB   ASP  36          1HB       ASP  36  -0.173 -13.801  -6.788
  233   2HB   ASP  36          2HB       ASP  36  -1.347 -12.516  -6.956
  234    H    GLY  37           H        GLY  37  -1.382 -12.134  -3.395
  235   1HA   GLY  37          1HA       GLY  37  -1.201 -13.239  -1.062
  236   2HA   GLY  37          2HA       GLY  37   0.200 -14.018  -1.767
  237    H    LYS  38           H        LYS  38   1.165 -11.626  -3.190
  238    HA   LYS  38           HA       LYS  38   2.784 -10.580  -1.170
  239   1HB   LYS  38          1HB       LYS  38   2.151  -9.016  -3.639
  240   2HB   LYS  38          2HB       LYS  38   3.682  -9.162  -2.786
  241   1HG   LYS  38          1HG       LYS  38   2.362 -11.326  -4.395
  242   2HG   LYS  38          2HG       LYS  38   3.689 -10.326  -4.925
  243   1HD   LYS  38          1HD       LYS  38   5.191 -11.273  -3.354
  244   2HD   LYS  38          2HD       LYS  38   3.868 -12.042  -2.468
  245   1HE   LYS  38          1HE       LYS  38   5.312 -13.491  -4.027
  246   2HE   LYS  38          2HE       LYS  38   3.560 -13.665  -4.110
  247   1HZ   LYS  38          1HZ       LYS  38   5.032 -11.839  -5.921
  248   2HZ   LYS  38          2HZ       LYS  38   4.815 -13.482  -6.296
  249   3HZ   LYS  38          3HZ       LYS  38   3.463 -12.470  -6.097
  250    H    MET  39           H        MET  39   2.083  -9.397   0.528
  251    HA   MET  39           HA       MET  39  -0.216  -7.693   0.284
  252   1HB   MET  39          1HB       MET  39   1.795  -7.895   2.546
  253   2HB   MET  39          2HB       MET  39   0.229  -7.106   2.612
  254   1HG   MET  39          1HG       MET  39  -0.858  -9.281   2.205
  255   2HG   MET  39          2HG       MET  39   0.729 -10.046   2.245
  256   1HE   MET  39          1HE       MET  39  -1.003  -7.259   4.007
  257   2HE   MET  39          2HE       MET  39  -2.068  -8.333   4.911
  258   3HE   MET  39          3HE       MET  39  -0.729  -7.528   5.729
  259    H    TRP  40           H        TRP  40  -0.210  -5.508   0.043
  260    HA   TRP  40           HA       TRP  40   2.407  -4.236  -0.401
  261   1HB   TRP  40          1HB       TRP  40   1.249  -2.866  -2.138
  262   2HB   TRP  40          2HB       TRP  40   1.296  -4.588  -2.527
  263    HD1  TRP  40           HD1      TRP  40  -1.152  -5.936  -1.883
  264    HE1  TRP  40           1HE      TRP  40  -3.553  -5.053  -2.111
  265    HE3  TRP  40           3HE      TRP  40  -0.157  -0.948  -2.190
  266    HZ2  TRP  40           2HZ      TRP  40  -4.848  -2.577  -2.352
  267    HZ3  TRP  40           3HZ      TRP  40  -2.034   0.616  -2.388
  268    HH2  TRP  40           HH2      TRP  40  -4.331  -0.185  -2.477
  269    H    CYS  41           H        CYS  41   1.490  -1.700  -0.882
  270    HA   CYS  41           HA       CYS  41  -0.160  -0.704   1.251
  271   1HB   CYS  41          1HB       CYS  41   1.726   0.742   2.157
  272   2HB   CYS  41          2HB       CYS  41   1.842  -0.971   2.566
  273    H    ALA  42           H        ALA  42  -0.903   1.387   0.693
  274    HA   ALA  42           HA       ALA  42  -0.385   2.185  -2.005
  275   1HB   ALA  42          1HB       ALA  42  -2.000   3.389   0.214
  276   2HB   ALA  42          2HB       ALA  42  -1.737   4.250  -1.303
  277   3HB   ALA  42          3HB       ALA  42  -2.554   2.686  -1.306
  278    H    THR  43           H        THR  43   0.601   4.077  -2.729
  279    HA   THR  43           HA       THR  43   2.606   5.104  -0.857
  280    HB   THR  43           HB       THR  43   3.888   5.705  -2.866
  281    HG1  THR  43           1HG      THR  43   2.258   6.033  -4.375
  282   1HG2  THR  43          1HG2      THR  43   3.611   3.108  -3.803
  283   2HG2  THR  43          2HG2      THR  43   4.724   3.670  -2.555
  284   3HG2  THR  43          3HG2      THR  43   3.147   3.021  -2.103
  285    H    THR  44           H        THR  44  -0.285   5.848  -1.483
  286    HA   THR  44           HA       THR  44   0.127   8.740  -1.459
  287    HB   THR  44           HB       THR  44  -2.009   8.970  -2.796
  288    HG1  THR  44           1HG      THR  44  -3.050   7.241  -3.298
  289   1HG2  THR  44          1HG2      THR  44  -0.085   7.484  -4.516
  290   2HG2  THR  44          2HG2      THR  44  -1.011   8.945  -4.859
  291   3HG2  THR  44          3HG2      THR  44   0.390   9.019  -3.789
  292    H    ALA  45           H        ALA  45  -1.571   9.867  -0.292
  293    HA   ALA  45           HA       ALA  45  -2.398   8.529   2.044
  294   1HB   ALA  45          1HB       ALA  45  -2.066  11.066   1.589
  295   2HB   ALA  45          2HB       ALA  45  -3.764  11.019   1.107
  296   3HB   ALA  45          3HB       ALA  45  -3.297  10.542   2.738
  297    H    ASN  46           H        ASN  46  -4.176   9.405  -0.899
  298    HA   ASN  46           HA       ASN  46  -6.328   7.618   0.016
  299   1HB   ASN  46          1HB       ASN  46  -7.072   9.986  -0.145
  300   2HB   ASN  46          2HB       ASN  46  -6.611   9.991  -1.849
  301   1HD2  ASN  46          1HD2      ASN  46 -10.159   8.621  -0.665
  302   2HD2  ASN  46          2HD2      ASN  46  -9.007   9.316   0.413
  303    H    TYR  47           H        TYR  47  -5.998   5.759  -0.984
  304    HA   TYR  47           HA       TYR  47  -4.734   5.594  -3.547
  305   1HB   TYR  47          1HB       TYR  47  -4.473   3.894  -1.716
  306   2HB   TYR  47          2HB       TYR  47  -6.133   3.392  -2.023
  307    HD1  TYR  47           1HD      TYR  47  -6.694   2.478  -4.350
  308    HD2  TYR  47           2HD      TYR  47  -2.713   3.038  -2.971
  309    HE1  TYR  47           1HE      TYR  47  -5.874   0.932  -6.074
  310    HE2  TYR  47           2HE      TYR  47  -1.898   1.494  -4.688
  311    HH   TYR  47           HH       TYR  47  -3.991  -0.493  -6.503
  312    H    ASP  48           H        ASP  48  -8.019   5.502  -2.348
  313    HA   ASP  48           HA       ASP  48  -9.430   4.346  -4.382
  314   1HB   ASP  48          1HB       ASP  48 -10.065   6.713  -2.642
  315   2HB   ASP  48          2HB       ASP  48 -11.215   6.135  -3.839
  316    H    ASP  49           H        ASP  49  -8.028   7.561  -4.312
  317    HA   ASP  49           HA       ASP  49  -9.133   8.174  -6.937
  318   1HB   ASP  49          1HB       ASP  49  -7.895   9.785  -4.742
  319   2HB   ASP  49          2HB       ASP  49  -7.934  10.429  -6.383
  320    H    ASP  50           H        ASP  50  -5.924   8.438  -5.377
  321    HA   ASP  50           HA       ASP  50  -4.605   8.873  -7.862
  322   1HB   ASP  50          1HB       ASP  50  -3.519   8.274  -5.115
  323   2HB   ASP  50          2HB       ASP  50  -2.514   8.670  -6.507
  324    H    ARG  51           H        ARG  51  -5.264   5.967  -6.064
  325    HA   ARG  51           HA       ARG  51  -4.626   3.819  -6.293
  326   1HB   ARG  51          1HB       ARG  51  -4.961   4.545  -9.182
  327   2HB   ARG  51          2HB       ARG  51  -5.090   2.927  -8.492
  328   1HG   ARG  51          1HG       ARG  51  -6.765   4.384  -6.917
  329   2HG   ARG  51          2HG       ARG  51  -7.012   5.111  -8.511
  330   1HD   ARG  51          1HD       ARG  51  -7.118   2.167  -7.957
  331   2HD   ARG  51          2HD       ARG  51  -8.526   3.223  -7.931
  332    HE   ARG  51           HE       ARG  51  -7.078   3.433 -10.389
  333   1HH1  ARG  51          1HH1      ARG  51  -9.451   1.593  -8.613
  334   2HH1  ARG  51          2HH1      ARG  51 -10.164   0.879 -10.021
  335   1HH2  ARG  51          1HH2      ARG  51  -8.058   2.538 -12.280
  336   2HH2  ARG  51          2HH2      ARG  51  -9.381   1.419 -12.105
  337    H    LYS  52           H        LYS  52  -2.321   5.031  -5.765
  338    HA   LYS  52           HA       LYS  52  -0.446   3.718  -7.592
  339   1HB   LYS  52          1HB       LYS  52  -0.154   6.253  -6.011
  340   2HB   LYS  52          2HB       LYS  52   1.269   5.319  -6.460
  341   1HG   LYS  52          1HG       LYS  52   0.669   5.506  -8.809
  342   2HG   LYS  52          2HG       LYS  52  -0.780   6.402  -8.382
  343   1HD   LYS  52          1HD       LYS  52   0.595   8.189  -7.437
  344   2HD   LYS  52          2HD       LYS  52   2.052   7.285  -7.846
  345   1HE   LYS  52          1HE       LYS  52   0.011   8.374  -9.780
  346   2HE   LYS  52          2HE       LYS  52   1.638   8.998  -9.512
  347   1HZ   LYS  52          1HZ       LYS  52   1.011   6.281 -10.565
  348   2HZ   LYS  52          2HZ       LYS  52   1.487   7.612 -11.511
  349   3HZ   LYS  52          3HZ       LYS  52   2.560   6.951 -10.372
  350    H    TRP  53           H        TRP  53   0.438   1.975  -6.779
  351    HA   TRP  53           HA       TRP  53   0.562   1.703  -3.852
  352   1HB   TRP  53          1HB       TRP  53  -0.183  -0.575  -4.107
  353   2HB   TRP  53          2HB       TRP  53  -1.308   0.502  -4.834
  354    HD1  TRP  53           HD1      TRP  53  -0.862   0.751  -7.719
  355    HE1  TRP  53           1HE      TRP  53  -0.441  -1.232  -9.318
  356    HE3  TRP  53           3HE      TRP  53   0.629  -2.592  -4.291
  357    HZ2  TRP  53           2HZ      TRP  53   0.451  -3.935  -9.097
  358    HZ3  TRP  53           3HZ      TRP  53   1.276  -4.886  -5.013
  359    HH2  TRP  53           HH2      TRP  53   1.187  -5.532  -7.373
  360    H    GLY  54           H        GLY  54   1.785  -0.222  -3.188
  361   1HA   GLY  54          1HA       GLY  54   4.045  -1.123  -4.723
  362   2HA   GLY  54          2HA       GLY  54   4.480   0.026  -3.459
  363    H    PHE  55           H        PHE  55   4.948  -2.976  -3.748
  364    HA   PHE  55           HA       PHE  55   3.379  -4.379  -1.910
  365   1HB   PHE  55          1HB       PHE  55   6.167  -4.748  -2.955
  366   2HB   PHE  55          2HB       PHE  55   5.517  -5.829  -1.740
  367    HD1  PHE  55           1HD      PHE  55   2.706  -5.067  -3.468
  368    HD2  PHE  55           2HD      PHE  55   6.408  -7.085  -4.050
  369    HE1  PHE  55           1HE      PHE  55   1.675  -6.456  -5.225
  370    HE2  PHE  55           2HE      PHE  55   5.376  -8.481  -5.801
  371    HZ   PHE  55           HZ       PHE  55   3.009  -8.148  -6.405
  372    H    CYS  56           H        CYS  56   3.875  -5.122   0.197
  373    HA   CYS  56           HA       CYS  56   4.687  -3.103   2.014
  374   1HB   CYS  56          1HB       CYS  56   3.011  -4.997   2.409
  375   2HB   CYS  56          2HB       CYS  56   4.405  -6.053   2.593
  376    HA   PRO  57           HA       PRO  57   9.011  -4.204   1.628
  377   1HB   PRO  57          1HB       PRO  57  10.087  -2.002   2.546
  378   2HB   PRO  57          2HB       PRO  57   9.173  -1.972   1.025
  379   1HG   PRO  57          1HG       PRO  57   8.234  -1.334   3.790
  380   2HG   PRO  57          2HG       PRO  57   8.089  -0.315   2.343
  381   1HD   PRO  57          1HD       PRO  57   6.075  -1.903   3.225
  382   2HD   PRO  57          2HD       PRO  57   6.347  -1.601   1.493
  383    H    ASP  58           H        ASP  58   7.240  -4.249   4.227
  384    HA   ASP  58           HA       ASP  58   9.418  -5.243   5.899
  385   1HB   ASP  58          1HB       ASP  58   8.855  -2.782   6.448
  386   2HB   ASP  58          2HB       ASP  58   7.368  -3.424   7.141
  387    H    GLN  59           H        GLN  59   8.666  -7.320   5.684
  388    HA   GLN  59           HA       GLN  59   6.042  -7.870   6.915
  389   1HB   GLN  59          1HB       GLN  59   7.366  -9.393   4.661
  390   2HB   GLN  59          2HB       GLN  59   5.848  -9.830   5.434
  391   1HG   GLN  59          1HG       GLN  59   4.901  -7.684   4.667
  392   2HG   GLN  59          2HG       GLN  59   6.407  -7.359   3.810
  393   1HE2  GLN  59          1HE2      GLN  59   3.562  -9.552   2.115
  394   2HE2  GLN  59          2HE2      GLN  59   3.358  -8.620   3.559
  395    H    GLY  60           H        GLY  60   8.759  -7.760   8.094
  396   1HA   GLY  60          1HA       GLY  60   8.577 -10.187   9.602
  397   2HA   GLY  60          2HA       GLY  60   9.962 -10.188   8.517
  Start of MODEL   40
    1    H    SER   1           1H       SER   1  10.393  10.024   6.344
    2    HA   SER   1           HA       SER   1  11.589   8.317   7.035
    3   1HB   SER   1          1HB       SER   1   9.553   6.950   5.250
    4   2HB   SER   1          2HB       SER   1  10.311   6.260   6.686
    5    HG   SER   1           HG       SER   1   9.158   7.603   7.974
    6    H    TRP   2           H        TRP   2  13.345   7.010   6.682
    7    HA   TRP   2           HA       TRP   2  14.449   7.024   4.001
    8   1HB   TRP   2          1HB       TRP   2  15.617   5.822   6.519
    9   2HB   TRP   2          2HB       TRP   2  16.476   6.159   5.021
   10    HD1  TRP   2           HD1      TRP   2  15.883   9.075   4.396
   11    HE1  TRP   2           1HE      TRP   2  16.531  10.993   5.995
   12    HE3  TRP   2           3HE      TRP   2  16.281   6.409   8.728
   13    HZ2  TRP   2           2HZ      TRP   2  17.138  11.314   8.733
   14    HZ3  TRP   2           3HZ      TRP   2  16.906   7.589  10.789
   15    HH2  TRP   2           HH2      TRP   2  17.327   9.990  10.791
   16    H    MET   3           H        MET   3  12.372   5.543   3.576
   17    HA   MET   3           HA       MET   3  13.415   2.852   3.293
   18   1HB   MET   3          1HB       MET   3  11.115   2.006   3.948
   19   2HB   MET   3          2HB       MET   3  12.147   2.536   5.258
   20   1HG   MET   3          1HG       MET   3  10.946   4.718   5.204
   21   2HG   MET   3          2HG       MET   3   9.838   4.010   4.033
   22   1HE   MET   3          1HE       MET   3  11.297   3.839   7.606
   23   2HE   MET   3          2HE       MET   3  10.266   2.670   8.423
   24   3HE   MET   3          3HE       MET   3  11.429   2.121   7.216
   25    H    SER   4           H        SER   4  11.958   1.570   1.813
   26    HA   SER   4           HA       SER   4  10.398   3.222  -0.007
   27   1HB   SER   4          1HB       SER   4  12.733   1.535  -0.949
   28   2HB   SER   4          2HB       SER   4  11.594   2.390  -1.989
   29    HG   SER   4           HG       SER   4  12.412   4.238  -0.417
   30    H    THR   5           H        THR   5   9.718   1.554  -1.933
   31    HA   THR   5           HA       THR   5   8.654  -0.783  -0.502
   32    HB   THR   5           HB       THR   5   6.898  -0.591  -2.439
   33    HG1  THR   5           1HG      THR   5   7.560   2.138  -2.200
   34   1HG2  THR   5          1HG2      THR   5   5.783   1.374  -1.054
   35   2HG2  THR   5          2HG2      THR   5   5.840  -0.292  -0.482
   36   3HG2  THR   5          3HG2      THR   5   7.017   0.884   0.108
   37    H    VAL   6           H        VAL   6   7.769  -2.388  -2.192
   38    HA   VAL   6           HA       VAL   6   9.664  -2.906  -4.347
   39    HB   VAL   6           HB       VAL   6  10.471  -4.569  -3.025
   40   1HG1  VAL   6          1HG1      VAL   6   8.014  -4.161  -1.402
   41   2HG1  VAL   6          2HG1      VAL   6   8.943  -5.646  -1.180
   42   3HG1  VAL   6          3HG1      VAL   6   9.710  -4.078  -0.924
   43   1HG2  VAL   6          1HG2      VAL   6   7.862  -5.758  -3.878
   44   2HG2  VAL   6          2HG2      VAL   6   9.461  -5.977  -4.595
   45   3HG2  VAL   6          3HG2      VAL   6   9.089  -6.692  -3.027
   46    H    GLY   7           H        GLY   7   8.452  -4.410  -5.999
   47   1HA   GLY   7          1HA       GLY   7   6.419  -4.944  -7.087
   48   2HA   GLY   7          2HA       GLY   7   5.634  -4.668  -5.565
   49    H    GLY   8           H        GLY   8   3.938  -3.595  -6.462
   50   1HA   GLY   8          1HA       GLY   8   2.747  -1.849  -7.341
   51   2HA   GLY   8          2HA       GLY   8   3.775  -0.937  -6.264
   52    H    ASN   9           H        ASN   9   4.005   0.884  -7.374
   53    HA   ASN   9           HA       ASN   9   5.776   0.912  -9.636
   54   1HB   ASN   9          1HB       ASN   9   4.126   2.481 -10.932
   55   2HB   ASN   9          2HB       ASN   9   3.984   0.748 -11.097
   56   1HD2  ASN   9          1HD2      ASN   9   1.190   1.924  -8.488
   57   2HD2  ASN   9          2HD2      ASN   9   2.882   1.928  -8.147
   58    H    SER  10           H        SER  10   5.975   1.802  -7.044
   59    HA   SER  10           HA       SER  10   5.386   4.589  -6.822
   60   1HB   SER  10          1HB       SER  10   7.194   4.057  -4.856
   61   2HB   SER  10          2HB       SER  10   5.462   3.748  -4.715
   62    HG   SER  10           HG       SER  10   6.732   1.899  -4.187
   63    H    GLY  11           H        GLY  11   8.570   3.046  -6.406
   64   1HA   GLY  11          1HA       GLY  11  10.473   3.546  -7.801
   65   2HA   GLY  11          2HA       GLY  11   9.706   5.070  -8.226
   66    H    GLY  12           H        GLY  12  10.687   3.365  -5.252
   67   1HA   GLY  12          1HA       GLY  12  12.194   4.075  -3.621
   68   2HA   GLY  12          2HA       GLY  12  12.387   5.593  -4.483
   69    H    ALA  13           H        ALA  13   9.159   4.574  -3.930
   70    HA   ALA  13           HA       ALA  13   8.911   6.669  -1.893
   71   1HB   ALA  13          1HB       ALA  13   7.547   6.972  -3.903
   72   2HB   ALA  13          2HB       ALA  13   6.753   5.427  -3.585
   73   3HB   ALA  13          3HB       ALA  13   6.552   6.765  -2.459
   74    HA   PRO  14           HA       PRO  14   7.895   3.513   1.056
   75   1HB   PRO  14          1HB       PRO  14   7.406   5.151   3.143
   76   2HB   PRO  14          2HB       PRO  14   9.036   4.878   2.522
   77   1HG   PRO  14          1HG       PRO  14   7.274   7.237   2.236
   78   2HG   PRO  14          2HG       PRO  14   9.041   7.146   2.228
   79   1HD   PRO  14          1HD       PRO  14   7.322   7.347  -0.019
   80   2HD   PRO  14          2HD       PRO  14   9.073   7.070  -0.034
   81    H    CYS  15           H        CYS  15   6.079   2.893   2.467
   82    HA   CYS  15           HA       CYS  15   3.564   3.345   1.183
   83   1HB   CYS  15          1HB       CYS  15   3.719   2.159   3.925
   84   2HB   CYS  15          2HB       CYS  15   2.719   1.682   2.560
   85    H    VAL  16           H        VAL  16   1.890   4.692   1.812
   86    HA   VAL  16           HA       VAL  16   2.471   6.497   4.060
   87    HB   VAL  16           HB       VAL  16   0.582   6.941   1.747
   88   1HG1  VAL  16          1HG1      VAL  16   1.322   8.616   4.106
   89   2HG1  VAL  16          2HG1      VAL  16   0.817   9.366   2.592
   90   3HG1  VAL  16          3HG1      VAL  16  -0.272   8.266   3.436
   91   1HG2  VAL  16          1HG2      VAL  16   3.089   6.893   1.256
   92   2HG2  VAL  16          2HG2      VAL  16   2.172   8.303   0.726
   93   3HG2  VAL  16          3HG2      VAL  16   3.162   8.394   2.182
   94    H    PHE  17           H        PHE  17   1.573   5.401   5.796
   95    HA   PHE  17           HA       PHE  17  -1.217   4.633   5.568
   96   1HB   PHE  17          1HB       PHE  17   0.401   4.203   8.039
   97   2HB   PHE  17          2HB       PHE  17  -1.024   3.360   7.494
   98    HD1  PHE  17           1HD      PHE  17  -0.767   1.970   5.335
   99    HD2  PHE  17           2HD      PHE  17   2.444   3.219   7.805
  100    HE1  PHE  17           1HE      PHE  17   0.596   0.112   4.481
  101    HE2  PHE  17           2HE      PHE  17   3.837   1.372   6.953
  102    HZ   PHE  17           HZ       PHE  17   2.922  -0.211   5.279
  103    HA   PRO  18           HA       PRO  18  -2.701   4.104   6.842
  104   1HB   PRO  18          1HB       PRO  18  -5.255   5.314   7.085
  105   2HB   PRO  18          2HB       PRO  18  -4.468   4.237   8.237
  106   1HG   PRO  18          1HG       PRO  18  -5.035   6.935   8.665
  107   2HG   PRO  18          2HG       PRO  18  -3.890   5.963   9.606
  108   1HD   PRO  18          1HD       PRO  18  -3.378   7.908   7.399
  109   2HD   PRO  18          2HD       PRO  18  -2.394   7.543   8.836
  110    H    PHE  19           H        PHE  19  -3.131   3.474   4.738
  111    HA   PHE  19           HA       PHE  19  -3.771   5.638   2.868
  112   1HB   PHE  19          1HB       PHE  19  -3.793   3.765   1.101
  113   2HB   PHE  19          2HB       PHE  19  -2.258   4.285   1.749
  114    HD1  PHE  19           1HD      PHE  19  -1.381   2.771   3.778
  115    HD2  PHE  19           2HD      PHE  19  -4.211   1.585   0.839
  116    HE1  PHE  19           1HE      PHE  19  -0.813   0.406   4.170
  117    HE2  PHE  19           2HE      PHE  19  -3.646  -0.773   1.222
  118    HZ   PHE  19           HZ       PHE  19  -1.938  -1.364   2.901
  119    H    THR  20           H        THR  20  -5.384   4.063   1.047
  120    HA   THR  20           HA       THR  20  -7.645   3.449   2.759
  121    HB   THR  20           HB       THR  20  -8.102   5.363   0.476
  122    HG1  THR  20           1HG      THR  20  -6.848   5.873   2.864
  123   1HG2  THR  20          1HG2      THR  20  -9.901   6.113   2.154
  124   2HG2  THR  20          2HG2      THR  20 -10.148   4.626   1.241
  125   3HG2  THR  20          3HG2      THR  20  -9.611   4.550   2.919
  126    H    PHE  21           H        PHE  21  -8.553   1.809   2.292
  127    HA   PHE  21           HA       PHE  21  -9.190   1.120  -0.321
  128   1HB   PHE  21          1HB       PHE  21  -7.505  -0.583   1.120
  129   2HB   PHE  21          2HB       PHE  21  -8.949  -1.404   0.651
  130    HD1  PHE  21           1HD      PHE  21  -6.837  -2.613  -0.338
  131    HD2  PHE  21           2HD      PHE  21  -8.497   1.013  -1.744
  132    HE1  PHE  21           1HE      PHE  21  -6.244  -3.276  -2.598
  133    HE2  PHE  21           2HE      PHE  21  -7.846   0.413  -4.019
  134    HZ   PHE  21           HZ       PHE  21  -6.691  -1.716  -4.480
  135    H    LEU  22           H        LEU  22 -10.738   0.561  -0.936
  136    HA   LEU  22           HA       LEU  22 -12.968   0.708  -1.069
  137   1HB   LEU  22          1HB       LEU  22 -12.479  -2.020  -0.068
  138   2HB   LEU  22          2HB       LEU  22 -13.538  -1.560  -1.372
  139    HG   LEU  22           HG       LEU  22 -11.762  -2.459  -2.579
  140   1HD1  LEU  22          1HD1      LEU  22 -11.550   0.332  -2.453
  141   2HD1  LEU  22          2HD1      LEU  22  -9.953  -0.391  -2.641
  142   3HD1  LEU  22          3HD1      LEU  22 -11.233  -0.771  -3.794
  143   1HD2  LEU  22          1HD2      LEU  22 -10.376  -2.069  -0.100
  144   2HD2  LEU  22          2HD2      LEU  22 -10.366  -3.423  -1.230
  145   3HD2  LEU  22          3HD2      LEU  22  -9.375  -1.998  -1.551
  146    H    GLY  23           H        GLY  23 -12.726   2.111   1.055
  147   1HA   GLY  23          1HA       GLY  23 -14.448   2.822   2.543
  148   2HA   GLY  23          2HA       GLY  23 -14.909   1.147   2.758
  149    H    ASN  24           H        ASN  24 -11.622   1.025   3.113
  150    HA   ASN  24           HA       ASN  24 -11.843   1.633   5.982
  151   1HB   ASN  24          1HB       ASN  24 -10.153  -0.575   4.886
  152   2HB   ASN  24          2HB       ASN  24 -10.793  -0.395   6.496
  153   1HD2  ASN  24          1HD2      ASN  24 -12.654  -2.662   3.878
  154   2HD2  ASN  24          2HD2      ASN  24 -11.032  -2.075   3.733
  155    H    LYS  25           H        LYS  25 -10.105   2.551   6.992
  156    HA   LYS  25           HA       LYS  25  -8.069   3.730   5.347
  157   1HB   LYS  25          1HB       LYS  25  -8.062   3.796   8.341
  158   2HB   LYS  25          2HB       LYS  25  -7.629   5.035   7.191
  159   1HG   LYS  25          1HG       LYS  25 -10.466   4.162   7.557
  160   2HG   LYS  25          2HG       LYS  25  -9.729   5.426   8.545
  161   1HD   LYS  25          1HD       LYS  25  -9.491   5.625   5.579
  162   2HD   LYS  25          2HD       LYS  25 -11.046   6.004   6.322
  163   1HE   LYS  25          1HE       LYS  25  -9.505   7.959   5.967
  164   2HE   LYS  25          2HE       LYS  25 -10.094   7.757   7.614
  165   1HZ   LYS  25          1HZ       LYS  25  -7.870   6.428   7.865
  166   2HZ   LYS  25          2HZ       LYS  25  -7.387   7.376   6.541
  167   3HZ   LYS  25          3HZ       LYS  25  -7.888   8.120   7.986
  168    H    TYR  26           H        TYR  26  -6.202   2.604   4.892
  169    HA   TYR  26           HA       TYR  26  -5.662   0.315   6.606
  170   1HB   TYR  26          1HB       TYR  26  -4.744   1.036   3.839
  171   2HB   TYR  26          2HB       TYR  26  -4.100  -0.336   4.747
  172    HD1  TYR  26           1HD      TYR  26  -7.299  -0.043   5.892
  173    HD2  TYR  26           2HD      TYR  26  -5.266  -1.200   2.347
  174    HE1  TYR  26           1HE      TYR  26  -9.182  -1.433   5.300
  175    HE2  TYR  26           2HE      TYR  26  -7.161  -2.607   1.749
  176    HH   TYR  26           HH       TYR  26  -9.138  -3.854   3.424
  177    H    GLU  27           H        GLU  27  -4.751   1.017   8.289
  178    HA   GLU  27           HA       GLU  27  -2.616   2.906   8.361
  179   1HB   GLU  27          1HB       GLU  27  -3.543   1.110  10.577
  180   2HB   GLU  27          2HB       GLU  27  -2.751   2.658  10.708
  181   1HG   GLU  27          1HG       GLU  27  -4.738   3.704   9.634
  182   2HG   GLU  27          2HG       GLU  27  -5.542   2.139   9.749
  183    H    SER  28           H        SER  28  -2.783  -0.395   7.816
  184    HA   SER  28           HA       SER  28   0.103  -0.660   8.193
  185   1HB   SER  28          1HB       SER  28  -0.489  -3.108   8.766
  186   2HB   SER  28          2HB       SER  28  -0.745  -1.909  10.025
  187    HG   SER  28           HG       SER  28  -2.680  -2.743  10.052
  188    H    CYS  29           H        CYS  29   0.663  -2.898   6.919
  189    HA   CYS  29           HA       CYS  29  -0.095  -2.376   4.249
  190   1HB   CYS  29          1HB       CYS  29   1.182  -4.837   5.448
  191   2HB   CYS  29          2HB       CYS  29   0.977  -4.575   3.735
  192    H    THR  30           H        THR  30  -1.175  -4.012   2.878
  193    HA   THR  30           HA       THR  30  -3.211  -5.597   4.261
  194    HB   THR  30           HB       THR  30  -4.272  -3.371   3.778
  195    HG1  THR  30           1HG      THR  30  -5.729  -4.974   3.681
  196   1HG2  THR  30          1HG2      THR  30  -4.344  -3.869   0.888
  197   2HG2  THR  30          2HG2      THR  30  -4.220  -2.355   1.783
  198   3HG2  THR  30          3HG2      THR  30  -2.782  -3.336   1.508
  199    H    SER  31           H        SER  31  -4.560  -6.721   2.456
  200    HA   SER  31           HA       SER  31  -2.771  -7.562   0.289
  201   1HB   SER  31          1HB       SER  31  -3.709  -9.880   0.580
  202   2HB   SER  31          2HB       SER  31  -2.712  -9.329   1.934
  203    HG   SER  31           HG       SER  31  -5.364 -10.011   1.865
  204    H    ALA  32           H        ALA  32  -5.245  -5.812   0.955
  205    HA   ALA  32           HA       ALA  32  -7.484  -6.722  -0.477
  206   1HB   ALA  32          1HB       ALA  32  -6.507  -4.110   0.539
  207   2HB   ALA  32          2HB       ALA  32  -7.684  -4.045  -0.771
  208   3HB   ALA  32          3HB       ALA  32  -8.086  -4.873   0.735
  209    H    GLY  33           H        GLY  33  -8.178  -6.324  -2.595
  210   1HA   GLY  33          1HA       GLY  33  -7.969  -5.816  -4.840
  211   2HA   GLY  33          2HA       GLY  33  -6.558  -4.840  -4.438
  212    H    ARG  34           H        ARG  34  -5.695  -7.568  -3.019
  213    HA   ARG  34           HA       ARG  34  -4.460  -8.667  -5.448
  214   1HB   ARG  34          1HB       ARG  34  -3.478  -8.748  -2.590
  215   2HB   ARG  34          2HB       ARG  34  -2.684  -9.492  -3.957
  216   1HG   ARG  34          1HG       ARG  34  -2.806  -6.987  -4.863
  217   2HG   ARG  34          2HG       ARG  34  -2.775  -6.673  -3.123
  218   1HD   ARG  34          1HD       ARG  34  -0.509  -6.741  -4.132
  219   2HD   ARG  34          2HD       ARG  34  -0.739  -7.972  -2.886
  220    HE   ARG  34           HE       ARG  34  -0.463  -9.595  -4.461
  221   1HH1  ARG  34          1HH1      ARG  34  -1.110  -6.551  -6.077
  222   2HH1  ARG  34          2HH1      ARG  34  -0.795  -7.189  -7.664
  223   1HH2  ARG  34          1HH2      ARG  34  -0.064 -10.433  -6.539
  224   2HH2  ARG  34          2HH2      ARG  34  -0.217  -9.398  -7.925
  225    H    SER  35           H        SER  35  -4.649 -10.031  -2.212
  226    HA   SER  35           HA       SER  35  -5.414 -12.001  -1.385
  227   1HB   SER  35          1HB       SER  35  -7.332 -12.004  -3.736
  228   2HB   SER  35          2HB       SER  35  -7.489 -12.929  -2.242
  229    HG   SER  35           HG       SER  35  -7.345 -10.647  -1.271
  230    H    ASP  36           H        ASP  36  -3.277 -11.827  -3.333
  231    HA   ASP  36           HA       ASP  36  -3.427 -14.441  -4.627
  232   1HB   ASP  36          1HB       ASP  36  -2.118 -13.604  -6.312
  233   2HB   ASP  36          2HB       ASP  36  -2.951 -12.153  -5.809
  234    H    GLY  37           H        GLY  37  -1.723 -12.498  -2.389
  235   1HA   GLY  37          1HA       GLY  37  -0.724 -14.300  -0.714
  236   2HA   GLY  37          2HA       GLY  37   0.424 -14.433  -2.036
  237    H    LYS  38           H        LYS  38   1.245 -12.154  -2.775
  238    HA   LYS  38           HA       LYS  38   2.724 -11.084  -0.646
  239   1HB   LYS  38          1HB       LYS  38   2.200  -9.725  -3.281
  240   2HB   LYS  38          2HB       LYS  38   3.625  -9.576  -2.260
  241   1HG   LYS  38          1HG       LYS  38   4.430 -10.976  -3.841
  242   2HG   LYS  38          2HG       LYS  38   3.807 -12.162  -2.705
  243   1HD   LYS  38          1HD       LYS  38   1.689 -12.191  -4.058
  244   2HD   LYS  38          2HD       LYS  38   2.519 -11.182  -5.248
  245   1HE   LYS  38          1HE       LYS  38   4.207 -12.920  -5.551
  246   2HE   LYS  38          2HE       LYS  38   3.409 -13.921  -4.335
  247   1HZ   LYS  38          1HZ       LYS  38   1.432 -13.301  -6.119
  248   2HZ   LYS  38          2HZ       LYS  38   2.792 -13.592  -7.103
  249   3HZ   LYS  38          3HZ       LYS  38   2.259 -14.780  -6.007
  250    H    MET  39           H        MET  39   2.252  -9.545   0.809
  251    HA   MET  39           HA       MET  39  -0.199  -8.029   0.494
  252   1HB   MET  39          1HB       MET  39   1.831  -7.897   2.734
  253   2HB   MET  39          2HB       MET  39   0.204  -7.241   2.740
  254   1HG   MET  39          1HG       MET  39  -0.692  -9.530   2.576
  255   2HG   MET  39          2HG       MET  39   0.957 -10.145   2.685
  256   1HE   MET  39          1HE       MET  39   2.528  -9.111   4.313
  257   2HE   MET  39          2HE       MET  39   2.026  -7.988   5.581
  258   3HE   MET  39          3HE       MET  39   2.228  -9.703   5.946
  259    H    TRP  40           H        TRP  40  -0.186  -5.693   0.553
  260    HA   TRP  40           HA       TRP  40   2.384  -4.493  -0.243
  261   1HB   TRP  40          1HB       TRP  40   1.149  -3.136  -1.929
  262   2HB   TRP  40          2HB       TRP  40   1.099  -4.863  -2.297
  263    HD1  TRP  40           HD1      TRP  40  -1.304  -6.119  -1.416
  264    HE1  TRP  40           1HE      TRP  40  -3.684  -5.179  -1.369
  265    HE3  TRP  40           3HE      TRP  40  -0.232  -1.140  -1.849
  266    HZ2  TRP  40           2HZ      TRP  40  -4.935  -2.700  -1.451
  267    HZ3  TRP  40           3HZ      TRP  40  -2.117   0.466  -1.816
  268    HH2  TRP  40           HH2      TRP  40  -4.439  -0.315  -1.614
  269    H    CYS  41           H        CYS  41   1.747  -1.975  -0.570
  270    HA   CYS  41           HA       CYS  41   0.042  -0.924   1.502
  271   1HB   CYS  41          1HB       CYS  41   1.954   0.452   2.444
  272   2HB   CYS  41          2HB       CYS  41   1.974  -1.258   2.875
  273    H    ALA  42           H        ALA  42  -0.722   1.044   0.843
  274    HA   ALA  42           HA       ALA  42  -0.025   1.888  -1.797
  275   1HB   ALA  42          1HB       ALA  42  -2.312   2.114  -0.616
  276   2HB   ALA  42          2HB       ALA  42  -1.629   3.586   0.078
  277   3HB   ALA  42          3HB       ALA  42  -1.767   3.418  -1.673
  278    H    THR  43           H        THR  43   0.916   3.828  -2.437
  279    HA   THR  43           HA       THR  43   2.761   4.923  -0.445
  280    HB   THR  43           HB       THR  43   4.100   5.639  -2.362
  281    HG1  THR  43           1HG      THR  43   2.766   6.079  -4.003
  282   1HG2  THR  43          1HG2      THR  43   4.045   3.198  -3.542
  283   2HG2  THR  43          2HG2      THR  43   4.895   3.567  -2.041
  284   3HG2  THR  43          3HG2      THR  43   3.286   2.850  -1.989
  285    H    THR  44           H        THR  44  -0.156   5.521  -1.081
  286    HA   THR  44           HA       THR  44   0.110   8.426  -0.981
  287    HB   THR  44           HB       THR  44  -1.974   8.616  -2.369
  288    HG1  THR  44           1HG      THR  44  -2.981   6.838  -2.776
  289   1HG2  THR  44          1HG2      THR  44   0.013   7.198  -4.074
  290   2HG2  THR  44          2HG2      THR  44  -0.921   8.658  -4.401
  291   3HG2  THR  44          3HG2      THR  44   0.452   8.718  -3.296
  292    H    ALA  45           H        ALA  45  -1.319   9.404   0.421
  293    HA   ALA  45           HA       ALA  45  -2.276   8.019   2.609
  294   1HB   ALA  45          1HB       ALA  45  -2.104  10.651   1.915
  295   2HB   ALA  45          2HB       ALA  45  -3.852  10.404   1.992
  296   3HB   ALA  45          3HB       ALA  45  -2.846  10.036   3.393
  297    H    ASN  46           H        ASN  46  -3.870   8.601  -0.436
  298    HA   ASN  46           HA       ASN  46  -6.118   6.938   0.461
  299   1HB   ASN  46          1HB       ASN  46  -6.696   9.428   0.144
  300   2HB   ASN  46          2HB       ASN  46  -6.434   9.145  -1.574
  301   1HD2  ASN  46          1HD2      ASN  46  -9.940   8.416  -0.030
  302   2HD2  ASN  46          2HD2      ASN  46  -8.728   9.463   0.605
  303    H    TYR  47           H        TYR  47  -6.105   5.123  -0.691
  304    HA   TYR  47           HA       TYR  47  -4.526   5.015  -3.093
  305   1HB   TYR  47          1HB       TYR  47  -4.358   3.226  -1.370
  306   2HB   TYR  47          2HB       TYR  47  -5.989   2.716  -1.806
  307    HD1  TYR  47           1HD      TYR  47  -6.424   1.652  -3.970
  308    HD2  TYR  47           2HD      TYR  47  -2.506   2.860  -2.856
  309    HE1  TYR  47           1HE      TYR  47  -5.487   0.310  -5.802
  310    HE2  TYR  47           2HE      TYR  47  -1.564   1.522  -4.674
  311    HH   TYR  47           HH       TYR  47  -3.186   0.487  -7.219
  312    H    ASP  48           H        ASP  48  -7.939   4.201  -2.272
  313    HA   ASP  48           HA       ASP  48  -8.885   3.454  -4.706
  314   1HB   ASP  48          1HB       ASP  48 -10.101   5.167  -2.581
  315   2HB   ASP  48          2HB       ASP  48 -10.974   4.904  -4.083
  316    H    ASP  49           H        ASP  49  -7.957   6.705  -3.820
  317    HA   ASP  49           HA       ASP  49  -9.025   7.907  -6.209
  318   1HB   ASP  49          1HB       ASP  49  -7.553   8.896  -3.800
  319   2HB   ASP  49          2HB       ASP  49  -7.663   9.919  -5.229
  320    H    ASP  50           H        ASP  50  -5.670   7.777  -4.899
  321    HA   ASP  50           HA       ASP  50  -4.616   8.521  -7.483
  322   1HB   ASP  50          1HB       ASP  50  -3.371   8.033  -4.801
  323   2HB   ASP  50          2HB       ASP  50  -2.375   8.222  -6.238
  324    H    ARG  51           H        ARG  51  -5.003   5.554  -5.771
  325    HA   ARG  51           HA       ARG  51  -4.373   3.440  -6.122
  326   1HB   ARG  51          1HB       ARG  51  -4.653   4.266  -8.993
  327   2HB   ARG  51          2HB       ARG  51  -4.765   2.624  -8.360
  328   1HG   ARG  51          1HG       ARG  51  -6.495   4.040  -6.780
  329   2HG   ARG  51          2HG       ARG  51  -6.755   4.739  -8.383
  330   1HD   ARG  51          1HD       ARG  51  -6.803   1.799  -7.743
  331   2HD   ARG  51          2HD       ARG  51  -8.233   2.829  -7.827
  332    HE   ARG  51           HE       ARG  51  -6.686   2.967 -10.222
  333   1HH1  ARG  51          1HH1      ARG  51  -8.920   0.919  -8.481
  334   2HH1  ARG  51          2HH1      ARG  51  -9.621   0.238  -9.916
  335   1HH2  ARG  51          1HH2      ARG  51  -7.504   1.989 -12.102
  336   2HH2  ARG  51          2HH2      ARG  51  -8.796   0.832 -11.987
  337    H    LYS  52           H        LYS  52  -2.150   4.796  -5.490
  338    HA   LYS  52           HA       LYS  52  -0.127   3.601  -7.261
  339   1HB   LYS  52          1HB       LYS  52  -0.028   6.090  -5.559
  340   2HB   LYS  52          2HB       LYS  52   1.437   5.287  -6.117
  341   1HG   LYS  52          1HG       LYS  52   1.139   5.930  -8.274
  342   2HG   LYS  52          2HG       LYS  52  -0.619   5.867  -8.158
  343   1HD   LYS  52          1HD       LYS  52   0.075   8.151  -8.466
  344   2HD   LYS  52          2HD       LYS  52  -0.557   7.957  -6.832
  345   1HE   LYS  52          1HE       LYS  52   1.651   7.931  -5.910
  346   2HE   LYS  52          2HE       LYS  52   2.378   7.869  -7.517
  347   1HZ   LYS  52          1HZ       LYS  52   0.738  10.091  -7.499
  348   2HZ   LYS  52          2HZ       LYS  52   1.556  10.130  -6.009
  349   3HZ   LYS  52          3HZ       LYS  52   2.439  10.071  -7.460
  350    H    TRP  53           H        TRP  53   0.647   1.809  -6.449
  351    HA   TRP  53           HA       TRP  53   0.807   1.520  -3.522
  352   1HB   TRP  53          1HB       TRP  53   0.098  -0.771  -3.800
  353   2HB   TRP  53          2HB       TRP  53  -1.052   0.277  -4.545
  354    HD1  TRP  53           HD1      TRP  53  -0.688   0.495  -7.399
  355    HE1  TRP  53           1HE      TRP  53  -0.104  -1.439  -9.012
  356    HE3  TRP  53           3HE      TRP  53   1.117  -2.709  -3.992
  357    HZ2  TRP  53           2HZ      TRP  53   1.009  -4.062  -8.796
  358    HZ3  TRP  53           3HZ      TRP  53   1.942  -4.947  -4.713
  359    HH2  TRP  53           HH2      TRP  53   1.884  -5.591  -7.076
  360    H    GLY  54           H        GLY  54   1.960  -0.513  -2.965
  361   1HA   GLY  54          1HA       GLY  54   4.206  -1.366  -4.499
  362   2HA   GLY  54          2HA       GLY  54   4.667  -0.268  -3.196
  363    H    PHE  55           H        PHE  55   4.912  -3.310  -3.658
  364    HA   PHE  55           HA       PHE  55   3.336  -4.653  -1.800
  365   1HB   PHE  55          1HB       PHE  55   6.052  -5.195  -2.968
  366   2HB   PHE  55          2HB       PHE  55   5.334  -6.270  -1.783
  367    HD1  PHE  55           1HD      PHE  55   2.556  -6.367  -2.547
  368    HD2  PHE  55           2HD      PHE  55   6.020  -6.274  -5.011
  369    HE1  PHE  55           1HE      PHE  55   1.345  -7.626  -4.282
  370    HE2  PHE  55           2HE      PHE  55   4.820  -7.529  -6.749
  371    HZ   PHE  55           HZ       PHE  55   2.477  -8.198  -6.396
  372    H    CYS  56           H        CYS  56   3.778  -5.392   0.301
  373    HA   CYS  56           HA       CYS  56   4.876  -3.450   2.040
  374   1HB   CYS  56          1HB       CYS  56   3.029  -5.232   2.486
  375   2HB   CYS  56          2HB       CYS  56   4.372  -6.316   2.819
  376    HA   PRO  57           HA       PRO  57   9.072  -4.863   1.498
  377   1HB   PRO  57          1HB       PRO  57  10.341  -3.028   2.926
  378   2HB   PRO  57          2HB       PRO  57   9.572  -2.625   1.383
  379   1HG   PRO  57          1HG       PRO  57   8.468  -2.367   4.139
  380   2HG   PRO  57          2HG       PRO  57   8.561  -1.104   2.895
  381   1HD   PRO  57          1HD       PRO  57   6.309  -2.490   3.320
  382   2HD   PRO  57          2HD       PRO  57   6.818  -2.071   1.667
  383    H    ASP  58           H        ASP  58   7.275  -5.270   4.022
  384    HA   ASP  58           HA       ASP  58   9.180  -6.987   5.371
  385   1HB   ASP  58          1HB       ASP  58   9.228  -4.650   6.453
  386   2HB   ASP  58          2HB       ASP  58   7.624  -5.037   7.054
  387    H    GLN  59           H        GLN  59   8.047  -8.825   5.074
  388    HA   GLN  59           HA       GLN  59   5.276  -8.864   6.065
  389   1HB   GLN  59          1HB       GLN  59   6.421 -10.551   3.835
  390   2HB   GLN  59          2HB       GLN  59   4.767 -10.598   4.422
  391   1HG   GLN  59          1HG       GLN  59   4.497  -8.252   3.695
  392   2HG   GLN  59          2HG       GLN  59   6.124  -8.313   3.014
  393   1HE2  GLN  59          1HE2      GLN  59   5.033  -9.635   0.025
  394   2HE2  GLN  59          2HE2      GLN  59   6.203  -8.732   0.925
  395    H    GLY  60           H        GLY  60   5.597  -9.672   8.086
  396   1HA   GLY  60          1HA       GLY  60   5.744 -12.319   8.625
  397   2HA   GLY  60          2HA       GLY  60   7.437 -11.850   8.549
  Start of MODEL   41
    1    H    SER   1           1H       SER   1  17.211   1.670   8.174
    2    HA   SER   1           HA       SER   1  17.789   2.080   5.920
    3   1HB   SER   1          1HB       SER   1  17.843  -0.426   5.391
    4   2HB   SER   1          2HB       SER   1  16.087  -0.336   5.243
    5    HG   SER   1           HG       SER   1  17.950   1.207   3.724
    6    H    TRP   2           H        TRP   2  16.393   3.381   4.665
    7    HA   TRP   2           HA       TRP   2  13.987   4.165   5.995
    8   1HB   TRP   2          1HB       TRP   2  15.481   5.735   4.774
    9   2HB   TRP   2          2HB       TRP   2  15.016   4.961   3.263
   10    HD1  TRP   2           HD1      TRP   2  12.763   6.250   6.168
   11    HE1  TRP   2           1HE      TRP   2  11.048   7.894   5.169
   12    HE3  TRP   2           3HE      TRP   2  14.339   6.203   1.308
   13    HZ2  TRP   2           2HZ      TRP   2  10.432   8.998   2.646
   14    HZ3  TRP   2           3HZ      TRP   2  13.128   7.569  -0.341
   15    HH2  TRP   2           HH2      TRP   2  11.210   8.942   0.318
   16    H    MET   3           H        MET   3  12.039   3.298   5.755
   17    HA   MET   3           HA       MET   3  11.554   1.065   4.164
   18   1HB   MET   3          1HB       MET   3   9.543   2.948   5.409
   19   2HB   MET   3          2HB       MET   3   9.168   1.365   4.748
   20   1HG   MET   3          1HG       MET   3  10.777   0.396   6.411
   21   2HG   MET   3          2HG       MET   3  10.850   1.993   7.157
   22   1HE   MET   3          1HE       MET   3   8.543   3.264   6.978
   23   2HE   MET   3          2HE       MET   3   6.986   2.441   6.922
   24   3HE   MET   3          3HE       MET   3   7.698   2.867   8.478
   25    H    SER   4           H        SER   4  11.870   1.236   2.042
   26    HA   SER   4           HA       SER   4  10.357   3.262   0.546
   27   1HB   SER   4          1HB       SER   4  12.529   1.415  -0.493
   28   2HB   SER   4          2HB       SER   4  11.852   2.830  -1.304
   29    HG   SER   4           HG       SER   4  12.955   3.232   1.220
   30    H    THR   5           H        THR   5   9.884   2.031  -1.828
   31    HA   THR   5           HA       THR   5   8.283  -0.259  -0.959
   32    HB   THR   5           HB       THR   5   7.060   0.326  -3.196
   33    HG1  THR   5           1HG      THR   5   7.492   2.949  -2.680
   34   1HG2  THR   5          1HG2      THR   5   5.930   2.316  -1.775
   35   2HG2  THR   5          2HG2      THR   5   5.582   0.600  -1.543
   36   3HG2  THR   5          3HG2      THR   5   6.746   1.411  -0.499
   37    H    VAL   6           H        VAL   6   7.867  -1.927  -2.391
   38    HA   VAL   6           HA       VAL   6   9.818  -2.449  -4.491
   39    HB   VAL   6           HB       VAL   6  10.700  -3.924  -2.968
   40   1HG1  VAL   6          1HG1      VAL   6   9.329  -3.210  -1.069
   41   2HG1  VAL   6          2HG1      VAL   6   8.011  -4.233  -1.647
   42   3HG1  VAL   6          3HG1      VAL   6   9.514  -4.964  -1.092
   43   1HG2  VAL   6          1HG2      VAL   6   8.445  -5.272  -4.280
   44   2HG2  VAL   6          2HG2      VAL   6  10.174  -5.619  -4.353
   45   3HG2  VAL   6          3HG2      VAL   6   9.225  -6.127  -2.953
   46    H    GLY   7           H        GLY   7   8.735  -4.042  -6.083
   47   1HA   GLY   7          1HA       GLY   7   6.747  -4.729  -7.181
   48   2HA   GLY   7          2HA       GLY   7   5.962  -4.562  -5.640
   49    H    GLY   8           H        GLY   8   4.148  -3.666  -6.704
   50   1HA   GLY   8          1HA       GLY   8   2.834  -1.958  -7.513
   51   2HA   GLY   8          2HA       GLY   8   3.748  -1.022  -6.361
   52    H    ASN   9           H        ASN   9   3.912   0.853  -7.370
   53    HA   ASN   9           HA       ASN   9   5.593   0.975  -9.734
   54   1HB   ASN   9          1HB       ASN   9   4.034   2.798 -10.642
   55   2HB   ASN   9          2HB       ASN   9   3.462   1.143 -10.787
   56   1HD2  ASN   9          1HD2      ASN   9   0.572   3.042  -9.671
   57   2HD2  ASN   9          2HD2      ASN   9   1.567   2.901 -11.073
   58    H    SER  10           H        SER  10   3.857   3.702  -8.757
   59    HA   SER  10           HA       SER  10   4.486   5.747  -8.030
   60   1HB   SER  10          1HB       SER  10   5.288   4.088  -5.668
   61   2HB   SER  10          2HB       SER  10   4.623   5.720  -5.686
   62    HG   SER  10           HG       SER  10   3.350   3.263  -6.160
   63    H    GLY  11           H        GLY  11   6.985   4.159  -9.166
   64   1HA   GLY  11          1HA       GLY  11   9.213   4.649  -9.436
   65   2HA   GLY  11          2HA       GLY  11   8.834   6.244  -8.804
   66    H    GLY  12           H        GLY  12   8.051   3.649  -6.721
   67   1HA   GLY  12          1HA       GLY  12   9.219   2.672  -4.947
   68   2HA   GLY  12          2HA       GLY  12  10.639   3.602  -5.404
   69    H    ALA  13           H        ALA  13   7.528   5.097  -4.943
   70    HA   ALA  13           HA       ALA  13   8.561   6.895  -2.971
   71   1HB   ALA  13          1HB       ALA  13   6.589   7.121  -4.774
   72   2HB   ALA  13          2HB       ALA  13   5.630   6.684  -3.359
   73   3HB   ALA  13          3HB       ALA  13   6.670   8.108  -3.317
   74    HA   PRO  14           HA       PRO  14   7.604   4.725   0.772
   75   1HB   PRO  14          1HB       PRO  14   6.691   7.209   2.013
   76   2HB   PRO  14          2HB       PRO  14   8.123   6.240   2.373
   77   1HG   PRO  14          1HG       PRO  14   8.246   8.682   1.187
   78   2HG   PRO  14          2HG       PRO  14   9.443   7.403   0.902
   79   1HD   PRO  14          1HD       PRO  14   7.179   8.311  -0.820
   80   2HD   PRO  14          2HD       PRO  14   8.797   7.745  -1.280
   81    H    CYS  15           H        CYS  15   5.876   3.871   1.925
   82    HA   CYS  15           HA       CYS  15   3.278   4.308   0.763
   83   1HB   CYS  15          1HB       CYS  15   4.209   2.486   2.997
   84   2HB   CYS  15          2HB       CYS  15   2.549   2.543   2.412
   85    H    VAL  16           H        VAL  16   1.833   5.735   1.443
   86    HA   VAL  16           HA       VAL  16   2.273   7.257   3.859
   87    HB   VAL  16           HB       VAL  16   0.112   7.411   1.747
   88   1HG1  VAL  16          1HG1      VAL  16  -0.488   8.242   4.111
   89   2HG1  VAL  16          2HG1      VAL  16   0.634   9.559   3.766
   90   3HG1  VAL  16          3HG1      VAL  16  -0.775   9.308   2.736
   91   1HG2  VAL  16          1HG2      VAL  16   2.463   8.025   1.106
   92   2HG2  VAL  16          2HG2      VAL  16   1.267   9.303   0.901
   93   3HG2  VAL  16          3HG2      VAL  16   2.365   9.337   2.281
   94    H    PHE  17           H        PHE  17   1.504   6.689   5.773
   95    HA   PHE  17           HA       PHE  17  -0.937   5.069   5.890
   96   1HB   PHE  17          1HB       PHE  17   1.512   5.039   7.650
   97   2HB   PHE  17          2HB       PHE  17  -0.001   4.274   8.093
   98    HD1  PHE  17           1HD      PHE  17  -0.959   2.644   6.151
   99    HD2  PHE  17           2HD      PHE  17   3.100   3.747   6.754
  100    HE1  PHE  17           1HE      PHE  17  -0.231   0.610   4.981
  101    HE2  PHE  17           2HE      PHE  17   3.848   1.724   5.586
  102    HZ   PHE  17           HZ       PHE  17   2.190   0.126   4.678
  103    HA   PRO  18           HA       PRO  18  -2.375   4.530   6.970
  104   1HB   PRO  18          1HB       PRO  18  -4.982   5.417   7.580
  105   2HB   PRO  18          2HB       PRO  18  -3.957   4.390   8.580
  106   1HG   PRO  18          1HG       PRO  18  -4.787   6.994   9.200
  107   2HG   PRO  18          2HG       PRO  18  -3.489   6.092   9.998
  108   1HD   PRO  18          1HD       PRO  18  -3.316   8.186   7.877
  109   2HD   PRO  18          2HD       PRO  18  -2.205   7.850   9.225
  110    H    PHE  19           H        PHE  19  -2.974   4.072   4.910
  111    HA   PHE  19           HA       PHE  19  -4.021   6.306   3.331
  112   1HB   PHE  19          1HB       PHE  19  -3.655   4.913   1.331
  113   2HB   PHE  19          2HB       PHE  19  -2.182   5.175   2.243
  114    HD1  PHE  19           1HD      PHE  19  -1.425   3.260   3.796
  115    HD2  PHE  19           2HD      PHE  19  -4.296   2.812   0.693
  116    HE1  PHE  19           1HE      PHE  19  -0.972   0.845   3.734
  117    HE2  PHE  19           2HE      PHE  19  -3.850   0.394   0.618
  118    HZ   PHE  19           HZ       PHE  19  -2.185  -0.597   2.146
  119    H    THR  20           H        THR  20  -5.549   5.024   1.435
  120    HA   THR  20           HA       THR  20  -7.535   3.539   2.972
  121    HB   THR  20           HB       THR  20  -8.077   6.173   1.564
  122    HG1  THR  20           1HG      THR  20  -7.402   5.671   4.015
  123   1HG2  THR  20          1HG2      THR  20 -10.257   4.911   3.073
  124   2HG2  THR  20          2HG2      THR  20 -10.294   5.871   1.592
  125   3HG2  THR  20          3HG2      THR  20  -9.864   4.162   1.526
  126    H    PHE  21           H        PHE  21  -8.308   1.925   1.888
  127    HA   PHE  21           HA       PHE  21  -8.459   2.082  -1.051
  128   1HB   PHE  21          1HB       PHE  21  -6.482   0.701  -0.044
  129   2HB   PHE  21          2HB       PHE  21  -7.727  -0.440   0.400
  130    HD1  PHE  21           1HD      PHE  21  -8.442   1.249  -2.694
  131    HD2  PHE  21           2HD      PHE  21  -6.348  -2.005  -0.942
  132    HE1  PHE  21           1HE      PHE  21  -8.301   0.155  -4.874
  133    HE2  PHE  21           2HE      PHE  21  -6.198  -3.105  -3.115
  134    HZ   PHE  21           HZ       PHE  21  -7.171  -2.022  -5.111
  135    H    LEU  22           H        LEU  22 -10.253   1.018  -1.883
  136    HA   LEU  22           HA       LEU  22 -12.447   0.588  -1.937
  137   1HB   LEU  22          1HB       LEU  22 -11.211  -1.550  -0.311
  138   2HB   LEU  22          2HB       LEU  22 -12.762  -1.737  -1.109
  139    HG   LEU  22           HG       LEU  22 -11.575  -2.553  -2.817
  140   1HD1  LEU  22          1HD1      LEU  22 -11.592   0.107  -3.260
  141   2HD1  LEU  22          2HD1      LEU  22  -9.922  -0.374  -3.545
  142   3HD1  LEU  22          3HD1      LEU  22 -11.228  -1.158  -4.438
  143   1HD2  LEU  22          1HD2      LEU  22  -9.408  -1.878  -1.066
  144   2HD2  LEU  22          2HD2      LEU  22  -9.803  -3.399  -1.864
  145   3HD2  LEU  22          3HD2      LEU  22  -8.996  -2.111  -2.762
  146    H    GLY  23           H        GLY  23 -12.003   2.471   0.143
  147   1HA   GLY  23          1HA       GLY  23 -13.536   3.444   1.607
  148   2HA   GLY  23          2HA       GLY  23 -14.370   1.911   1.718
  149    H    ASN  24           H        ASN  24 -11.283   1.014   2.369
  150    HA   ASN  24           HA       ASN  24 -11.710   1.490   5.245
  151   1HB   ASN  24          1HB       ASN  24 -10.210  -0.725   3.846
  152   2HB   ASN  24          2HB       ASN  24 -10.435  -0.579   5.579
  153   1HD2  ASN  24          1HD2      ASN  24 -13.143  -2.383   3.311
  154   2HD2  ASN  24          2HD2      ASN  24 -11.572  -1.913   2.782
  155    H    LYS  25           H        LYS  25 -10.125   2.392   6.474
  156    HA   LYS  25           HA       LYS  25  -7.895   3.612   5.161
  157   1HB   LYS  25          1HB       LYS  25  -8.741   3.433   8.056
  158   2HB   LYS  25          2HB       LYS  25  -7.493   4.474   7.431
  159   1HG   LYS  25          1HG       LYS  25  -9.090   5.736   6.146
  160   2HG   LYS  25          2HG       LYS  25 -10.378   4.620   6.627
  161   1HD   LYS  25          1HD       LYS  25 -10.224   5.293   8.894
  162   2HD   LYS  25          2HD       LYS  25  -8.746   6.206   8.595
  163   1HE   LYS  25          1HE       LYS  25 -10.038   7.715   7.105
  164   2HE   LYS  25          2HE       LYS  25 -11.507   6.843   7.559
  165   1HZ   LYS  25          1HZ       LYS  25 -11.071   7.476   9.881
  166   2HZ   LYS  25          2HZ       LYS  25  -9.732   8.391   9.380
  167   3HZ   LYS  25          3HZ       LYS  25 -11.305   8.819   8.882
  168    H    TYR  26           H        TYR  26  -5.850   2.727   5.038
  169    HA   TYR  26           HA       TYR  26  -5.404   0.343   6.682
  170   1HB   TYR  26          1HB       TYR  26  -4.155   1.106   4.045
  171   2HB   TYR  26          2HB       TYR  26  -3.800  -0.352   4.961
  172    HD1  TYR  26           1HD      TYR  26  -6.877  -0.594   5.786
  173    HD2  TYR  26           2HD      TYR  26  -4.794  -0.232   2.112
  174    HE1  TYR  26           1HE      TYR  26  -8.688  -1.779   4.643
  175    HE2  TYR  26           2HE      TYR  26  -6.594  -1.404   0.963
  176    HH   TYR  26           HH       TYR  26  -9.350  -1.690   1.654
  177    H    GLU  27           H        GLU  27  -4.242   0.710   8.334
  178    HA   GLU  27           HA       GLU  27  -2.269   2.841   8.422
  179   1HB   GLU  27          1HB       GLU  27  -3.181   0.954  10.586
  180   2HB   GLU  27          2HB       GLU  27  -2.253   2.416  10.801
  181   1HG   GLU  27          1HG       GLU  27  -4.145   3.729   9.962
  182   2HG   GLU  27          2HG       GLU  27  -5.081   2.245   9.819
  183    H    SER  28           H        SER  28  -2.418  -0.422   7.762
  184    HA   SER  28           HA       SER  28   0.476  -0.710   8.025
  185   1HB   SER  28          1HB       SER  28  -0.136  -3.190   8.492
  186   2HB   SER  28          2HB       SER  28  -0.289  -2.043   9.819
  187    HG   SER  28           HG       SER  28  -2.168  -3.610   8.785
  188    H    CYS  29           H        CYS  29   0.996  -2.896   6.640
  189    HA   CYS  29           HA       CYS  29   0.193  -2.250   4.010
  190   1HB   CYS  29          1HB       CYS  29   1.440  -4.816   4.960
  191   2HB   CYS  29          2HB       CYS  29   1.364  -4.259   3.308
  192    H    THR  30           H        THR  30  -0.959  -3.586   2.573
  193    HA   THR  30           HA       THR  30  -2.990  -5.296   3.833
  194    HB   THR  30           HB       THR  30  -3.942  -3.019   3.368
  195    HG1  THR  30           1HG      THR  30  -5.382  -4.721   3.227
  196   1HG2  THR  30          1HG2      THR  30  -4.138  -3.317   0.508
  197   2HG2  THR  30          2HG2      THR  30  -3.619  -1.931   1.465
  198   3HG2  THR  30          3HG2      THR  30  -2.455  -3.176   1.016
  199    H    SER  31           H        SER  31  -4.275  -6.384   1.996
  200    HA   SER  31           HA       SER  31  -2.496  -7.125  -0.203
  201   1HB   SER  31          1HB       SER  31  -3.531  -9.479   0.081
  202   2HB   SER  31          2HB       SER  31  -2.267  -8.992   1.220
  203    HG   SER  31           HG       SER  31  -3.707  -8.866   2.798
  204    H    ALA  32           H        ALA  32  -4.896  -5.394   0.463
  205    HA   ALA  32           HA       ALA  32  -7.231  -6.294  -0.757
  206   1HB   ALA  32          1HB       ALA  32  -6.093  -3.561  -0.231
  207   2HB   ALA  32          2HB       ALA  32  -7.615  -3.749  -1.099
  208   3HB   ALA  32          3HB       ALA  32  -7.462  -4.354   0.551
  209    H    GLY  33           H        GLY  33  -8.045  -6.207  -2.782
  210   1HA   GLY  33          1HA       GLY  33  -8.115  -5.902  -5.062
  211   2HA   GLY  33          2HA       GLY  33  -6.741  -4.815  -4.923
  212    H    ARG  34           H        ARG  34  -5.575  -7.326  -3.361
  213    HA   ARG  34           HA       ARG  34  -4.438  -8.496  -5.798
  214   1HB   ARG  34          1HB       ARG  34  -3.436  -8.531  -2.948
  215   2HB   ARG  34          2HB       ARG  34  -2.645  -9.311  -4.299
  216   1HG   ARG  34          1HG       ARG  34  -2.747  -6.831  -5.275
  217   2HG   ARG  34          2HG       ARG  34  -2.758  -6.455  -3.556
  218   1HD   ARG  34          1HD       ARG  34  -0.479  -6.522  -4.507
  219   2HD   ARG  34          2HD       ARG  34  -0.719  -7.706  -3.219
  220    HE   ARG  34           HE       ARG  34  -0.399  -9.387  -4.733
  221   1HH1  ARG  34          1HH1      ARG  34  -0.882  -6.381  -6.484
  222   2HH1  ARG  34          2HH1      ARG  34  -0.529  -7.084  -8.030
  223   1HH2  ARG  34          1HH2      ARG  34   0.007 -10.313  -6.767
  224   2HH2  ARG  34          2HH2      ARG  34  -0.069  -9.330  -8.201
  225    H    SER  35           H        SER  35  -4.978  -9.636  -2.493
  226    HA   SER  35           HA       SER  35  -5.594 -11.614  -1.611
  227   1HB   SER  35          1HB       SER  35  -7.677 -12.643  -2.500
  228   2HB   SER  35          2HB       SER  35  -7.820 -10.909  -2.225
  229    HG   SER  35           HG       SER  35  -6.978 -11.448  -4.749
  230    H    ASP  36           H        ASP  36  -3.452 -11.667  -3.567
  231    HA   ASP  36           HA       ASP  36  -3.707 -14.388  -4.608
  232   1HB   ASP  36          1HB       ASP  36  -2.205 -13.811  -6.307
  233   2HB   ASP  36          2HB       ASP  36  -3.217 -12.398  -6.134
  234    H    GLY  37           H        GLY  37  -1.736 -12.210  -2.785
  235   1HA   GLY  37          1HA       GLY  37  -0.870 -13.923  -0.869
  236   2HA   GLY  37          2HA       GLY  37   0.285 -14.163  -2.171
  237    H    LYS  38           H        LYS  38   1.216 -12.030  -3.047
  238    HA   LYS  38           HA       LYS  38   2.727 -10.824  -1.074
  239   1HB   LYS  38          1HB       LYS  38   2.050  -9.542  -3.715
  240   2HB   LYS  38          2HB       LYS  38   3.523  -9.356  -2.767
  241   1HG   LYS  38          1HG       LYS  38   4.263 -10.796  -4.347
  242   2HG   LYS  38          2HG       LYS  38   3.701 -11.957  -3.155
  243   1HD   LYS  38          1HD       LYS  38   1.556 -12.094  -4.400
  244   2HD   LYS  38          2HD       LYS  38   2.243 -11.032  -5.628
  245   1HE   LYS  38          1HE       LYS  38   3.978 -12.653  -6.118
  246   2HE   LYS  38          2HE       LYS  38   3.400 -13.692  -4.814
  247   1HZ   LYS  38          1HZ       LYS  38   1.219 -13.199  -6.451
  248   2HZ   LYS  38          2HZ       LYS  38   2.513 -13.554  -7.496
  249   3HZ   LYS  38          3HZ       LYS  38   2.075 -14.653  -6.280
  250    H    MET  39           H        MET  39   2.466  -9.143   0.263
  251    HA   MET  39           HA       MET  39  -0.030  -7.652   0.137
  252   1HB   MET  39          1HB       MET  39   2.099  -7.589   2.288
  253   2HB   MET  39          2HB       MET  39   0.476  -6.934   2.386
  254   1HG   MET  39          1HG       MET  39   0.342  -8.888   3.608
  255   2HG   MET  39          2HG       MET  39  -0.336  -9.325   2.042
  256   1HE   MET  39          1HE       MET  39   0.004 -11.356   3.681
  257   2HE   MET  39          2HE       MET  39   0.479 -12.379   2.325
  258   3HE   MET  39          3HE       MET  39   1.482 -12.312   3.773
  259    H    TRP  40           H        TRP  40   0.019  -5.313   0.337
  260    HA   TRP  40           HA       TRP  40   2.538  -4.034  -0.443
  261   1HB   TRP  40          1HB       TRP  40   1.388  -2.800  -2.251
  262   2HB   TRP  40          2HB       TRP  40   1.384  -4.534  -2.553
  263    HD1  TRP  40           HD1      TRP  40  -1.086  -5.793  -1.875
  264    HE1  TRP  40           1HE      TRP  40  -3.466  -4.858  -2.151
  265    HE3  TRP  40           3HE      TRP  40   0.039  -0.848  -2.306
  266    HZ2  TRP  40           2HZ      TRP  40  -4.690  -2.349  -2.462
  267    HZ3  TRP  40           3HZ      TRP  40  -1.794   0.761  -2.564
  268    HH2  TRP  40           HH2      TRP  40  -4.113   0.023  -2.648
  269    H    CYS  41           H        CYS  41   1.648  -1.525  -0.910
  270    HA   CYS  41           HA       CYS  41  -0.269  -0.590   0.983
  271   1HB   CYS  41          1HB       CYS  41   1.449   0.907   2.175
  272   2HB   CYS  41          2HB       CYS  41   1.343  -0.775   2.675
  273    H    ALA  42           H        ALA  42  -0.896   1.551   0.515
  274    HA   ALA  42           HA       ALA  42  -0.144   2.435  -2.104
  275   1HB   ALA  42          1HB       ALA  42  -1.908   3.741  -0.041
  276   2HB   ALA  42          2HB       ALA  42  -1.746   4.255  -1.719
  277   3HB   ALA  42          3HB       ALA  42  -2.437   2.675  -1.344
  278    H    THR  43           H        THR  43   0.711   4.470  -2.646
  279    HA   THR  43           HA       THR  43   2.589   5.480  -0.635
  280    HB   THR  43           HB       THR  43   3.898   6.285  -2.513
  281    HG1  THR  43           1HG      THR  43   2.711   5.231  -4.605
  282   1HG2  THR  43          1HG2      THR  43   3.460   3.794  -3.805
  283   2HG2  THR  43          2HG2      THR  43   4.772   4.267  -2.724
  284   3HG2  THR  43          3HG2      THR  43   3.294   3.562  -2.066
  285    H    THR  44           H        THR  44  -0.374   6.065  -1.468
  286    HA   THR  44           HA       THR  44  -0.166   8.973  -1.122
  287    HB   THR  44           HB       THR  44  -2.184   9.196  -2.605
  288    HG1  THR  44           1HG      THR  44  -3.122   7.427  -3.213
  289   1HG2  THR  44          1HG2      THR  44  -0.440   7.982  -4.542
  290   2HG2  THR  44          2HG2      THR  44  -0.861   9.678  -4.305
  291   3HG2  THR  44          3HG2      THR  44   0.463   8.960  -3.384
  292    H    ALA  45           H        ALA  45  -2.001   9.888   0.030
  293    HA   ALA  45           HA       ALA  45  -2.899   8.254   2.145
  294   1HB   ALA  45          1HB       ALA  45  -3.281  11.023   1.321
  295   2HB   ALA  45          2HB       ALA  45  -4.698  10.331   2.110
  296   3HB   ALA  45          3HB       ALA  45  -3.141  10.326   2.936
  297    H    ASN  46           H        ASN  46  -4.444   9.236  -0.869
  298    HA   ASN  46           HA       ASN  46  -6.590   7.308  -0.303
  299   1HB   ASN  46          1HB       ASN  46  -7.405   9.654  -0.594
  300   2HB   ASN  46          2HB       ASN  46  -6.727   9.649  -2.226
  301   1HD2  ASN  46          1HD2      ASN  46 -10.363   8.259  -1.572
  302   2HD2  ASN  46          2HD2      ASN  46  -9.447   9.188  -0.445
  303    H    TYR  47           H        TYR  47  -6.085   5.487  -1.284
  304    HA   TYR  47           HA       TYR  47  -4.421   5.465  -3.628
  305   1HB   TYR  47          1HB       TYR  47  -4.081   3.776  -1.896
  306   2HB   TYR  47          2HB       TYR  47  -5.718   3.172  -2.145
  307    HD1  TYR  47           1HD      TYR  47  -2.377   3.478  -3.677
  308    HD2  TYR  47           2HD      TYR  47  -6.219   1.685  -3.931
  309    HE1  TYR  47           1HE      TYR  47  -1.550   1.966  -5.421
  310    HE2  TYR  47           2HE      TYR  47  -5.396   0.175  -5.680
  311    HH   TYR  47           HH       TYR  47  -3.000  -0.776  -6.320
  312    H    ASP  48           H        ASP  48  -7.814   5.018  -2.929
  313    HA   ASP  48           HA       ASP  48  -8.668   3.699  -5.191
  314   1HB   ASP  48          1HB       ASP  48  -9.968   5.776  -3.457
  315   2HB   ASP  48          2HB       ASP  48 -10.815   5.086  -4.837
  316    H    ASP  49           H        ASP  49  -7.898   7.104  -4.813
  317    HA   ASP  49           HA       ASP  49  -8.784   7.764  -7.485
  318   1HB   ASP  49          1HB       ASP  49  -7.773   9.292  -5.143
  319   2HB   ASP  49          2HB       ASP  49  -7.530  10.006  -6.735
  320    H    ASP  50           H        ASP  50  -5.669   8.324  -5.854
  321    HA   ASP  50           HA       ASP  50  -4.258   8.710  -8.269
  322   1HB   ASP  50          1HB       ASP  50  -3.330   8.240  -5.441
  323   2HB   ASP  50          2HB       ASP  50  -2.211   8.530  -6.768
  324    H    ARG  51           H        ARG  51  -4.838   5.847  -6.376
  325    HA   ARG  51           HA       ARG  51  -4.169   3.712  -6.527
  326   1HB   ARG  51          1HB       ARG  51  -4.463   4.404  -9.428
  327   2HB   ARG  51          2HB       ARG  51  -4.324   2.766  -8.808
  328   1HG   ARG  51          1HG       ARG  51  -6.281   4.219  -7.350
  329   2HG   ARG  51          2HG       ARG  51  -6.656   4.255  -9.076
  330   1HD   ARG  51          1HD       ARG  51  -6.177   1.854  -7.330
  331   2HD   ARG  51          2HD       ARG  51  -7.712   2.361  -8.033
  332    HE   ARG  51           HE       ARG  51  -5.754   1.927 -10.051
  333   1HH1  ARG  51          1HH1      ARG  51  -7.952   0.257  -7.917
  334   2HH1  ARG  51          2HH1      ARG  51  -8.030  -1.168  -8.904
  335   1HH2  ARG  51          1HH2      ARG  51  -5.782   0.020 -11.308
  336   2HH2  ARG  51          2HH2      ARG  51  -6.798  -1.307 -10.821
  337    H    LYS  52           H        LYS  52  -1.965   5.127  -5.946
  338    HA   LYS  52           HA       LYS  52   0.068   3.834  -7.622
  339   1HB   LYS  52          1HB       LYS  52   0.364   6.291  -5.864
  340   2HB   LYS  52          2HB       LYS  52   1.692   5.500  -6.705
  341   1HG   LYS  52          1HG       LYS  52   0.542   5.962  -8.856
  342   2HG   LYS  52          2HG       LYS  52  -0.689   6.855  -7.965
  343   1HD   LYS  52          1HD       LYS  52   2.261   7.510  -8.078
  344   2HD   LYS  52          2HD       LYS  52   0.970   8.361  -8.934
  345   1HE   LYS  52          1HE       LYS  52  -0.041   8.888  -6.710
  346   2HE   LYS  52          2HE       LYS  52   1.383   8.188  -5.946
  347   1HZ   LYS  52          1HZ       LYS  52   2.753   9.834  -7.098
  348   2HZ   LYS  52          2HZ       LYS  52   1.361  10.531  -7.777
  349   3HZ   LYS  52          3HZ       LYS  52   1.596  10.573  -6.091
  350    H    TRP  53           H        TRP  53   0.858   2.115  -6.762
  351    HA   TRP  53           HA       TRP  53   0.854   1.844  -3.835
  352   1HB   TRP  53          1HB       TRP  53   0.169  -0.456  -4.160
  353   2HB   TRP  53          2HB       TRP  53  -0.961   0.636  -4.886
  354    HD1  TRP  53           HD1      TRP  53  -0.402   0.971  -7.750
  355    HE1  TRP  53           1HE      TRP  53   0.045  -0.975  -9.384
  356    HE3  TRP  53           3HE      TRP  53   0.915  -2.471  -4.355
  357    HZ2  TRP  53           2HZ      TRP  53   0.863  -3.709  -9.195
  358    HZ3  TRP  53           3HZ      TRP  53   1.525  -4.773  -5.102
  359    HH2  TRP  53           HH2      TRP  53   1.498  -5.363  -7.477
  360    H    GLY  54           H        GLY  54   1.963  -0.316  -3.307
  361   1HA   GLY  54          1HA       GLY  54   4.250  -1.138  -4.737
  362   2HA   GLY  54          2HA       GLY  54   4.710   0.009  -3.479
  363    H    PHE  55           H        PHE  55   5.028  -2.995  -3.864
  364    HA   PHE  55           HA       PHE  55   3.488  -4.368  -1.990
  365   1HB   PHE  55          1HB       PHE  55   6.187  -4.877  -3.206
  366   2HB   PHE  55          2HB       PHE  55   5.511  -5.961  -2.012
  367    HD1  PHE  55           1HD      PHE  55   2.675  -5.915  -2.783
  368    HD2  PHE  55           2HD      PHE  55   6.167  -6.121  -5.198
  369    HE1  PHE  55           1HE      PHE  55   1.395  -7.118  -4.509
  370    HE2  PHE  55           2HE      PHE  55   4.890  -7.321  -6.929
  371    HZ   PHE  55           HZ       PHE  55   2.507  -7.811  -6.589
  372    H    CYS  56           H        CYS  56   4.001  -5.175   0.055
  373    HA   CYS  56           HA       CYS  56   5.122  -3.247   1.822
  374   1HB   CYS  56          1HB       CYS  56   3.249  -4.960   2.293
  375   2HB   CYS  56          2HB       CYS  56   4.547  -6.123   2.523
  376    HA   PRO  57           HA       PRO  57   9.329  -4.642   1.500
  377   1HB   PRO  57          1HB       PRO  57  10.452  -3.242   3.441
  378   2HB   PRO  57          2HB       PRO  57   9.822  -2.444   1.988
  379   1HG   PRO  57          1HG       PRO  57   8.463  -2.890   4.614
  380   2HG   PRO  57          2HG       PRO  57   8.681  -1.344   3.764
  381   1HD   PRO  57          1HD       PRO  57   6.389  -2.709   3.567
  382   2HD   PRO  57          2HD       PRO  57   7.085  -1.913   2.134
  383    H    ASP  58           H        ASP  58   7.280  -5.624   3.613
  384    HA   ASP  58           HA       ASP  58   9.186  -7.313   5.095
  385   1HB   ASP  58          1HB       ASP  58   7.924  -5.538   6.466
  386   2HB   ASP  58          2HB       ASP  58   6.482  -6.502   6.172
  387    H    GLN  59           H        GLN  59   8.696  -8.512   2.951
  388    HA   GLN  59           HA       GLN  59   6.164  -9.776   2.650
  389   1HB   GLN  59          1HB       GLN  59   8.876 -10.393   1.476
  390   2HB   GLN  59          2HB       GLN  59   7.425 -11.291   1.058
  391   1HG   GLN  59          1HG       GLN  59   7.817  -8.336   0.654
  392   2HG   GLN  59          2HG       GLN  59   7.971  -9.575  -0.593
  393   1HE2  GLN  59          1HE2      GLN  59   4.459  -7.941   0.028
  394   2HE2  GLN  59          2HE2      GLN  59   5.994  -7.277   0.465
  395    H    GLY  60           H        GLY  60   5.844 -12.139   2.700
  396   1HA   GLY  60          1HA       GLY  60   7.486 -13.910   4.124
  397   2HA   GLY  60          2HA       GLY  60   6.365 -13.176   5.263
  Start of MODEL   42
    1    H    SER   1           1H       SER   1  17.127   1.712   6.913
    2    HA   SER   1           HA       SER   1  16.646   3.454   5.742
    3   1HB   SER   1          1HB       SER   1  15.876   2.892   3.348
    4   2HB   SER   1          2HB       SER   1  17.366   2.132   3.911
    5    HG   SER   1           HG       SER   1  15.858   0.683   2.852
    6    H    TRP   2           H        TRP   2  14.572   3.896   3.769
    7    HA   TRP   2           HA       TRP   2  12.414   4.565   5.576
    8   1HB   TRP   2          1HB       TRP   2  12.953   5.122   2.663
    9   2HB   TRP   2          2HB       TRP   2  11.405   5.512   3.406
   10    HD1  TRP   2           HD1      TRP   2  15.140   6.260   4.282
   11    HE1  TRP   2           1HE      TRP   2  15.272   8.711   5.077
   12    HE3  TRP   2           3HE      TRP   2  10.185   7.506   3.900
   13    HZ2  TRP   2           2HZ      TRP   2  13.503  10.882   5.471
   14    HZ3  TRP   2           3HZ      TRP   2   9.489   9.791   4.504
   15    HH2  TRP   2           HH2      TRP   2  11.116  11.440   5.274
   16    H    MET   3           H        MET   3  10.128   4.311   4.469
   17    HA   MET   3           HA       MET   3   9.733   1.464   4.189
   18   1HB   MET   3          1HB       MET   3   7.318   2.059   4.294
   19   2HB   MET   3          2HB       MET   3   8.228   2.605   5.687
   20   1HG   MET   3          1HG       MET   3   7.486   4.359   3.359
   21   2HG   MET   3          2HG       MET   3   6.531   4.214   4.831
   22   1HE   MET   3          1HE       MET   3   7.389   4.868   7.200
   23   2HE   MET   3          2HE       MET   3   8.967   4.084   7.107
   24   3HE   MET   3          3HE       MET   3   8.854   5.793   7.531
   25    H    SER   4           H        SER   4  11.119   2.139   2.087
   26    HA   SER   4           HA       SER   4   9.745   3.133  -0.160
   27   1HB   SER   4          1HB       SER   4  12.063   1.192  -0.161
   28   2HB   SER   4          2HB       SER   4  11.629   2.327  -1.435
   29    HG   SER   4           HG       SER   4  12.067   4.030   0.136
   30    H    THR   5           H        THR   5   9.069   1.943  -2.053
   31    HA   THR   5           HA       THR   5   7.681  -0.485  -1.282
   32    HB   THR   5           HB       THR   5   6.504  -0.072  -3.498
   33    HG1  THR   5           1HG      THR   5   7.773   1.282  -4.573
   34   1HG2  THR   5          1HG2      THR   5   5.746   2.350  -2.303
   35   2HG2  THR   5          2HG2      THR   5   4.940   0.783  -2.212
   36   3HG2  THR   5          3HG2      THR   5   6.145   1.230  -1.002
   37    H    VAL   6           H        VAL   6   7.467  -2.191  -2.646
   38    HA   VAL   6           HA       VAL   6   9.535  -2.725  -4.624
   39    HB   VAL   6           HB       VAL   6  10.395  -4.220  -3.145
   40   1HG1  VAL   6          1HG1      VAL   6   8.319  -3.277  -1.502
   41   2HG1  VAL   6          2HG1      VAL   6   8.300  -5.037  -1.388
   42   3HG1  VAL   6          3HG1      VAL   6   9.774  -4.146  -1.018
   43   1HG2  VAL   6          1HG2      VAL   6   8.011  -5.543  -4.222
   44   2HG2  VAL   6          2HG2      VAL   6   9.701  -6.045  -4.250
   45   3HG2  VAL   6          3HG2      VAL   6   8.728  -6.308  -2.803
   46    H    GLY   7           H        GLY   7   8.528  -4.484  -6.174
   47   1HA   GLY   7          1HA       GLY   7   6.598  -5.227  -7.323
   48   2HA   GLY   7          2HA       GLY   7   5.730  -4.947  -5.852
   49    H    GLY   8           H        GLY   8   3.974  -4.007  -6.692
   50   1HA   GLY   8          1HA       GLY   8   2.636  -2.440  -7.725
   51   2HA   GLY   8          2HA       GLY   8   3.582  -1.383  -6.709
   52    H    ASN   9           H        ASN   9   3.533   0.379  -7.968
   53    HA   ASN   9           HA       ASN   9   5.231   0.373 -10.320
   54   1HB   ASN   9          1HB       ASN   9   3.589   1.551 -11.728
   55   2HB   ASN   9          2HB       ASN   9   3.064  -0.067 -11.320
   56   1HD2  ASN   9          1HD2      ASN   9   0.960   2.204  -8.862
   57   2HD2  ASN   9          2HD2      ASN   9   2.594   1.690  -8.624
   58    H    SER  10           H        SER  10   5.360   1.450  -7.632
   59    HA   SER  10           HA       SER  10   4.964   4.295  -7.859
   60   1HB   SER  10          1HB       SER  10   6.515   3.841  -5.611
   61   2HB   SER  10          2HB       SER  10   4.757   3.927  -5.647
   62    HG   SER  10           HG       SER  10   5.924   1.943  -4.751
   63    H    GLY  11           H        GLY  11   7.839   2.264  -7.233
   64   1HA   GLY  11          1HA       GLY  11   9.856   2.526  -8.549
   65   2HA   GLY  11          2HA       GLY  11   9.427   4.217  -8.774
   66    H    GLY  12           H        GLY  12   9.508   2.246  -5.818
   67   1HA   GLY  12          1HA       GLY  12  10.925   2.377  -3.985
   68   2HA   GLY  12          2HA       GLY  12  11.890   3.566  -4.846
   69    H    ALA  13           H        ALA  13   8.421   3.855  -4.333
   70    HA   ALA  13           HA       ALA  13   8.890   6.355  -2.908
   71   1HB   ALA  13          1HB       ALA  13   7.204   6.049  -4.821
   72   2HB   ALA  13          2HB       ALA  13   6.198   5.238  -3.619
   73   3HB   ALA  13          3HB       ALA  13   6.670   6.920  -3.383
   74    HA   PRO  14           HA       PRO  14   7.895   4.485   0.971
   75   1HB   PRO  14          1HB       PRO  14   7.294   6.672   2.444
   76   2HB   PRO  14          2HB       PRO  14   8.942   6.287   1.940
   77   1HG   PRO  14          1HG       PRO  14   7.076   8.338   0.891
   78   2HG   PRO  14          2HG       PRO  14   8.844   8.356   0.955
   79   1HD   PRO  14          1HD       PRO  14   7.266   7.783  -1.296
   80   2HD   PRO  14          2HD       PRO  14   9.007   7.491  -1.131
   81    H    CYS  15           H        CYS  15   6.129   3.417   1.609
   82    HA   CYS  15           HA       CYS  15   3.546   3.988   0.640
   83   1HB   CYS  15          1HB       CYS  15   4.440   2.221   2.937
   84   2HB   CYS  15          2HB       CYS  15   2.786   2.278   2.333
   85    H    VAL  16           H        VAL  16   2.028   5.361   1.348
   86    HA   VAL  16           HA       VAL  16   2.542   6.911   3.758
   87    HB   VAL  16           HB       VAL  16   0.421   7.264   1.631
   88   1HG1  VAL  16          1HG1      VAL  16   1.054   8.752   4.124
   89   2HG1  VAL  16          2HG1      VAL  16   0.614   9.689   2.695
   90   3HG1  VAL  16          3HG1      VAL  16  -0.497   8.478   3.330
   91   1HG2  VAL  16          1HG2      VAL  16   2.938   7.542   1.074
   92   2HG2  VAL  16          2HG2      VAL  16   1.794   8.785   0.568
   93   3HG2  VAL  16          3HG2      VAL  16   2.796   9.037   1.998
   94    H    PHE  17           H        PHE  17   1.579   6.534   5.632
   95    HA   PHE  17           HA       PHE  17  -0.959   5.060   5.646
   96   1HB   PHE  17          1HB       PHE  17   1.273   5.048   7.679
   97   2HB   PHE  17          2HB       PHE  17  -0.281   4.276   7.900
   98    HD1  PHE  17           1HD      PHE  17  -0.921   2.658   5.814
   99    HD2  PHE  17           2HD      PHE  17   2.973   3.740   7.108
  100    HE1  PHE  17           1HE      PHE  17  -0.012   0.632   4.765
  101    HE2  PHE  17           2HE      PHE  17   3.906   1.720   6.060
  102    HZ   PHE  17           HZ       PHE  17   2.428   0.140   4.874
  103    HA   PRO  18           HA       PRO  18  -2.484   4.602   6.902
  104   1HB   PRO  18          1HB       PRO  18  -5.072   5.760   7.242
  105   2HB   PRO  18          2HB       PRO  18  -4.205   4.716   8.371
  106   1HG   PRO  18          1HG       PRO  18  -4.804   7.389   8.818
  107   2HG   PRO  18          2HG       PRO  18  -3.537   6.476   9.656
  108   1HD   PRO  18          1HD       PRO  18  -3.308   8.369   7.347
  109   2HD   PRO  18          2HD       PRO  18  -2.221   8.145   8.738
  110    H    PHE  19           H        PHE  19  -3.060   3.855   4.921
  111    HA   PHE  19           HA       PHE  19  -4.042   5.875   3.012
  112   1HB   PHE  19          1HB       PHE  19  -3.249   4.527   1.203
  113   2HB   PHE  19          2HB       PHE  19  -1.929   4.733   2.348
  114    HD1  PHE  19           1HD      PHE  19  -1.424   2.796   3.939
  115    HD2  PHE  19           2HD      PHE  19  -3.910   2.410   0.509
  116    HE1  PHE  19           1HE      PHE  19  -1.088   0.359   3.969
  117    HE2  PHE  19           2HE      PHE  19  -3.578  -0.024   0.531
  118    HZ   PHE  19           HZ       PHE  19  -2.157  -1.056   2.263
  119    H    THR  20           H        THR  20  -6.046   5.709   2.276
  120    HA   THR  20           HA       THR  20  -7.630   3.467   3.250
  121    HB   THR  20           HB       THR  20  -8.546   5.930   1.726
  122    HG1  THR  20           1HG      THR  20  -7.426   6.333   3.778
  123   1HG2  THR  20          1HG2      THR  20 -10.485   5.193   3.546
  124   2HG2  THR  20          2HG2      THR  20 -10.537   4.980   1.796
  125   3HG2  THR  20          3HG2      THR  20  -9.956   3.671   2.827
  126    H    PHE  21           H        PHE  21  -8.126   1.787   2.098
  127    HA   PHE  21           HA       PHE  21  -7.961   1.984  -0.838
  128   1HB   PHE  21          1HB       PHE  21  -6.258   0.455   0.228
  129   2HB   PHE  21          2HB       PHE  21  -7.597  -0.495   0.836
  130    HD1  PHE  21           1HD      PHE  21  -5.965   0.633  -2.284
  131    HD2  PHE  21           2HD      PHE  21  -8.712  -2.102  -0.528
  132    HE1  PHE  21           1HE      PHE  21  -5.932  -0.707  -4.334
  133    HE2  PHE  21           2HE      PHE  21  -8.676  -3.438  -2.584
  134    HZ   PHE  21           HZ       PHE  21  -7.291  -2.751  -4.488
  135    H    LEU  22           H        LEU  22  -9.685   1.455  -1.912
  136    HA   LEU  22           HA       LEU  22 -11.891   1.237  -2.282
  137   1HB   LEU  22          1HB       LEU  22 -10.554  -1.225  -1.395
  138   2HB   LEU  22          2HB       LEU  22 -12.234  -1.315  -1.890
  139    HG   LEU  22           HG       LEU  22 -10.594  -1.833  -3.685
  140   1HD1  LEU  22          1HD1      LEU  22 -12.357   0.537  -4.002
  141   2HD1  LEU  22          2HD1      LEU  22 -11.647  -0.370  -5.338
  142   3HD1  LEU  22          3HD1      LEU  22 -12.786  -1.157  -4.244
  143   1HD2  LEU  22          1HD2      LEU  22  -9.053   0.088  -2.880
  144   2HD2  LEU  22          2HD2      LEU  22  -9.156  -0.325  -4.592
  145   3HD2  LEU  22          3HD2      LEU  22 -10.053   1.058  -3.961
  146    H    GLY  23           H        GLY  23 -11.792   2.555   0.036
  147   1HA   GLY  23          1HA       GLY  23 -13.603   3.169   1.424
  148   2HA   GLY  23          2HA       GLY  23 -14.181   1.520   1.362
  149    H    ASN  24           H        ASN  24 -11.138   0.793   2.193
  150    HA   ASN  24           HA       ASN  24 -11.759   1.231   5.040
  151   1HB   ASN  24          1HB       ASN  24 -10.095  -0.933   3.760
  152   2HB   ASN  24          2HB       ASN  24 -10.489  -0.797   5.468
  153   1HD2  ASN  24          1HD2      ASN  24 -12.937  -2.664   2.970
  154   2HD2  ASN  24          2HD2      ASN  24 -11.337  -2.154   2.577
  155    H    LYS  25           H        LYS  25 -10.302   2.194   6.361
  156    HA   LYS  25           HA       LYS  25  -8.040   3.511   5.218
  157   1HB   LYS  25          1HB       LYS  25  -8.756   3.326   8.138
  158   2HB   LYS  25          2HB       LYS  25  -7.961   4.621   7.282
  159   1HG   LYS  25          1HG       LYS  25  -9.969   5.317   6.232
  160   2HG   LYS  25          2HG       LYS  25 -10.812   3.872   6.791
  161   1HD   LYS  25          1HD       LYS  25 -10.478   4.633   9.125
  162   2HD   LYS  25          2HD       LYS  25  -9.761   6.119   8.506
  163   1HE   LYS  25          1HE       LYS  25 -12.559   5.160   7.945
  164   2HE   LYS  25          2HE       LYS  25 -12.117   6.420   9.098
  165   1HZ   LYS  25          1HZ       LYS  25 -10.976   7.410   6.945
  166   2HZ   LYS  25          2HZ       LYS  25 -12.189   6.511   6.165
  167   3HZ   LYS  25          3HZ       LYS  25 -12.608   7.698   7.306
  168    H    TYR  26           H        TYR  26  -6.027   2.600   5.085
  169    HA   TYR  26           HA       TYR  26  -5.475   0.294   6.821
  170   1HB   TYR  26          1HB       TYR  26  -4.264   1.094   4.174
  171   2HB   TYR  26          2HB       TYR  26  -3.801  -0.318   5.114
  172    HD1  TYR  26           1HD      TYR  26  -7.054  -0.390   5.817
  173    HD2  TYR  26           2HD      TYR  26  -4.566  -0.699   2.396
  174    HE1  TYR  26           1HE      TYR  26  -8.772  -1.717   4.691
  175    HE2  TYR  26           2HE      TYR  26  -6.269  -2.037   1.262
  176    HH   TYR  26           HH       TYR  26  -8.456  -3.659   2.531
  177    H    GLU  27           H        GLU  27  -4.281   0.720   8.448
  178    HA   GLU  27           HA       GLU  27  -2.409   2.940   8.459
  179   1HB   GLU  27          1HB       GLU  27  -3.267   1.024  10.621
  180   2HB   GLU  27          2HB       GLU  27  -2.235   2.413  10.855
  181   1HG   GLU  27          1HG       GLU  27  -4.038   3.905  10.233
  182   2HG   GLU  27          2HG       GLU  27  -5.078   2.523   9.889
  183    H    SER  28           H        SER  28  -2.452  -0.396   7.969
  184    HA   SER  28           HA       SER  28   0.473  -0.482   8.093
  185   1HB   SER  28          1HB       SER  28   0.070  -2.979   8.594
  186   2HB   SER  28          2HB       SER  28  -0.178  -1.842   9.915
  187    HG   SER  28           HG       SER  28  -2.375  -2.411   8.286
  188    H    CYS  29           H        CYS  29   0.969  -2.810   6.787
  189    HA   CYS  29           HA       CYS  29   0.203  -2.165   4.134
  190   1HB   CYS  29          1HB       CYS  29   1.536  -4.637   5.227
  191   2HB   CYS  29          2HB       CYS  29   1.350  -4.279   3.523
  192    H    THR  30           H        THR  30  -0.732  -3.927   2.689
  193    HA   THR  30           HA       THR  30  -2.810  -5.502   4.006
  194    HB   THR  30           HB       THR  30  -3.835  -3.257   3.533
  195    HG1  THR  30           1HG      THR  30  -5.296  -4.871   3.433
  196   1HG2  THR  30          1HG2      THR  30  -3.684  -3.841   0.618
  197   2HG2  THR  30          2HG2      THR  30  -3.986  -2.315   1.452
  198   3HG2  THR  30          3HG2      THR  30  -2.357  -2.990   1.406
  199    H    SER  31           H        SER  31  -4.076  -6.673   2.237
  200    HA   SER  31           HA       SER  31  -2.350  -7.390  -0.018
  201   1HB   SER  31          1HB       SER  31  -3.164  -9.786   0.343
  202   2HB   SER  31          2HB       SER  31  -2.007  -9.172   1.535
  203    HG   SER  31           HG       SER  31  -3.756  -8.766   2.936
  204    H    ALA  32           H        ALA  32  -4.659  -5.666   0.535
  205    HA   ALA  32           HA       ALA  32  -7.034  -6.732  -0.563
  206   1HB   ALA  32          1HB       ALA  32  -6.074  -4.218   0.522
  207   2HB   ALA  32          2HB       ALA  32  -7.089  -3.947  -0.892
  208   3HB   ALA  32          3HB       ALA  32  -7.718  -4.859   0.482
  209    H    GLY  33           H        GLY  33  -7.820  -6.799  -2.558
  210   1HA   GLY  33          1HA       GLY  33  -7.998  -6.425  -4.827
  211   2HA   GLY  33          2HA       GLY  33  -6.728  -5.219  -4.693
  212    H    ARG  34           H        ARG  34  -5.677  -8.086  -3.280
  213    HA   ARG  34           HA       ARG  34  -4.242  -8.729  -5.767
  214   1HB   ARG  34          1HB       ARG  34  -3.473  -9.373  -2.920
  215   2HB   ARG  34          2HB       ARG  34  -2.531  -9.721  -4.355
  216   1HG   ARG  34          1HG       ARG  34  -2.909  -7.062  -4.651
  217   2HG   ARG  34          2HG       ARG  34  -2.864  -7.205  -2.888
  218   1HD   ARG  34          1HD       ARG  34  -0.645  -6.801  -4.024
  219   2HD   ARG  34          2HD       ARG  34  -0.706  -8.187  -2.930
  220    HE   ARG  34           HE       ARG  34  -0.300  -9.563  -4.716
  221   1HH1  ARG  34          1HH1      ARG  34  -1.362  -6.454  -5.950
  222   2HH1  ARG  34          2HH1      ARG  34  -1.137  -6.903  -7.614
  223   1HH2  ARG  34          1HH2      ARG  34  -0.011 -10.141  -6.904
  224   2HH2  ARG  34          2HH2      ARG  34  -0.333  -8.972  -8.149
  225    H    SER  35           H        SER  35  -3.945 -10.863  -6.404
  226    HA   SER  35           HA       SER  35  -5.980 -12.693  -5.333
  227   1HB   SER  35          1HB       SER  35  -6.002 -11.948  -7.797
  228   2HB   SER  35          2HB       SER  35  -4.586 -12.983  -7.995
  229    HG   SER  35           HG       SER  35  -7.094 -13.852  -6.954
  230    H    ASP  36           H        ASP  36  -2.673 -12.159  -5.224
  231    HA   ASP  36           HA       ASP  36  -2.059 -15.013  -5.029
  232   1HB   ASP  36          1HB       ASP  36   0.362 -13.993  -4.767
  233   2HB   ASP  36          2HB       ASP  36  -0.370 -14.207  -6.349
  234    H    GLY  37           H        GLY  37  -0.391 -12.468  -3.382
  235   1HA   GLY  37          1HA       GLY  37  -1.535 -12.623  -0.886
  236   2HA   GLY  37          2HA       GLY  37  -0.352 -13.914  -0.937
  237    H    LYS  38           H        LYS  38   0.910 -11.588  -2.908
  238    HA   LYS  38           HA       LYS  38   2.878 -10.827  -1.009
  239   1HB   LYS  38          1HB       LYS  38   2.406  -9.161  -3.426
  240   2HB   LYS  38          2HB       LYS  38   3.917  -9.761  -2.761
  241   1HG   LYS  38          1HG       LYS  38   1.908 -11.400  -4.287
  242   2HG   LYS  38          2HG       LYS  38   3.378 -10.723  -4.941
  243   1HD   LYS  38          1HD       LYS  38   4.687 -12.036  -3.301
  244   2HD   LYS  38          2HD       LYS  38   3.187 -12.790  -2.764
  245   1HE   LYS  38          1HE       LYS  38   4.460 -14.171  -4.383
  246   2HE   LYS  38          2HE       LYS  38   2.831 -13.774  -4.936
  247   1HZ   LYS  38          1HZ       LYS  38   5.212 -12.192  -5.730
  248   2HZ   LYS  38          2HZ       LYS  38   4.667 -13.533  -6.621
  249   3HZ   LYS  38          3HZ       LYS  38   3.660 -12.181  -6.430
  250    H    MET  39           H        MET  39   2.218  -9.577   0.720
  251    HA   MET  39           HA       MET  39   0.097  -7.722   0.538
  252   1HB   MET  39          1HB       MET  39   2.315  -7.692   2.595
  253   2HB   MET  39          2HB       MET  39   0.688  -7.043   2.756
  254   1HG   MET  39          1HG       MET  39  -0.256  -9.259   2.734
  255   2HG   MET  39          2HG       MET  39   1.332  -9.962   2.430
  256   1HE   MET  39          1HE       MET  39   3.306  -9.490   3.855
  257   2HE   MET  39          2HE       MET  39   3.155  -8.103   4.933
  258   3HE   MET  39          3HE       MET  39   3.243  -9.733   5.600
  259    H    TRP  40           H        TRP  40   0.099  -5.517   0.375
  260    HA   TRP  40           HA       TRP  40   2.614  -4.204  -0.416
  261   1HB   TRP  40          1HB       TRP  40   1.358  -3.026  -2.200
  262   2HB   TRP  40          2HB       TRP  40   1.378  -4.768  -2.467
  263    HD1  TRP  40           HD1      TRP  40  -0.995  -6.059  -1.584
  264    HE1  TRP  40           1HE      TRP  40  -3.419  -5.215  -1.716
  265    HE3  TRP  40           3HE      TRP  40  -0.084  -1.110  -2.325
  266    HZ2  TRP  40           2HZ      TRP  40  -4.761  -2.770  -2.053
  267    HZ3  TRP  40           3HZ      TRP  40  -1.982   0.425  -2.514
  268    HH2  TRP  40           HH2      TRP  40  -4.278  -0.389  -2.393
  269    H    CYS  41           H        CYS  41   1.676  -1.720  -0.901
  270    HA   CYS  41           HA       CYS  41  -0.180  -0.748   1.032
  271   1HB   CYS  41          1HB       CYS  41   1.644   0.799   2.078
  272   2HB   CYS  41          2HB       CYS  41   1.430  -0.834   2.703
  273    H    ALA  42           H        ALA  42  -0.814   1.383   0.556
  274    HA   ALA  42           HA       ALA  42  -0.173   2.207  -2.105
  275   1HB   ALA  42          1HB       ALA  42  -2.414   2.519  -1.055
  276   2HB   ALA  42          2HB       ALA  42  -1.708   3.806  -0.077
  277   3HB   ALA  42          3HB       ALA  42  -1.752   3.957  -1.835
  278    H    THR  43           H        THR  43   0.594   4.271  -2.722
  279    HA   THR  43           HA       THR  43   2.674   5.232  -0.889
  280    HB   THR  43           HB       THR  43   3.849   5.945  -2.903
  281    HG1  THR  43           1HG      THR  43   2.952   5.652  -4.920
  282   1HG2  THR  43          1HG2      THR  43   3.972   3.697  -4.088
  283   2HG2  THR  43          2HG2      THR  43   4.356   3.719  -2.366
  284   3HG2  THR  43          3HG2      THR  43   2.780   3.145  -2.910
  285    H    THR  44           H        THR  44  -0.309   5.898  -1.470
  286    HA   THR  44           HA       THR  44   0.024   8.803  -1.256
  287    HB   THR  44           HB       THR  44  -2.125   9.038  -2.526
  288    HG1  THR  44           1HG      THR  44  -3.185   7.319  -3.011
  289   1HG2  THR  44          1HG2      THR  44  -1.250   8.655  -4.756
  290   2HG2  THR  44          2HG2      THR  44  -0.035   9.400  -3.716
  291   3HG2  THR  44          3HG2      THR  44   0.056   7.678  -4.085
  292    H    ALA  45           H        ALA  45  -1.567   9.820   0.080
  293    HA   ALA  45           HA       ALA  45  -2.310   8.387   2.362
  294   1HB   ALA  45          1HB       ALA  45  -2.087  10.917   2.064
  295   2HB   ALA  45          2HB       ALA  45  -3.754  10.871   1.481
  296   3HB   ALA  45          3HB       ALA  45  -3.372  10.331   3.117
  297    H    ASN  46           H        ASN  46  -4.116   9.097  -0.565
  298    HA   ASN  46           HA       ASN  46  -6.184   7.223   0.351
  299   1HB   ASN  46          1HB       ASN  46  -7.038   9.582   0.270
  300   2HB   ASN  46          2HB       ASN  46  -6.688   9.606  -1.456
  301   1HD2  ASN  46          1HD2      ASN  46 -10.085   8.090  -0.069
  302   2HD2  ASN  46          2HD2      ASN  46  -8.950   8.969   0.884
  303    H    TYR  47           H        TYR  47  -6.034   5.449  -0.781
  304    HA   TYR  47           HA       TYR  47  -4.625   5.394  -3.282
  305   1HB   TYR  47          1HB       TYR  47  -4.391   3.602  -1.583
  306   2HB   TYR  47          2HB       TYR  47  -6.065   3.145  -1.870
  307    HD1  TYR  47           1HD      TYR  47  -6.696   2.263  -4.171
  308    HD2  TYR  47           2HD      TYR  47  -2.668   2.822  -2.953
  309    HE1  TYR  47           1HE      TYR  47  -5.949   0.741  -5.953
  310    HE2  TYR  47           2HE      TYR  47  -1.911   1.307  -4.723
  311    HH   TYR  47           HH       TYR  47  -3.571  -0.830  -6.168
  312    H    ASP  48           H        ASP  48  -7.989   5.274  -2.298
  313    HA   ASP  48           HA       ASP  48  -9.166   4.174  -4.537
  314   1HB   ASP  48          1HB       ASP  48 -10.100   6.284  -2.623
  315   2HB   ASP  48          2HB       ASP  48 -11.105   5.790  -3.977
  316    H    ASP  49           H        ASP  49  -7.952   7.429  -4.088
  317    HA   ASP  49           HA       ASP  49  -9.012   8.349  -6.601
  318   1HB   ASP  49          1HB       ASP  49  -7.256   9.634  -4.518
  319   2HB   ASP  49          2HB       ASP  49  -7.697  10.433  -6.023
  320    H    ASP  50           H        ASP  50  -5.638   8.383  -5.371
  321    HA   ASP  50           HA       ASP  50  -4.581   8.650  -7.997
  322   1HB   ASP  50          1HB       ASP  50  -3.297   8.170  -5.329
  323   2HB   ASP  50          2HB       ASP  50  -2.355   8.251  -6.815
  324    H    ARG  51           H        ARG  51  -5.173   5.854  -6.019
  325    HA   ARG  51           HA       ARG  51  -4.707   3.667  -6.233
  326   1HB   ARG  51          1HB       ARG  51  -5.179   4.334  -9.116
  327   2HB   ARG  51          2HB       ARG  51  -5.308   2.729  -8.395
  328   1HG   ARG  51          1HG       ARG  51  -6.824   4.301  -6.748
  329   2HG   ARG  51          2HG       ARG  51  -7.189   4.942  -8.354
  330   1HD   ARG  51          1HD       ARG  51  -7.335   2.060  -7.542
  331   2HD   ARG  51          2HD       ARG  51  -8.710   3.161  -7.616
  332    HE   ARG  51           HE       ARG  51  -7.382   3.151 -10.101
  333   1HH1  ARG  51          1HH1      ARG  51  -9.403   1.126  -8.112
  334   2HH1  ARG  51          2HH1      ARG  51 -10.079   0.255  -9.452
  335   1HH2  ARG  51          1HH2      ARG  51  -8.237   2.020 -11.865
  336   2HH2  ARG  51          2HH2      ARG  51  -9.414   0.762 -11.600
  337    H    LYS  52           H        LYS  52  -2.368   4.861  -5.863
  338    HA   LYS  52           HA       LYS  52  -0.555   3.486  -7.721
  339   1HB   LYS  52          1HB       LYS  52  -0.114   5.959  -6.032
  340   2HB   LYS  52          2HB       LYS  52   1.208   5.064  -6.770
  341   1HG   LYS  52          1HG       LYS  52   0.529   5.608  -8.936
  342   2HG   LYS  52          2HG       LYS  52  -1.076   6.100  -8.403
  343   1HD   LYS  52          1HD       LYS  52   0.005   7.973  -7.146
  344   2HD   LYS  52          2HD       LYS  52   1.536   7.511  -7.890
  345   1HE   LYS  52          1HE       LYS  52   0.598   7.901 -10.104
  346   2HE   LYS  52          2HE       LYS  52  -0.953   8.322  -9.377
  347   1HZ   LYS  52          1HZ       LYS  52   1.317   9.834  -8.396
  348   2HZ   LYS  52          2HZ       LYS  52   0.926  10.102 -10.028
  349   3HZ   LYS  52          3HZ       LYS  52  -0.239  10.359  -8.818
  350    H    TRP  53           H        TRP  53   0.389   1.768  -6.920
  351    HA   TRP  53           HA       TRP  53   0.584   1.520  -3.997
  352   1HB   TRP  53          1HB       TRP  53  -0.203  -0.739  -4.165
  353   2HB   TRP  53          2HB       TRP  53  -1.335   0.292  -4.947
  354    HD1  TRP  53           HD1      TRP  53  -0.931   0.402  -7.827
  355    HE1  TRP  53           1HE      TRP  53  -0.403  -1.619  -9.345
  356    HE3  TRP  53           3HE      TRP  53   0.728  -2.722  -4.266
  357    HZ2  TRP  53           2HZ      TRP  53   0.614  -4.271  -9.007
  358    HZ3  TRP  53           3HZ      TRP  53   1.489  -5.007  -4.888
  359    HH2  TRP  53           HH2      TRP  53   1.428  -5.755  -7.221
  360    H    GLY  54           H        GLY  54   1.786  -0.460  -3.389
  361   1HA   GLY  54          1HA       GLY  54   3.879  -1.481  -5.022
  362   2HA   GLY  54          2HA       GLY  54   4.481  -0.261  -3.898
  363    H    PHE  55           H        PHE  55   4.742  -3.282  -4.071
  364    HA   PHE  55           HA       PHE  55   3.387  -4.549  -2.029
  365   1HB   PHE  55          1HB       PHE  55   6.114  -5.000  -3.219
  366   2HB   PHE  55          2HB       PHE  55   5.457  -6.043  -1.968
  367    HD1  PHE  55           1HD      PHE  55   2.569  -5.913  -2.972
  368    HD2  PHE  55           2HD      PHE  55   6.268  -6.649  -4.939
  369    HE1  PHE  55           1HE      PHE  55   1.401  -7.331  -4.613
  370    HE2  PHE  55           2HE      PHE  55   5.103  -8.055  -6.599
  371    HZ   PHE  55           HZ       PHE  55   2.674  -8.391  -6.440
  372    H    CYS  56           H        CYS  56   3.971  -5.125   0.060
  373    HA   CYS  56           HA       CYS  56   4.952  -3.010   1.657
  374   1HB   CYS  56          1HB       CYS  56   3.206  -4.738   2.300
  375   2HB   CYS  56          2HB       CYS  56   4.528  -5.882   2.491
  376    HA   PRO  57           HA       PRO  57   9.248  -4.121   1.526
  377   1HB   PRO  57          1HB       PRO  57  10.220  -2.436   3.323
  378   2HB   PRO  57          2HB       PRO  57   9.568  -1.836   1.785
  379   1HG   PRO  57          1HG       PRO  57   8.200  -2.106   4.429
  380   2HG   PRO  57          2HG       PRO  57   8.304  -0.652   3.415
  381   1HD   PRO  57          1HD       PRO  57   6.139  -2.237   3.375
  382   2HD   PRO  57          2HD       PRO  57   6.755  -1.502   1.876
  383    H    ASP  58           H        ASP  58   7.168  -4.941   3.700
  384    HA   ASP  58           HA       ASP  58   9.084  -6.414   5.382
  385   1HB   ASP  58          1HB       ASP  58   7.894  -4.547   6.606
  386   2HB   ASP  58          2HB       ASP  58   6.387  -5.406   6.314
  387    H    GLN  59           H        GLN  59   8.776  -8.032   3.667
  388    HA   GLN  59           HA       GLN  59   6.230  -9.492   3.924
  389   1HB   GLN  59          1HB       GLN  59   8.230  -9.536   1.657
  390   2HB   GLN  59          2HB       GLN  59   6.782 -10.528   1.740
  391   1HG   GLN  59          1HG       GLN  59   5.414  -8.515   1.722
  392   2HG   GLN  59          2HG       GLN  59   6.873  -7.525   1.630
  393   1HE2  GLN  59          1HE2      GLN  59   5.178  -8.709  -1.699
  394   2HE2  GLN  59          2HE2      GLN  59   4.428  -8.596  -0.147
  395    H    GLY  60           H        GLY  60   9.702  -9.704   4.110
  396   1HA   GLY  60          1HA       GLY  60   9.871 -11.720   5.928
  397   2HA   GLY  60          2HA       GLY  60   9.768 -12.563   4.392
  Start of MODEL   43
    1    H    SER   1           1H       SER   1  12.357   5.909  -1.912
    2    HA   SER   1           HA       SER   1  14.640   5.537  -1.115
    3   1HB   SER   1          1HB       SER   1  13.288   7.581  -0.698
    4   2HB   SER   1          2HB       SER   1  12.649   6.834   0.768
    5    HG   SER   1           HG       SER   1  14.440   7.273   1.789
    6    H    TRP   2           H        TRP   2  15.205   3.417  -0.563
    7    HA   TRP   2           HA       TRP   2  15.767   1.684   0.773
    8   1HB   TRP   2          1HB       TRP   2  15.394   3.715   2.989
    9   2HB   TRP   2          2HB       TRP   2  16.239   2.175   3.141
   10    HD1  TRP   2           HD1      TRP   2  16.567   5.524   1.209
   11    HE1  TRP   2           1HE      TRP   2  19.066   5.923   0.736
   12    HE3  TRP   2           3HE      TRP   2  18.437   1.145   3.088
   13    HZ2  TRP   2           2HZ      TRP   2  21.505   4.561   1.140
   14    HZ3  TRP   2           3HZ      TRP   2  20.872   0.777   3.013
   15    HH2  TRP   2           HH2      TRP   2  22.371   2.455   2.057
   16    H    MET   3           H        MET   3  13.813   2.924   3.375
   17    HA   MET   3           HA       MET   3  12.261   0.515   3.431
   18   1HB   MET   3          1HB       MET   3  11.173   1.606   5.419
   19   2HB   MET   3          2HB       MET   3  12.909   1.395   5.559
   20   1HG   MET   3          1HG       MET   3  13.301   3.716   5.210
   21   2HG   MET   3          2HG       MET   3  11.635   3.982   4.698
   22   1HE   MET   3          1HE       MET   3  12.935   5.841   6.498
   23   2HE   MET   3          2HE       MET   3  11.187   6.056   6.576
   24   3HE   MET   3          3HE       MET   3  12.129   5.952   8.064
   25    H    SER   4           H        SER   4  11.431   0.989   1.212
   26    HA   SER   4           HA       SER   4   8.883   2.419   1.440
   27   1HB   SER   4          1HB       SER   4  10.768   2.655  -0.912
   28   2HB   SER   4          2HB       SER   4   9.192   3.433  -0.755
   29    HG   SER   4           HG       SER   4  10.503   4.105   1.399
   30    H    THR   5           H        THR   5   8.013   2.020  -1.142
   31    HA   THR   5           HA       THR   5   7.097  -0.646  -1.020
   32    HB   THR   5           HB       THR   5   6.047  -0.099  -3.218
   33    HG1  THR   5           1HG      THR   5   6.937   2.541  -2.929
   34   1HG2  THR   5          1HG2      THR   5   5.397   2.331  -1.789
   35   2HG2  THR   5          2HG2      THR   5   4.389   0.935  -2.174
   36   3HG2  THR   5          3HG2      THR   5   5.419   0.911  -0.742
   37    H    VAL   6           H        VAL   6   7.216  -2.208  -2.726
   38    HA   VAL   6           HA       VAL   6   9.753  -2.285  -4.121
   39    HB   VAL   6           HB       VAL   6  10.275  -4.004  -2.793
   40   1HG1  VAL   6          1HG1      VAL   6   7.384  -4.295  -2.093
   41   2HG1  VAL   6          2HG1      VAL   6   8.686  -5.251  -1.390
   42   3HG1  VAL   6          3HG1      VAL   6   8.640  -3.506  -1.140
   43   1HG2  VAL   6          1HG2      VAL   6   9.161  -5.041  -5.015
   44   2HG2  VAL   6          2HG2      VAL   6   9.976  -5.996  -3.776
   45   3HG2  VAL   6          3HG2      VAL   6   8.221  -5.844  -3.756
   46    H    GLY   7           H        GLY   7   6.752  -3.599  -3.839
   47   1HA   GLY   7          1HA       GLY   7   6.387  -4.342  -6.589
   48   2HA   GLY   7          2HA       GLY   7   5.226  -4.566  -5.308
   49    H    GLY   8           H        GLY   8   3.713  -3.803  -7.003
   50   1HA   GLY   8          1HA       GLY   8   2.200  -2.140  -7.512
   51   2HA   GLY   8          2HA       GLY   8   3.124  -1.048  -6.504
   52    H    ASN   9           H        ASN   9   2.291   0.286  -8.419
   53    HA   ASN   9           HA       ASN   9   4.141   0.098 -10.673
   54   1HB   ASN   9          1HB       ASN   9   2.662   1.719 -11.818
   55   2HB   ASN   9          2HB       ASN   9   1.843   0.240 -11.362
   56   1HD2  ASN   9          1HD2      ASN   9   0.697   2.774  -8.580
   57   2HD2  ASN   9          2HD2      ASN   9   2.204   1.932  -8.614
   58    H    SER  10           H        SER  10   3.901   1.685  -7.759
   59    HA   SER  10           HA       SER  10   4.956   4.223  -8.567
   60   1HB   SER  10          1HB       SER  10   5.044   2.983  -5.807
   61   2HB   SER  10          2HB       SER  10   5.125   4.686  -6.219
   62    HG   SER  10           HG       SER  10   3.017   3.971  -5.498
   63    H    GLY  11           H        GLY  11   6.334   1.532  -6.666
   64   1HA   GLY  11          1HA       GLY  11   8.442   0.639  -6.600
   65   2HA   GLY  11          2HA       GLY  11   8.712   1.361  -8.174
   66    H    GLY  12           H        GLY  12   9.001   1.791  -4.717
   67   1HA   GLY  12          1HA       GLY  12  11.053   2.803  -3.920
   68   2HA   GLY  12          2HA       GLY  12  10.980   3.901  -5.289
   69    H    ALA  13           H        ALA  13   7.985   4.227  -4.741
   70    HA   ALA  13           HA       ALA  13   8.290   6.501  -3.019
   71   1HB   ALA  13          1HB       ALA  13   6.492   5.756  -4.987
   72   2HB   ALA  13          2HB       ALA  13   5.541   5.720  -3.503
   73   3HB   ALA  13          3HB       ALA  13   6.396   7.192  -3.970
   74    HA   PRO  14           HA       PRO  14   7.304   4.384   0.727
   75   1HB   PRO  14          1HB       PRO  14   6.784   6.540   2.311
   76   2HB   PRO  14          2HB       PRO  14   8.411   6.051   1.834
   77   1HG   PRO  14          1HG       PRO  14   6.773   8.320   0.897
   78   2HG   PRO  14          2HG       PRO  14   8.534   8.127   0.907
   79   1HD   PRO  14          1HD       PRO  14   6.788   7.842  -1.302
   80   2HD   PRO  14          2HD       PRO  14   8.515   7.445  -1.248
   81    H    CYS  15           H        CYS  15   5.527   3.703   1.950
   82    HA   CYS  15           HA       CYS  15   2.955   4.317   0.792
   83   1HB   CYS  15          1HB       CYS  15   3.755   2.483   3.068
   84   2HB   CYS  15          2HB       CYS  15   2.114   2.626   2.440
   85    H    VAL  16           H        VAL  16   1.301   5.464   1.697
   86    HA   VAL  16           HA       VAL  16   1.970   7.116   4.022
   87    HB   VAL  16           HB       VAL  16  -0.225   7.419   1.957
   88   1HG1  VAL  16          1HG1      VAL  16  -0.636   8.344   4.323
   89   2HG1  VAL  16          2HG1      VAL  16   0.584   9.547   3.899
   90   3HG1  VAL  16          3HG1      VAL  16  -0.891   9.412   2.941
   91   1HG2  VAL  16          1HG2      VAL  16   2.552   8.303   2.079
   92   2HG2  VAL  16          2HG2      VAL  16   1.455   8.187   0.704
   93   3HG2  VAL  16          3HG2      VAL  16   1.405   9.605   1.753
   94    H    PHE  17           H        PHE  17   1.049   6.727   5.937
   95    HA   PHE  17           HA       PHE  17  -1.427   5.160   6.001
   96   1HB   PHE  17          1HB       PHE  17   0.964   4.991   7.827
   97   2HB   PHE  17          2HB       PHE  17  -0.584   4.251   8.176
   98    HD1  PHE  17           1HD      PHE  17  -1.489   2.836   5.972
   99    HD2  PHE  17           2HD      PHE  17   2.542   3.577   7.099
  100    HE1  PHE  17           1HE      PHE  17  -0.782   0.850   4.725
  101    HE2  PHE  17           2HE      PHE  17   3.269   1.585   5.856
  102    HZ   PHE  17           HZ       PHE  17   1.620   0.198   4.646
  103    HA   PRO  18           HA       PRO  18  -2.817   4.596   7.165
  104   1HB   PRO  18          1HB       PRO  18  -5.423   5.395   7.761
  105   2HB   PRO  18          2HB       PRO  18  -4.342   4.504   8.835
  106   1HG   PRO  18          1HG       PRO  18  -5.305   7.164   9.146
  107   2HG   PRO  18          2HG       PRO  18  -4.145   6.310  10.172
  108   1HD   PRO  18          1HD       PRO  18  -3.665   8.322   8.064
  109   2HD   PRO  18          2HD       PRO  18  -2.645   7.867   9.443
  110    H    PHE  19           H        PHE  19  -3.532   4.070   5.151
  111    HA   PHE  19           HA       PHE  19  -4.588   6.313   3.563
  112   1HB   PHE  19          1HB       PHE  19  -3.921   5.169   1.564
  113   2HB   PHE  19          2HB       PHE  19  -2.548   5.209   2.650
  114    HD1  PHE  19           1HD      PHE  19  -5.011   3.096   0.980
  115    HD2  PHE  19           2HD      PHE  19  -1.663   3.184   3.608
  116    HE1  PHE  19           1HE      PHE  19  -4.700   0.686   0.655
  117    HE2  PHE  19           2HE      PHE  19  -1.361   0.764   3.292
  118    HZ   PHE  19           HZ       PHE  19  -2.871  -0.487   1.813
  119    H    THR  20           H        THR  20  -5.982   4.972   1.616
  120    HA   THR  20           HA       THR  20  -7.839   3.233   3.037
  121    HB   THR  20           HB       THR  20  -8.720   5.818   1.703
  122    HG1  THR  20           1HG      THR  20  -7.853   5.329   4.206
  123   1HG2  THR  20          1HG2      THR  20 -10.550   4.411   3.516
  124   2HG2  THR  20          2HG2      THR  20 -10.868   5.281   2.017
  125   3HG2  THR  20          3HG2      THR  20 -10.259   3.627   1.961
  126    H    PHE  21           H        PHE  21  -8.412   1.614   1.791
  127    HA   PHE  21           HA       PHE  21  -8.248   1.977  -1.138
  128   1HB   PHE  21          1HB       PHE  21  -6.573   0.372  -0.147
  129   2HB   PHE  21          2HB       PHE  21  -7.922  -0.589   0.409
  130    HD1  PHE  21           1HD      PHE  21  -6.187   0.617  -2.589
  131    HD2  PHE  21           2HD      PHE  21  -9.117  -2.063  -1.078
  132    HE1  PHE  21           1HE      PHE  21  -6.140  -0.602  -4.708
  133    HE2  PHE  21           2HE      PHE  21  -9.074  -3.290  -3.199
  134    HZ   PHE  21           HZ       PHE  21  -7.598  -2.576  -5.024
  135    H    LEU  22           H        LEU  22  -9.934   1.570  -2.236
  136    HA   LEU  22           HA       LEU  22 -12.135   1.410  -2.672
  137   1HB   LEU  22          1HB       LEU  22 -10.816  -1.142  -2.050
  138   2HB   LEU  22          2HB       LEU  22 -12.479  -1.162  -2.610
  139    HG   LEU  22           HG       LEU  22 -10.801  -1.475  -4.408
  140   1HD1  LEU  22          1HD1      LEU  22 -13.018   0.202  -4.292
  141   2HD1  LEU  22          2HD1      LEU  22 -11.811   0.971  -5.329
  142   3HD1  LEU  22          3HD1      LEU  22 -12.364  -0.668  -5.684
  143   1HD2  LEU  22          1HD2      LEU  22  -9.242   0.287  -3.309
  144   2HD2  LEU  22          2HD2      LEU  22  -9.287   0.087  -5.061
  145   3HD2  LEU  22          3HD2      LEU  22 -10.177   1.408  -4.301
  146    H    GLY  23           H        GLY  23 -12.111   2.409  -0.167
  147   1HA   GLY  23          1HA       GLY  23 -14.084   2.768   1.157
  148   2HA   GLY  23          2HA       GLY  23 -14.475   1.076   0.965
  149    H    ASN  24           H        ASN  24 -11.392   0.606   1.823
  150    HA   ASN  24           HA       ASN  24 -12.076   0.864   4.682
  151   1HB   ASN  24          1HB       ASN  24 -10.195  -1.162   3.481
  152   2HB   ASN  24          2HB       ASN  24 -10.884  -1.146   5.095
  153   1HD2  ASN  24          1HD2      ASN  24 -12.690  -3.109   2.196
  154   2HD2  ASN  24          2HD2      ASN  24 -11.069  -2.521   2.149
  155    H    LYS  25           H        LYS  25 -10.668   1.837   6.053
  156    HA   LYS  25           HA       LYS  25  -8.404   3.229   4.976
  157   1HB   LYS  25          1HB       LYS  25  -9.479   2.986   7.798
  158   2HB   LYS  25          2HB       LYS  25  -8.311   4.147   7.238
  159   1HG   LYS  25          1HG       LYS  25  -9.883   5.306   5.919
  160   2HG   LYS  25          2HG       LYS  25 -11.053   3.994   6.074
  161   1HD   LYS  25          1HD       LYS  25 -11.895   5.536   7.559
  162   2HD   LYS  25          2HD       LYS  25 -10.904   4.542   8.631
  163   1HE   LYS  25          1HE       LYS  25  -9.919   7.086   7.340
  164   2HE   LYS  25          2HE       LYS  25 -10.723   7.059   8.906
  165   1HZ   LYS  25          1HZ       LYS  25  -8.663   5.144   8.946
  166   2HZ   LYS  25          2HZ       LYS  25  -8.025   6.597   8.339
  167   3HZ   LYS  25          3HZ       LYS  25  -8.797   6.571   9.853
  168    H    TYR  26           H        TYR  26  -6.313   2.444   5.022
  169    HA   TYR  26           HA       TYR  26  -5.838   0.100   6.739
  170   1HB   TYR  26          1HB       TYR  26  -4.471   0.850   4.161
  171   2HB   TYR  26          2HB       TYR  26  -4.150  -0.579   5.130
  172    HD1  TYR  26           1HD      TYR  26  -7.120  -1.136   5.803
  173    HD2  TYR  26           2HD      TYR  26  -5.108  -0.285   2.165
  174    HE1  TYR  26           1HE      TYR  26  -8.827  -2.384   4.565
  175    HE2  TYR  26           2HE      TYR  26  -6.803  -1.523   0.924
  176    HH   TYR  26           HH       TYR  26  -8.815  -3.682   2.174
  177    H    GLU  27           H        GLU  27  -4.528   0.309   8.282
  178    HA   GLU  27           HA       GLU  27  -2.806   2.637   8.520
  179   1HB   GLU  27          1HB       GLU  27  -3.439   0.467  10.509
  180   2HB   GLU  27          2HB       GLU  27  -2.682   2.004  10.841
  181   1HG   GLU  27          1HG       GLU  27  -4.702   3.186  10.315
  182   2HG   GLU  27          2HG       GLU  27  -5.478   1.691   9.798
  183    H    SER  28           H        SER  28  -2.712  -0.699   7.837
  184    HA   SER  28           HA       SER  28   0.221  -0.634   7.871
  185   1HB   SER  28          1HB       SER  28   0.044  -3.121   8.372
  186   2HB   SER  28          2HB       SER  28  -0.381  -2.049   9.705
  187    HG   SER  28           HG       SER  28  -1.857  -3.947   8.571
  188    H    CYS  29           H        CYS  29   0.781  -2.945   6.509
  189    HA   CYS  29           HA       CYS  29  -0.016  -2.271   3.881
  190   1HB   CYS  29          1HB       CYS  29   1.273  -4.806   4.881
  191   2HB   CYS  29          2HB       CYS  29   1.081  -4.377   3.202
  192    H    THR  30           H        THR  30  -1.096  -3.769   2.421
  193    HA   THR  30           HA       THR  30  -3.177  -5.383   3.714
  194    HB   THR  30           HB       THR  30  -4.106  -3.104   3.276
  195    HG1  THR  30           1HG      THR  30  -5.455  -4.959   3.063
  196   1HG2  THR  30          1HG2      THR  30  -4.579  -2.640   0.791
  197   2HG2  THR  30          2HG2      THR  30  -2.989  -2.224   1.434
  198   3HG2  THR  30          3HG2      THR  30  -3.201  -3.694   0.483
  199    H    SER  31           H        SER  31  -4.412  -6.606   2.045
  200    HA   SER  31           HA       SER  31  -2.743  -7.284  -0.269
  201   1HB   SER  31          1HB       SER  31  -3.525  -9.664   0.031
  202   2HB   SER  31          2HB       SER  31  -2.445  -9.081   1.309
  203    HG   SER  31           HG       SER  31  -4.193 -10.136   2.252
  204    H    ALA  32           H        ALA  32  -4.986  -5.496   0.319
  205    HA   ALA  32           HA       ALA  32  -7.427  -6.428  -0.700
  206   1HB   ALA  32          1HB       ALA  32  -7.207  -4.387   0.640
  207   2HB   ALA  32          2HB       ALA  32  -6.310  -3.621  -0.670
  208   3HB   ALA  32          3HB       ALA  32  -8.004  -4.051  -0.898
  209    H    GLY  33           H        GLY  33  -8.266  -6.559  -2.695
  210   1HA   GLY  33          1HA       GLY  33  -8.431  -6.339  -4.996
  211   2HA   GLY  33          2HA       GLY  33  -7.023  -5.281  -4.962
  212    H    ARG  34           H        ARG  34  -5.993  -7.800  -3.234
  213    HA   ARG  34           HA       ARG  34  -4.930  -9.177  -5.604
  214   1HB   ARG  34          1HB       ARG  34  -3.744  -9.170  -2.831
  215   2HB   ARG  34          2HB       ARG  34  -2.996  -9.698  -4.321
  216   1HG   ARG  34          1HG       ARG  34  -3.405  -7.169  -5.002
  217   2HG   ARG  34          2HG       ARG  34  -3.362  -6.963  -3.253
  218   1HD   ARG  34          1HD       ARG  34  -1.156  -6.672  -4.301
  219   2HD   ARG  34          2HD       ARG  34  -1.189  -8.004  -3.144
  220    HE   ARG  34           HE       ARG  34  -0.750  -9.462  -4.851
  221   1HH1  ARG  34          1HH1      ARG  34  -1.772  -6.397  -6.238
  222   2HH1  ARG  34          2HH1      ARG  34  -1.500  -6.919  -7.875
  223   1HH2  ARG  34          1HH2      ARG  34  -0.461 -10.143  -7.015
  224   2HH2  ARG  34          2HH2      ARG  34  -0.726  -9.015  -8.311
  225    H    SER  35           H        SER  35  -4.386 -11.506  -5.206
  226    HA   SER  35           HA       SER  35  -6.050 -12.827  -3.212
  227   1HB   SER  35          1HB       SER  35  -6.964 -14.371  -5.004
  228   2HB   SER  35          2HB       SER  35  -7.606 -12.728  -5.020
  229    HG   SER  35           HG       SER  35  -6.728 -13.855  -7.074
  230    H    ASP  36           H        ASP  36  -3.133 -12.465  -4.178
  231    HA   ASP  36           HA       ASP  36  -2.407 -15.269  -4.518
  232   1HB   ASP  36          1HB       ASP  36  -0.046 -14.121  -4.719
  233   2HB   ASP  36          2HB       ASP  36  -1.157 -14.150  -6.074
  234    H    GLY  37           H        GLY  37  -0.645 -12.748  -2.946
  235   1HA   GLY  37          1HA       GLY  37  -0.962 -13.475  -0.292
  236   2HA   GLY  37          2HA       GLY  37   0.429 -14.355  -0.911
  237    H    LYS  38           H        LYS  38   0.669 -11.933  -2.821
  238    HA   LYS  38           HA       LYS  38   2.707 -10.565  -1.397
  239   1HB   LYS  38          1HB       LYS  38   1.257  -9.589  -3.867
  240   2HB   LYS  38          2HB       LYS  38   2.884  -9.193  -3.355
  241   1HG   LYS  38          1HG       LYS  38   3.725 -11.255  -3.984
  242   2HG   LYS  38          2HG       LYS  38   2.126 -11.996  -4.061
  243   1HD   LYS  38          1HD       LYS  38   1.634 -10.388  -5.958
  244   2HD   LYS  38          2HD       LYS  38   3.350  -9.984  -5.941
  245   1HE   LYS  38          1HE       LYS  38   2.964 -11.630  -7.639
  246   2HE   LYS  38          2HE       LYS  38   3.877 -12.375  -6.324
  247   1HZ   LYS  38          1HZ       LYS  38   0.934 -12.570  -6.336
  248   2HZ   LYS  38          2HZ       LYS  38   1.827 -13.583  -7.359
  249   3HZ   LYS  38          3HZ       LYS  38   2.081 -13.640  -5.677
  250    H    MET  39           H        MET  39   2.431  -8.956   0.085
  251    HA   MET  39           HA       MET  39  -0.155  -7.592   0.112
  252   1HB   MET  39          1HB       MET  39   2.015  -7.518   2.213
  253   2HB   MET  39          2HB       MET  39   0.366  -6.936   2.353
  254   1HG   MET  39          1HG       MET  39  -0.425  -9.268   2.061
  255   2HG   MET  39          2HG       MET  39   1.260  -9.789   2.137
  256   1HE   MET  39          1HE       MET  39   2.832  -9.119   4.024
  257   2HE   MET  39          2HE       MET  39   2.281  -7.550   4.610
  258   3HE   MET  39          3HE       MET  39   2.348  -8.929   5.708
  259    H    TRP  40           H        TRP  40  -0.234  -5.302   0.231
  260    HA   TRP  40           HA       TRP  40   2.218  -3.882  -0.527
  261   1HB   TRP  40          1HB       TRP  40   1.007  -2.755  -2.356
  262   2HB   TRP  40          2HB       TRP  40   1.074  -4.499  -2.615
  263    HD1  TRP  40           HD1      TRP  40  -1.346  -5.855  -1.940
  264    HE1  TRP  40           1HE      TRP  40  -3.764  -5.005  -2.183
  265    HE3  TRP  40           3HE      TRP  40  -0.417  -0.865  -2.326
  266    HZ2  TRP  40           2HZ      TRP  40  -5.095  -2.545  -2.464
  267    HZ3  TRP  40           3HZ      TRP  40  -2.311   0.679  -2.545
  268    HH2  TRP  40           HH2      TRP  40  -4.602  -0.147  -2.618
  269    H    CYS  41           H        CYS  41   1.237  -1.429  -0.997
  270    HA   CYS  41           HA       CYS  41  -0.760  -0.567   0.837
  271   1HB   CYS  41          1HB       CYS  41   0.906   0.977   2.098
  272   2HB   CYS  41          2HB       CYS  41   0.719  -0.690   2.622
  273    H    ALA  42           H        ALA  42  -1.317   1.625   0.569
  274    HA   ALA  42           HA       ALA  42  -0.731   2.621  -2.039
  275   1HB   ALA  42          1HB       ALA  42  -2.849   2.910  -0.406
  276   2HB   ALA  42          2HB       ALA  42  -2.020   4.436  -0.101
  277   3HB   ALA  42          3HB       ALA  42  -2.497   4.005  -1.744
  278    H    THR  43           H        THR  43   0.308   4.522  -2.615
  279    HA   THR  43           HA       THR  43   2.298   5.395  -0.656
  280    HB   THR  43           HB       THR  43   3.578   6.187  -2.593
  281    HG1  THR  43           1HG      THR  43   2.391   6.687  -4.260
  282   1HG2  THR  43          1HG2      THR  43   3.994   4.046  -3.703
  283   2HG2  THR  43          2HG2      THR  43   3.891   3.872  -1.951
  284   3HG2  THR  43          3HG2      THR  43   2.533   3.388  -2.966
  285    H    THR  44           H        THR  44  -0.640   6.195  -1.360
  286    HA   THR  44           HA       THR  44  -0.215   9.068  -0.979
  287    HB   THR  44           HB       THR  44  -2.273   9.474  -2.339
  288    HG1  THR  44           1HG      THR  44  -3.403   7.848  -2.975
  289   1HG2  THR  44          1HG2      THR  44  -0.918   8.209  -4.470
  290   2HG2  THR  44          2HG2      THR  44  -0.917   9.913  -4.018
  291   3HG2  THR  44          3HG2      THR  44   0.297   8.823  -3.346
  292    H    ALA  45           H        ALA  45  -2.014  10.107   0.195
  293    HA   ALA  45           HA       ALA  45  -2.786   8.668   2.472
  294   1HB   ALA  45          1HB       ALA  45  -2.721  11.263   1.944
  295   2HB   ALA  45          2HB       ALA  45  -4.441  10.995   1.649
  296   3HB   ALA  45          3HB       ALA  45  -3.742  10.594   3.219
  297    H    ASN  46           H        ASN  46  -4.548   9.310  -0.520
  298    HA   ASN  46           HA       ASN  46  -6.492   7.300   0.352
  299   1HB   ASN  46          1HB       ASN  46  -7.443   9.665   0.295
  300   2HB   ASN  46          2HB       ASN  46  -7.221   9.611  -1.451
  301   1HD2  ASN  46          1HD2      ASN  46 -10.436   8.028   0.224
  302   2HD2  ASN  46          2HD2      ASN  46  -9.308   9.040   1.040
  303    H    TYR  47           H        TYR  47  -6.190   5.574  -0.823
  304    HA   TYR  47           HA       TYR  47  -4.682   5.559  -3.213
  305   1HB   TYR  47          1HB       TYR  47  -4.796   3.678  -1.593
  306   2HB   TYR  47          2HB       TYR  47  -6.445   3.364  -2.124
  307    HD1  TYR  47           1HD      TYR  47  -2.903   3.293  -3.136
  308    HD2  TYR  47           2HD      TYR  47  -6.887   2.270  -4.188
  309    HE1  TYR  47           1HE      TYR  47  -2.056   1.864  -4.943
  310    HE2  TYR  47           2HE      TYR  47  -6.047   0.832  -5.990
  311    HH   TYR  47           HH       TYR  47  -4.146   0.566  -7.363
  312    H    ASP  48           H        ASP  48  -8.178   5.294  -2.617
  313    HA   ASP  48           HA       ASP  48  -9.014   4.549  -5.138
  314   1HB   ASP  48          1HB       ASP  48 -10.302   6.342  -3.098
  315   2HB   ASP  48          2HB       ASP  48 -11.107   5.886  -4.590
  316    H    ASP  49           H        ASP  49  -7.993   7.683  -4.033
  317    HA   ASP  49           HA       ASP  49  -8.892   9.160  -6.292
  318   1HB   ASP  49          1HB       ASP  49  -7.017   9.753  -4.018
  319   2HB   ASP  49          2HB       ASP  49  -7.254  10.895  -5.332
  320    H    ASP  50           H        ASP  50  -5.518   8.672  -5.224
  321    HA   ASP  50           HA       ASP  50  -4.580   9.203  -7.908
  322   1HB   ASP  50          1HB       ASP  50  -3.189   8.813  -5.275
  323   2HB   ASP  50          2HB       ASP  50  -2.294   8.948  -6.785
  324    H    ARG  51           H        ARG  51  -5.198   6.372  -6.087
  325    HA   ARG  51           HA       ARG  51  -4.641   4.202  -6.302
  326   1HB   ARG  51          1HB       ARG  51  -5.001   4.958  -9.180
  327   2HB   ARG  51          2HB       ARG  51  -5.115   3.326  -8.523
  328   1HG   ARG  51          1HG       ARG  51  -6.773   4.692  -6.878
  329   2HG   ARG  51          2HG       ARG  51  -7.029   5.533  -8.414
  330   1HD   ARG  51          1HD       ARG  51  -7.140   2.564  -8.041
  331   2HD   ARG  51          2HD       ARG  51  -8.550   3.619  -7.993
  332    HE   ARG  51           HE       ARG  51  -7.198   2.659 -10.320
  333   1HH1  ARG  51          1HH1      ARG  51  -9.069   5.317  -9.051
  334   2HH1  ARG  51          2HH1      ARG  51  -9.564   5.887 -10.618
  335   1HH2  ARG  51          1HH2      ARG  51  -7.878   3.342 -12.364
  336   2HH2  ARG  51          2HH2      ARG  51  -8.884   4.755 -12.507
  337    H    LYS  52           H        LYS  52  -2.361   5.226  -5.703
  338    HA   LYS  52           HA       LYS  52  -0.504   3.904  -7.543
  339   1HB   LYS  52          1HB       LYS  52  -0.030   6.381  -5.889
  340   2HB   LYS  52          2HB       LYS  52   1.291   5.403  -6.522
  341   1HG   LYS  52          1HG       LYS  52   0.334   5.716  -8.800
  342   2HG   LYS  52          2HG       LYS  52  -0.813   6.859  -8.107
  343   1HD   LYS  52          1HD       LYS  52   1.086   8.041  -9.078
  344   2HD   LYS  52          2HD       LYS  52   1.071   8.243  -7.323
  345   1HE   LYS  52          1HE       LYS  52   2.827   6.676  -7.032
  346   2HE   LYS  52          2HE       LYS  52   2.692   6.106  -8.695
  347   1HZ   LYS  52          1HZ       LYS  52   3.506   8.877  -7.990
  348   2HZ   LYS  52          2HZ       LYS  52   4.609   7.606  -8.222
  349   3HZ   LYS  52          3HZ       LYS  52   3.611   8.109  -9.504
  350    H    TRP  53           H        TRP  53   0.258   2.124  -6.770
  351    HA   TRP  53           HA       TRP  53   0.403   1.783  -3.858
  352   1HB   TRP  53          1HB       TRP  53  -0.421  -0.458  -4.167
  353   2HB   TRP  53          2HB       TRP  53  -1.514   0.669  -4.872
  354    HD1  TRP  53           HD1      TRP  53  -1.052   0.953  -7.758
  355    HE1  TRP  53           1HE      TRP  53  -0.671  -1.013  -9.386
  356    HE3  TRP  53           3HE      TRP  53   0.315  -2.483  -4.371
  357    HZ2  TRP  53           2HZ      TRP  53   0.141  -3.751  -9.195
  358    HZ3  TRP  53           3HZ      TRP  53   0.898  -4.783  -5.112
  359    HH2  TRP  53           HH2      TRP  53   0.808  -5.394  -7.486
  360    H    GLY  54           H        GLY  54   1.606  -0.141  -3.234
  361   1HA   GLY  54          1HA       GLY  54   3.722  -1.133  -4.894
  362   2HA   GLY  54          2HA       GLY  54   4.286   0.036  -3.701
  363    H    PHE  55           H        PHE  55   4.772  -2.895  -3.915
  364    HA   PHE  55           HA       PHE  55   3.293  -4.272  -1.976
  365   1HB   PHE  55          1HB       PHE  55   5.948  -4.713  -3.288
  366   2HB   PHE  55          2HB       PHE  55   5.437  -5.757  -1.981
  367    HD1  PHE  55           1HD      PHE  55   2.403  -5.128  -3.153
  368    HD2  PHE  55           2HD      PHE  55   6.015  -6.899  -4.544
  369    HE1  PHE  55           1HE      PHE  55   1.117  -6.521  -4.717
  370    HE2  PHE  55           2HE      PHE  55   4.733  -8.295  -6.112
  371    HZ   PHE  55           HZ       PHE  55   2.279  -8.084  -6.208
  372    H    CYS  56           H        CYS  56   4.059  -5.163   0.004
  373    HA   CYS  56           HA       CYS  56   4.907  -3.154   1.843
  374   1HB   CYS  56          1HB       CYS  56   3.326  -5.257   2.136
  375   2HB   CYS  56          2HB       CYS  56   4.830  -6.088   2.501
  376    HA   PRO  57           HA       PRO  57   9.296  -3.831   1.644
  377   1HB   PRO  57          1HB       PRO  57  10.083  -2.892   4.006
  378   2HB   PRO  57          2HB       PRO  57   9.408  -1.824   2.765
  379   1HG   PRO  57          1HG       PRO  57   8.004  -3.177   5.023
  380   2HG   PRO  57          2HG       PRO  57   8.021  -1.437   4.658
  381   1HD   PRO  57          1HD       PRO  57   5.977  -2.947   3.871
  382   2HD   PRO  57          2HD       PRO  57   6.660  -1.739   2.755
  383    H    ASP  58           H        ASP  58  10.806  -4.240   4.038
  384    HA   ASP  58           HA       ASP  58  11.197  -6.987   3.994
  385   1HB   ASP  58          1HB       ASP  58  12.789  -5.255   4.910
  386   2HB   ASP  58          2HB       ASP  58  11.801  -5.217   6.365
  387    H    GLN  59           H        GLN  59  10.262  -8.679   4.942
  388    HA   GLN  59           HA       GLN  59   8.087  -8.156   6.841
  389   1HB   GLN  59          1HB       GLN  59   8.623 -10.623   5.174
  390   2HB   GLN  59          2HB       GLN  59   7.214 -10.353   6.199
  391   1HG   GLN  59          1HG       GLN  59   6.540  -8.504   4.786
  392   2HG   GLN  59          2HG       GLN  59   7.978  -8.709   3.789
  393   1HE2  GLN  59          1HE2      GLN  59   4.690 -10.621   2.830
  394   2HE2  GLN  59          2HE2      GLN  59   4.806  -9.237   3.859
  395    H    GLY  60           H        GLY  60  10.268 -10.924   6.276
  396   1HA   GLY  60          1HA       GLY  60  11.865 -10.893   8.432
  397   2HA   GLY  60          2HA       GLY  60  10.345 -11.430   9.130
  Start of MODEL   44
    1    H    SER   1           1H       SER   1  14.589   9.668   7.115
    2    HA   SER   1           HA       SER   1  14.845   7.251   5.892
    3   1HB   SER   1          1HB       SER   1  15.695   7.796   8.077
    4   2HB   SER   1          2HB       SER   1  14.074   8.123   8.689
    5    HG   SER   1           HG       SER   1  13.963   6.097   9.189
    6    H    TRP   2           H        TRP   2  13.499   5.773   5.130
    7    HA   TRP   2           HA       TRP   2  10.971   5.223   6.294
    8   1HB   TRP   2          1HB       TRP   2   9.563   5.696   4.319
    9   2HB   TRP   2          2HB       TRP   2  10.224   7.156   5.030
   10    HD1  TRP   2           HD1      TRP   2  11.780   4.825   2.312
   11    HE1  TRP   2           1HE      TRP   2  12.355   6.283   0.267
   12    HE3  TRP   2           3HE      TRP   2   9.973   9.302   3.990
   13    HZ2  TRP   2           2HZ      TRP   2  12.056   8.969  -0.531
   14    HZ3  TRP   2           3HZ      TRP   2  10.146  11.267   2.517
   15    HH2  TRP   2           HH2      TRP   2  11.164  11.101   0.303
   16    H    MET   3           H        MET   3   9.726   3.651   4.690
   17    HA   MET   3           HA       MET   3  11.728   1.692   3.823
   18   1HB   MET   3          1HB       MET   3   8.793   1.359   4.470
   19   2HB   MET   3          2HB       MET   3   9.893   0.063   4.022
   20   1HG   MET   3          1HG       MET   3  10.203   1.815   6.449
   21   2HG   MET   3          2HG       MET   3   9.480   0.209   6.445
   22   1HE   MET   3          1HE       MET   3  11.231  -0.267   8.432
   23   2HE   MET   3          2HE       MET   3  12.983  -0.226   8.218
   24   3HE   MET   3          3HE       MET   3  12.059   1.277   8.216
   25    H    SER   4           H        SER   4  11.932   1.175   1.727
   26    HA   SER   4           HA       SER   4  10.348   2.593  -0.226
   27   1HB   SER   4          1HB       SER   4  12.469   0.485  -0.719
   28   2HB   SER   4          2HB       SER   4  11.905   1.723  -1.842
   29    HG   SER   4           HG       SER   4  13.588   1.959   0.389
   30    H    THR   5           H        THR   5   9.390   1.433  -2.104
   31    HA   THR   5           HA       THR   5   7.943  -0.890  -1.108
   32    HB   THR   5           HB       THR   5   6.471  -0.336  -3.143
   33    HG1  THR   5           1HG      THR   5   7.556   2.239  -2.893
   34   1HG2  THR   5          1HG2      THR   5   6.146   2.026  -1.548
   35   2HG2  THR   5          2HG2      THR   5   5.099   0.613  -1.705
   36   3HG2  THR   5          3HG2      THR   5   6.420   0.607  -0.538
   37    H    VAL   6           H        VAL   6   7.256  -2.462  -2.634
   38    HA   VAL   6           HA       VAL   6   9.256  -3.151  -4.699
   39    HB   VAL   6           HB       VAL   6   7.688  -5.402  -3.752
   40   1HG1  VAL   6          1HG1      VAL   6  10.546  -4.772  -4.259
   41   2HG1  VAL   6          2HG1      VAL   6  10.153  -6.213  -3.318
   42   3HG1  VAL   6          3HG1      VAL   6   9.521  -6.028  -4.957
   43   1HG2  VAL   6          1HG2      VAL   6   8.508  -3.677  -1.674
   44   2HG2  VAL   6          2HG2      VAL   6   7.814  -5.294  -1.544
   45   3HG2  VAL   6          3HG2      VAL   6   9.563  -5.089  -1.630
   46    H    GLY   7           H        GLY   7   7.798  -5.176  -5.840
   47   1HA   GLY   7          1HA       GLY   7   6.239  -5.307  -7.588
   48   2HA   GLY   7          2HA       GLY   7   5.157  -5.122  -6.239
   49    H    GLY   8           H        GLY   8   3.612  -3.788  -6.713
   50   1HA   GLY   8          1HA       GLY   8   2.440  -2.071  -7.749
   51   2HA   GLY   8          2HA       GLY   8   3.578  -1.155  -6.791
   52    H    ASN   9           H        ASN   9   3.864   0.571  -8.022
   53    HA   ASN   9           HA       ASN   9   5.501   0.265 -10.361
   54   1HB   ASN   9          1HB       ASN   9   4.085   1.587 -11.865
   55   2HB   ASN   9          2HB       ASN   9   3.349   0.059 -11.444
   56   1HD2  ASN   9          1HD2      ASN   9   1.397   2.555  -9.133
   57   2HD2  ASN   9          2HD2      ASN   9   2.928   1.831  -8.790
   58    H    SER  10           H        SER  10   5.717   1.411  -7.729
   59    HA   SER  10           HA       SER  10   5.914   4.273  -8.291
   60   1HB   SER  10          1HB       SER  10   6.207   2.794  -5.668
   61   2HB   SER  10          2HB       SER  10   6.096   4.535  -5.893
   62    HG   SER  10           HG       SER  10   4.099   2.615  -5.936
   63    H    GLY  11           H        GLY  11   7.820   1.540  -7.043
   64   1HA   GLY  11          1HA       GLY  11  10.095   1.208  -7.722
   65   2HA   GLY  11          2HA       GLY  11  10.239   2.944  -7.963
   66    H    GLY  12           H        GLY  12  10.955   4.200  -6.330
   67   1HA   GLY  12          1HA       GLY  12  11.594   2.798  -3.813
   68   2HA   GLY  12          2HA       GLY  12  12.521   4.137  -4.475
   69    H    ALA  13           H        ALA  13   9.020   4.036  -4.364
   70    HA   ALA  13           HA       ALA  13   9.058   6.431  -2.689
   71   1HB   ALA  13          1HB       ALA  13   6.884   5.138  -4.328
   72   2HB   ALA  13          2HB       ALA  13   6.601   6.505  -3.253
   73   3HB   ALA  13          3HB       ALA  13   7.697   6.677  -4.623
   74    HA   PRO  14           HA       PRO  14   7.719   4.074   0.808
   75   1HB   PRO  14          1HB       PRO  14   7.060   6.065   2.478
   76   2HB   PRO  14          2HB       PRO  14   8.734   5.788   1.986
   77   1HG   PRO  14          1HG       PRO  14   6.812   7.863   1.063
   78   2HG   PRO  14          2HG       PRO  14   8.563   7.978   1.302
   79   1HD   PRO  14          1HD       PRO  14   7.265   7.596  -1.144
   80   2HD   PRO  14          2HD       PRO  14   8.986   7.319  -0.834
   81    H    CYS  15           H        CYS  15   5.854   3.573   2.102
   82    HA   CYS  15           HA       CYS  15   3.367   4.072   0.670
   83   1HB   CYS  15          1HB       CYS  15   4.046   2.208   2.960
   84   2HB   CYS  15          2HB       CYS  15   2.436   2.353   2.259
   85    H    VAL  16           H        VAL  16   1.778   5.384   1.374
   86    HA   VAL  16           HA       VAL  16   2.237   6.931   3.794
   87    HB   VAL  16           HB       VAL  16   0.109   7.246   1.657
   88   1HG1  VAL  16          1HG1      VAL  16   0.476   8.506   4.246
   89   2HG1  VAL  16          2HG1      VAL  16   0.498   9.676   2.930
   90   3HG1  VAL  16          3HG1      VAL  16  -0.888   8.602   3.130
   91   1HG2  VAL  16          1HG2      VAL  16   2.845   8.376   2.032
   92   2HG2  VAL  16          2HG2      VAL  16   2.058   7.802   0.561
   93   3HG2  VAL  16          3HG2      VAL  16   1.600   9.357   1.258
   94    H    PHE  17           H        PHE  17   1.327   6.392   5.677
   95    HA   PHE  17           HA       PHE  17  -1.137   4.801   5.609
   96   1HB   PHE  17          1HB       PHE  17   1.135   4.825   7.591
   97   2HB   PHE  17          2HB       PHE  17  -0.393   4.011   7.874
   98    HD1  PHE  17           1HD      PHE  17  -1.113   2.356   5.891
   99    HD2  PHE  17           2HD      PHE  17   2.840   3.624   6.781
  100    HE1  PHE  17           1HE      PHE  17  -0.218   0.363   4.766
  101    HE2  PHE  17           2HE      PHE  17   3.753   1.646   5.658
  102    HZ   PHE  17           HZ       PHE  17   2.227  -0.016   4.629
  103    HA   PRO  18           HA       PRO  18  -2.596   4.212   6.699
  104   1HB   PRO  18          1HB       PRO  18  -5.217   4.664   7.101
  105   2HB   PRO  18          2HB       PRO  18  -4.105   4.286   8.416
  106   1HG   PRO  18          1HG       PRO  18  -5.370   6.853   7.697
  107   2HG   PRO  18          2HG       PRO  18  -4.780   6.296   9.270
  108   1HD   PRO  18          1HD       PRO  18  -3.473   8.059   7.453
  109   2HD   PRO  18          2HD       PRO  18  -2.824   7.390   8.962
  110    H    PHE  19           H        PHE  19  -3.155   3.545   4.712
  111    HA   PHE  19           HA       PHE  19  -4.205   5.596   2.883
  112   1HB   PHE  19          1HB       PHE  19  -3.433   4.277   1.016
  113   2HB   PHE  19          2HB       PHE  19  -2.100   4.523   2.134
  114    HD1  PHE  19           1HD      PHE  19  -1.526   2.588   3.719
  115    HD2  PHE  19           2HD      PHE  19  -4.012   2.154   0.299
  116    HE1  PHE  19           1HE      PHE  19  -1.122   0.166   3.738
  117    HE2  PHE  19           2HE      PHE  19  -3.600  -0.275   0.304
  118    HZ   PHE  19           HZ       PHE  19  -2.158  -1.267   2.028
  119    H    THR  20           H        THR  20  -6.186   5.446   2.118
  120    HA   THR  20           HA       THR  20  -7.742   3.182   3.067
  121    HB   THR  20           HB       THR  20  -8.588   5.809   1.812
  122    HG1  THR  20           1HG      THR  20  -7.946   6.264   3.836
  123   1HG2  THR  20          1HG2      THR  20 -10.776   4.933   3.151
  124   2HG2  THR  20          2HG2      THR  20 -10.535   4.795   1.407
  125   3HG2  THR  20          3HG2      THR  20 -10.162   3.429   2.460
  126    H    PHE  21           H        PHE  21  -8.322   1.574   1.917
  127    HA   PHE  21           HA       PHE  21  -8.566   1.840  -1.010
  128   1HB   PHE  21          1HB       PHE  21  -6.523   0.509  -0.109
  129   2HB   PHE  21          2HB       PHE  21  -7.703  -0.676   0.388
  130    HD1  PHE  21           1HD      PHE  21  -8.527   1.048  -2.679
  131    HD2  PHE  21           2HD      PHE  21  -6.428  -2.242  -1.003
  132    HE1  PHE  21           1HE      PHE  21  -8.420  -0.023  -4.881
  133    HE2  PHE  21           2HE      PHE  21  -6.323  -3.326  -3.185
  134    HZ   PHE  21           HZ       PHE  21  -7.308  -2.207  -5.162
  135    H    LEU  22           H        LEU  22 -10.318   0.673  -1.846
  136    HA   LEU  22           HA       LEU  22 -12.503   0.190  -1.880
  137   1HB   LEU  22          1HB       LEU  22 -11.181  -1.879  -0.239
  138   2HB   LEU  22          2HB       LEU  22 -12.757  -2.114  -0.976
  139    HG   LEU  22           HG       LEU  22 -11.632  -2.914  -2.734
  140   1HD1  LEU  22          1HD1      LEU  22 -10.946  -0.108  -2.999
  141   2HD1  LEU  22          2HD1      LEU  22 -10.126  -1.282  -4.031
  142   3HD1  LEU  22          3HD1      LEU  22 -11.884  -1.157  -4.060
  143   1HD2  LEU  22          1HD2      LEU  22  -9.869  -3.389  -1.127
  144   2HD2  LEU  22          2HD2      LEU  22  -9.349  -3.240  -2.805
  145   3HD2  LEU  22          3HD2      LEU  22  -9.083  -1.911  -1.680
  146    H    GLY  23           H        GLY  23 -12.029   2.108   0.187
  147   1HA   GLY  23          1HA       GLY  23 -13.516   3.118   1.666
  148   2HA   GLY  23          2HA       GLY  23 -14.401   1.609   1.772
  149    H    ASN  24           H        ASN  24 -11.263   0.735   2.376
  150    HA   ASN  24           HA       ASN  24 -11.696   1.055   5.271
  151   1HB   ASN  24          1HB       ASN  24  -9.987  -0.986   3.856
  152   2HB   ASN  24          2HB       ASN  24 -10.446  -0.977   5.545
  153   1HD2  ASN  24          1HD2      ASN  24 -12.640  -2.903   2.927
  154   2HD2  ASN  24          2HD2      ASN  24 -11.012  -2.377   2.701
  155    H    LYS  25           H        LYS  25 -10.146   1.994   6.525
  156    HA   LYS  25           HA       LYS  25  -7.945   3.321   5.247
  157   1HB   LYS  25          1HB       LYS  25  -8.770   3.098   8.150
  158   2HB   LYS  25          2HB       LYS  25  -7.619   4.225   7.491
  159   1HG   LYS  25          1HG       LYS  25  -9.283   5.425   6.326
  160   2HG   LYS  25          2HG       LYS  25 -10.483   4.168   6.639
  161   1HD   LYS  25          1HD       LYS  25 -10.312   4.653   9.058
  162   2HD   LYS  25          2HD       LYS  25  -9.186   5.962   8.694
  163   1HE   LYS  25          1HE       LYS  25 -12.022   5.770   7.699
  164   2HE   LYS  25          2HE       LYS  25 -11.487   6.769   9.049
  165   1HZ   LYS  25          1HZ       LYS  25  -9.885   7.784   7.336
  166   2HZ   LYS  25          2HZ       LYS  25 -10.915   7.094   6.168
  167   3HZ   LYS  25          3HZ       LYS  25 -11.519   8.234   7.272
  168    H    TYR  26           H        TYR  26  -6.006   2.252   4.945
  169    HA   TYR  26           HA       TYR  26  -5.473  -0.052   6.668
  170   1HB   TYR  26          1HB       TYR  26  -4.213   0.755   4.051
  171   2HB   TYR  26          2HB       TYR  26  -3.854  -0.715   4.949
  172    HD1  TYR  26           1HD      TYR  26  -6.876  -1.103   5.767
  173    HD2  TYR  26           2HD      TYR  26  -4.888  -0.439   2.072
  174    HE1  TYR  26           1HE      TYR  26  -8.662  -2.293   4.587
  175    HE2  TYR  26           2HE      TYR  26  -6.671  -1.622   0.892
  176    HH   TYR  26           HH       TYR  26  -8.647  -3.677   2.158
  177    H    GLU  27           H        GLU  27  -4.304   0.285   8.305
  178    HA   GLU  27           HA       GLU  27  -2.394   2.456   8.470
  179   1HB   GLU  27          1HB       GLU  27  -3.187   0.377  10.503
  180   2HB   GLU  27          2HB       GLU  27  -2.227   1.800  10.805
  181   1HG   GLU  27          1HG       GLU  27  -4.126   3.217  10.214
  182   2HG   GLU  27          2HG       GLU  27  -5.097   1.771   9.937
  183    H    SER  28           H        SER  28  -2.484  -0.874   7.832
  184    HA   SER  28           HA       SER  28   0.439  -0.986   7.852
  185   1HB   SER  28          1HB       SER  28  -0.018  -3.522   8.230
  186   2HB   SER  28          2HB       SER  28  -0.127  -2.442   9.617
  187    HG   SER  28           HG       SER  28  -2.101  -3.109   9.828
  188    H    CYS  29           H        CYS  29   0.973  -3.112   6.346
  189    HA   CYS  29           HA       CYS  29   0.057  -2.360   3.780
  190   1HB   CYS  29          1HB       CYS  29   1.383  -4.948   4.584
  191   2HB   CYS  29          2HB       CYS  29   1.239  -4.329   2.954
  192    H    THR  30           H        THR  30  -1.004  -3.842   2.279
  193    HA   THR  30           HA       THR  30  -3.036  -5.551   3.548
  194    HB   THR  30           HB       THR  30  -3.949  -3.229   3.115
  195    HG1  THR  30           1HG      THR  30  -5.520  -4.687   3.098
  196   1HG2  THR  30          1HG2      THR  30  -4.345  -3.585   0.297
  197   2HG2  THR  30          2HG2      THR  30  -3.687  -2.201   1.173
  198   3HG2  THR  30          3HG2      THR  30  -2.622  -3.513   0.666
  199    H    SER  31           H        SER  31  -4.242  -6.775   1.823
  200    HA   SER  31           HA       SER  31  -2.492  -7.362  -0.459
  201   1HB   SER  31          1HB       SER  31  -3.301  -9.732  -0.305
  202   2HB   SER  31          2HB       SER  31  -2.300  -9.228   1.063
  203    HG   SER  31           HG       SER  31  -3.942  -9.991   2.164
  204    H    ALA  32           H        ALA  32  -4.902  -5.686   0.257
  205    HA   ALA  32           HA       ALA  32  -7.210  -6.587  -1.050
  206   1HB   ALA  32          1HB       ALA  32  -6.344  -4.244   0.288
  207   2HB   ALA  32          2HB       ALA  32  -6.938  -3.736  -1.292
  208   3HB   ALA  32          3HB       ALA  32  -7.988  -4.649  -0.207
  209    H    GLY  33           H        GLY  33  -7.976  -6.347  -3.124
  210   1HA   GLY  33          1HA       GLY  33  -7.919  -5.849  -5.392
  211   2HA   GLY  33          2HA       GLY  33  -6.493  -4.860  -5.098
  212    H    ARG  34           H        ARG  34  -5.416  -7.400  -3.657
  213    HA   ARG  34           HA       ARG  34  -4.348  -8.584  -6.106
  214   1HB   ARG  34          1HB       ARG  34  -3.266  -8.630  -3.288
  215   2HB   ARG  34          2HB       ARG  34  -2.529  -9.426  -4.659
  216   1HG   ARG  34          1HG       ARG  34  -2.589  -6.986  -5.666
  217   2HG   ARG  34          2HG       ARG  34  -2.609  -6.548  -3.963
  218   1HD   ARG  34          1HD       ARG  34  -0.317  -6.661  -4.915
  219   2HD   ARG  34          2HD       ARG  34  -0.561  -7.780  -3.570
  220    HE   ARG  34           HE       ARG  34  -0.195  -9.523  -4.991
  221   1HH1  ARG  34          1HH1      ARG  34  -0.962  -6.707  -6.949
  222   2HH1  ARG  34          2HH1      ARG  34  -0.606  -7.505  -8.449
  223   1HH2  ARG  34          1HH2      ARG  34   0.216 -10.570  -6.974
  224   2HH2  ARG  34          2HH2      ARG  34   0.095  -9.679  -8.460
  225    H    SER  35           H        SER  35  -4.709  -9.787  -2.807
  226    HA   SER  35           HA       SER  35  -5.508 -11.721  -1.937
  227   1HB   SER  35          1HB       SER  35  -7.345 -11.647  -4.340
  228   2HB   SER  35          2HB       SER  35  -7.575 -12.643  -2.902
  229    HG   SER  35           HG       SER  35  -8.153  -9.999  -3.301
  230    H    ASP  36           H        ASP  36  -3.348 -11.737  -4.026
  231    HA   ASP  36           HA       ASP  36  -3.623 -14.454  -5.059
  232   1HB   ASP  36          1HB       ASP  36  -2.037 -13.850  -6.702
  233   2HB   ASP  36          2HB       ASP  36  -3.058 -12.444  -6.514
  234    H    GLY  37           H        GLY  37  -1.715 -12.386  -3.081
  235   1HA   GLY  37          1HA       GLY  37  -0.865 -14.180  -1.235
  236   2HA   GLY  37          2HA       GLY  37   0.323 -14.333  -2.517
  237    H    LYS  38           H        LYS  38   1.279 -12.194  -3.250
  238    HA   LYS  38           HA       LYS  38   2.670 -11.036  -1.149
  239   1HB   LYS  38          1HB       LYS  38   2.215  -9.679  -3.798
  240   2HB   LYS  38          2HB       LYS  38   3.634  -9.598  -2.763
  241   1HG   LYS  38          1HG       LYS  38   4.343 -10.991  -4.443
  242   2HG   LYS  38          2HG       LYS  38   3.807 -12.147  -3.229
  243   1HD   LYS  38          1HD       LYS  38   1.624 -12.257  -4.443
  244   2HD   LYS  38          2HD       LYS  38   2.334 -11.245  -5.702
  245   1HE   LYS  38          1HE       LYS  38   3.942 -12.904  -6.240
  246   2HE   LYS  38          2HE       LYS  38   3.518 -13.866  -4.827
  247   1HZ   LYS  38          1HZ       LYS  38   1.308 -13.320  -6.592
  248   2HZ   LYS  38          2HZ       LYS  38   2.530 -14.278  -7.286
  249   3HZ   LYS  38          3HZ       LYS  38   1.772 -14.776  -5.851
  250    H    MET  39           H        MET  39   2.454  -9.238   0.063
  251    HA   MET  39           HA       MET  39  -0.077  -7.803  -0.168
  252   1HB   MET  39          1HB       MET  39   1.915  -7.841   2.109
  253   2HB   MET  39          2HB       MET  39   0.368  -7.022   2.106
  254   1HG   MET  39          1HG       MET  39  -0.047  -8.945   3.316
  255   2HG   MET  39          2HG       MET  39  -0.657  -9.328   1.709
  256   1HE   MET  39          1HE       MET  39   2.556  -9.000   3.487
  257   2HE   MET  39          2HE       MET  39   2.542 -10.584   4.266
  258   3HE   MET  39          3HE       MET  39   3.572 -10.298   2.863
  259    H    TRP  40           H        TRP  40  -0.069  -5.505  -0.037
  260    HA   TRP  40           HA       TRP  40   2.487  -4.198  -0.686
  261   1HB   TRP  40          1HB       TRP  40   1.356  -2.932  -2.483
  262   2HB   TRP  40          2HB       TRP  40   1.372  -4.660  -2.830
  263    HD1  TRP  40           HD1      TRP  40  -1.097  -5.950  -2.185
  264    HE1  TRP  40           1HE      TRP  40  -3.480  -5.030  -2.439
  265    HE3  TRP  40           3HE      TRP  40  -0.029  -0.968  -2.528
  266    HZ2  TRP  40           2HZ      TRP  40  -4.733  -2.541  -2.713
  267    HZ3  TRP  40           3HZ      TRP  40  -1.893   0.621  -2.759
  268    HH2  TRP  40           HH2      TRP  40  -4.199  -0.155  -2.856
  269    H    CYS  41           H        CYS  41   1.596  -1.688  -1.140
  270    HA   CYS  41           HA       CYS  41  -0.375  -0.789   0.695
  271   1HB   CYS  41          1HB       CYS  41   1.298   0.669   2.012
  272   2HB   CYS  41          2HB       CYS  41   1.130  -1.023   2.466
  273    H    ALA  42           H        ALA  42  -1.016   1.292   0.213
  274    HA   ALA  42           HA       ALA  42  -0.171   2.263  -2.326
  275   1HB   ALA  42          1HB       ALA  42  -2.495   2.479  -1.368
  276   2HB   ALA  42          2HB       ALA  42  -1.864   3.781  -0.357
  277   3HB   ALA  42          3HB       ALA  42  -1.831   3.934  -2.116
  278    H    THR  43           H        THR  43   0.838   4.174  -2.845
  279    HA   THR  43           HA       THR  43   2.636   5.156  -0.764
  280    HB   THR  43           HB       THR  43   4.017   5.956  -2.593
  281    HG1  THR  43           1HG      THR  43   2.642   6.610  -4.162
  282   1HG2  THR  43          1HG2      THR  43   3.860   3.640  -4.013
  283   2HG2  THR  43          2HG2      THR  43   4.742   3.839  -2.496
  284   3HG2  THR  43          3HG2      THR  43   3.103   3.182  -2.486
  285    H    THR  44           H        THR  44  -0.284   5.777  -1.531
  286    HA   THR  44           HA       THR  44  -0.060   8.692  -1.276
  287    HB   THR  44           HB       THR  44  -2.156   8.847  -2.655
  288    HG1  THR  44           1HG      THR  44  -3.116   7.085  -3.216
  289   1HG2  THR  44          1HG2      THR  44   0.073   7.516  -4.170
  290   2HG2  THR  44          2HG2      THR  44  -1.174   8.582  -4.820
  291   3HG2  THR  44          3HG2      THR  44   0.046   9.219  -3.717
  292    H    ALA  45           H        ALA  45  -1.857   9.645  -0.089
  293    HA   ALA  45           HA       ALA  45  -2.626   8.159   2.174
  294   1HB   ALA  45          1HB       ALA  45  -2.450  10.604   2.171
  295   2HB   ALA  45          2HB       ALA  45  -3.851  10.705   1.106
  296   3HB   ALA  45          3HB       ALA  45  -4.032  10.073   2.743
  297    H    ASN  46           H        ASN  46  -4.346   8.922  -0.816
  298    HA   ASN  46           HA       ASN  46  -6.419   6.994  -0.023
  299   1HB   ASN  46          1HB       ASN  46  -7.254   9.375  -0.190
  300   2HB   ASN  46          2HB       ASN  46  -6.838   9.334  -1.901
  301   1HD2  ASN  46          1HD2      ASN  46 -10.285   7.842  -0.583
  302   2HD2  ASN  46          2HD2      ASN  46  -9.180   8.722   0.402
  303    H    TYR  47           H        TYR  47  -6.076   5.194  -1.103
  304    HA   TYR  47           HA       TYR  47  -4.619   5.206  -3.576
  305   1HB   TYR  47          1HB       TYR  47  -4.239   3.462  -1.886
  306   2HB   TYR  47          2HB       TYR  47  -5.882   2.879  -2.134
  307    HD1  TYR  47           1HD      TYR  47  -2.608   3.339  -3.780
  308    HD2  TYR  47           2HD      TYR  47  -6.395   1.423  -3.932
  309    HE1  TYR  47           1HE      TYR  47  -1.805   1.926  -5.614
  310    HE2  TYR  47           2HE      TYR  47  -5.602   0.005  -5.769
  311    HH   TYR  47           HH       TYR  47  -2.745  -0.663  -6.489
  312    H    ASP  48           H        ASP  48  -7.995   4.801  -2.678
  313    HA   ASP  48           HA       ASP  48  -8.912   3.576  -4.986
  314   1HB   ASP  48          1HB       ASP  48 -10.189   5.385  -2.990
  315   2HB   ASP  48          2HB       ASP  48 -11.070   4.960  -4.452
  316    H    ASP  49           H        ASP  49  -8.119   6.948  -4.452
  317    HA   ASP  49           HA       ASP  49  -9.191   7.698  -7.049
  318   1HB   ASP  49          1HB       ASP  49  -8.030   9.258  -4.753
  319   2HB   ASP  49          2HB       ASP  49  -8.301  10.001  -6.322
  320    H    ASP  50           H        ASP  50  -6.028   8.019  -5.408
  321    HA   ASP  50           HA       ASP  50  -4.722   8.771  -7.828
  322   1HB   ASP  50          1HB       ASP  50  -3.660   8.023  -5.110
  323   2HB   ASP  50          2HB       ASP  50  -2.614   8.476  -6.453
  324    H    ARG  51           H        ARG  51  -5.254   5.707  -6.299
  325    HA   ARG  51           HA       ARG  51  -4.503   3.624  -6.671
  326   1HB   ARG  51          1HB       ARG  51  -4.917   4.556  -9.483
  327   2HB   ARG  51          2HB       ARG  51  -4.895   2.877  -8.946
  328   1HG   ARG  51          1HG       ARG  51  -6.661   4.032  -7.224
  329   2HG   ARG  51          2HG       ARG  51  -7.000   4.878  -8.743
  330   1HD   ARG  51          1HD       ARG  51  -6.846   1.898  -8.416
  331   2HD   ARG  51          2HD       ARG  51  -8.343   2.834  -8.389
  332    HE   ARG  51           HE       ARG  51  -6.942   3.449 -10.751
  333   1HH1  ARG  51          1HH1      ARG  51  -8.691   0.794  -9.304
  334   2HH1  ARG  51          2HH1      ARG  51  -9.108   0.065 -10.822
  335   1HH2  ARG  51          1HH2      ARG  51  -7.539   2.548 -12.740
  336   2HH2  ARG  51          2HH2      ARG  51  -8.464   1.075 -12.787
  337    H    LYS  52           H        LYS  52  -2.287   4.874  -6.013
  338    HA   LYS  52           HA       LYS  52  -0.300   3.742  -7.860
  339   1HB   LYS  52          1HB       LYS  52  -0.146   6.273  -6.214
  340   2HB   LYS  52          2HB       LYS  52   1.303   5.448  -6.785
  341   1HG   LYS  52          1HG       LYS  52   0.766   5.814  -9.038
  342   2HG   LYS  52          2HG       LYS  52  -0.901   6.233  -8.658
  343   1HD   LYS  52          1HD       LYS  52  -0.118   8.282  -7.563
  344   2HD   LYS  52          2HD       LYS  52   1.547   7.857  -7.967
  345   1HE   LYS  52          1HE       LYS  52   1.027   7.963 -10.342
  346   2HE   LYS  52          2HE       LYS  52  -0.667   8.299  -9.978
  347   1HZ   LYS  52          1HZ       LYS  52   1.246  10.113  -8.765
  348   2HZ   LYS  52          2HZ       LYS  52   1.177  10.171 -10.460
  349   3HZ   LYS  52          3HZ       LYS  52  -0.234  10.439  -9.546
  350    H    TRP  53           H        TRP  53   0.652   2.048  -7.046
  351    HA   TRP  53           HA       TRP  53   0.768   1.765  -4.120
  352   1HB   TRP  53          1HB       TRP  53   0.014  -0.514  -4.387
  353   2HB   TRP  53          2HB       TRP  53  -1.136   0.596  -5.055
  354    HD1  TRP  53           HD1      TRP  53  -0.667   0.901  -7.974
  355    HE1  TRP  53           1HE      TRP  53  -0.339  -1.076  -9.601
  356    HE3  TRP  53           3HE      TRP  53   0.621  -2.547  -4.574
  357    HZ2  TRP  53           2HZ      TRP  53   0.356  -3.853  -9.391
  358    HZ3  TRP  53           3HZ      TRP  53   1.089  -4.877  -5.303
  359    HH2  TRP  53           HH2      TRP  53   0.966  -5.509  -7.665
  360    H    GLY  54           H        GLY  54   1.908  -0.296  -3.547
  361   1HA   GLY  54          1HA       GLY  54   4.048  -1.265  -5.141
  362   2HA   GLY  54          2HA       GLY  54   4.621  -0.116  -3.930
  363    H    PHE  55           H        PHE  55   4.982  -3.098  -4.156
  364    HA   PHE  55           HA       PHE  55   3.426  -4.429  -2.265
  365   1HB   PHE  55          1HB       PHE  55   6.202  -4.910  -3.317
  366   2HB   PHE  55          2HB       PHE  55   5.480  -5.958  -2.115
  367    HD1  PHE  55           1HD      PHE  55   2.756  -5.001  -3.887
  368    HD2  PHE  55           2HD      PHE  55   6.299  -7.294  -4.399
  369    HE1  PHE  55           1HE      PHE  55   1.644  -6.322  -5.641
  370    HE2  PHE  55           2HE      PHE  55   5.189  -8.626  -6.155
  371    HZ   PHE  55           HZ       PHE  55   2.855  -8.129  -6.781
  372    H    CYS  56           H        CYS  56   4.022  -5.220  -0.173
  373    HA   CYS  56           HA       CYS  56   4.740  -3.176   1.625
  374   1HB   CYS  56          1HB       CYS  56   3.285  -5.249   2.021
  375   2HB   CYS  56          2HB       CYS  56   4.796  -6.124   2.247
  376    HA   PRO  57           HA       PRO  57   9.172  -3.499   1.497
  377   1HB   PRO  57          1HB       PRO  57   9.789  -1.996   3.591
  378   2HB   PRO  57          2HB       PRO  57   9.048  -1.282   2.148
  379   1HG   PRO  57          1HG       PRO  57   7.718  -2.243   4.644
  380   2HG   PRO  57          2HG       PRO  57   7.574  -0.634   3.901
  381   1HD   PRO  57          1HD       PRO  57   5.719  -2.511   3.468
  382   2HD   PRO  57          2HD       PRO  57   6.272  -1.470   2.137
  383    H    ASP  58           H        ASP  58  10.617  -3.284   3.939
  384    HA   ASP  58           HA       ASP  58  11.041  -5.971   4.564
  385   1HB   ASP  58          1HB       ASP  58  12.618  -4.020   4.978
  386   2HB   ASP  58          2HB       ASP  58  11.662  -3.667   6.412
  387    H    GLN  59           H        GLN  59   9.840  -7.352   5.681
  388    HA   GLN  59           HA       GLN  59   7.956  -6.273   7.676
  389   1HB   GLN  59          1HB       GLN  59   7.742  -8.817   6.061
  390   2HB   GLN  59          2HB       GLN  59   6.562  -8.240   7.230
  391   1HG   GLN  59          1HG       GLN  59   6.224  -6.241   5.828
  392   2HG   GLN  59          2HG       GLN  59   7.341  -6.920   4.642
  393   1HE2  GLN  59          1HE2      GLN  59   4.903  -8.759   3.069
  394   2HE2  GLN  59          2HE2      GLN  59   6.448  -7.985   3.045
  395    H    GLY  60           H        GLY  60  10.856  -7.394   7.765
  396   1HA   GLY  60          1HA       GLY  60  11.643  -8.065   9.997
  397   2HA   GLY  60          2HA       GLY  60  10.325  -9.230  10.015
  Start of MODEL   45
    1    H    SER   1           1H       SER   1  17.408  -0.733   5.908
    2    HA   SER   1           HA       SER   1  15.796  -2.116   4.368
    3   1HB   SER   1          1HB       SER   1  15.645  -3.873   6.171
    4   2HB   SER   1          2HB       SER   1  14.917  -2.662   7.225
    5    HG   SER   1           HG       SER   1  13.073  -2.886   6.217
    6    H    TRP   2           H        TRP   2  14.623  -0.464   3.632
    7    HA   TRP   2           HA       TRP   2  14.055   1.772   5.445
    8   1HB   TRP   2          1HB       TRP   2  13.531   2.979   3.239
    9   2HB   TRP   2          2HB       TRP   2  15.216   2.573   3.556
   10    HD1  TRP   2           HD1      TRP   2  12.367   0.518   1.869
   11    HE1  TRP   2           1HE      TRP   2  13.255  -0.364  -0.378
   12    HE3  TRP   2           3HE      TRP   2  17.009   2.629   1.970
   13    HZ2  TRP   2           2HZ      TRP   2  15.614  -0.162  -1.919
   14    HZ3  TRP   2           3HZ      TRP   2  18.514   2.257   0.063
   15    HH2  TRP   2           HH2      TRP   2  17.833   0.889  -1.841
   16    H    MET   3           H        MET   3  11.978   2.935   5.062
   17    HA   MET   3           HA       MET   3   9.833   0.966   4.941
   18   1HB   MET   3          1HB       MET   3   9.875   3.822   5.917
   19   2HB   MET   3          2HB       MET   3   8.431   2.822   5.877
   20   1HG   MET   3          1HG       MET   3   9.544   1.214   7.381
   21   2HG   MET   3          2HG       MET   3  10.933   2.301   7.466
   22   1HE   MET   3          1HE       MET   3  10.729   4.689   7.962
   23   2HE   MET   3          2HE       MET   3   9.116   5.407   7.932
   24   3HE   MET   3          3HE       MET   3   9.968   5.209   9.465
   25    H    SER   4           H        SER   4  10.965   1.504   2.524
   26    HA   SER   4           HA       SER   4   9.103   3.302   1.155
   27   1HB   SER   4          1HB       SER   4  11.597   1.944   0.093
   28   2HB   SER   4          2HB       SER   4  10.610   3.126  -0.770
   29    HG   SER   4           HG       SER   4  11.997   4.472   0.091
   30    H    THR   5           H        THR   5   8.655   2.343  -1.221
   31    HA   THR   5           HA       THR   5   7.281  -0.158  -0.679
   32    HB   THR   5           HB       THR   5   6.049   0.398  -2.772
   33    HG1  THR   5           1HG      THR   5   7.542   1.684  -3.810
   34   1HG2  THR   5          1HG2      THR   5   5.969   2.771  -0.968
   35   2HG2  THR   5          2HG2      THR   5   4.661   2.030  -1.890
   36   3HG2  THR   5          3HG2      THR   5   5.326   1.200  -0.484
   37    H    VAL   6           H        VAL   6   6.925  -1.580  -2.466
   38    HA   VAL   6           HA       VAL   6   9.198  -2.050  -4.277
   39    HB   VAL   6           HB       VAL   6   7.771  -4.467  -3.440
   40   1HG1  VAL   6          1HG1      VAL   6   9.928  -4.162  -4.816
   41   2HG1  VAL   6          2HG1      VAL   6  10.722  -4.046  -3.247
   42   3HG1  VAL   6          3HG1      VAL   6   9.821  -5.501  -3.675
   43   1HG2  VAL   6          1HG2      VAL   6   7.959  -3.053  -1.293
   44   2HG2  VAL   6          2HG2      VAL   6   8.463  -4.743  -1.258
   45   3HG2  VAL   6          3HG2      VAL   6   9.673  -3.465  -1.370
   46    H    GLY   7           H        GLY   7   7.919  -4.273  -5.427
   47   1HA   GLY   7          1HA       GLY   7   6.501  -4.534  -7.276
   48   2HA   GLY   7          2HA       GLY   7   5.318  -4.360  -6.013
   49    H    GLY   8           H        GLY   8   3.778  -3.085  -6.529
   50   1HA   GLY   8          1HA       GLY   8   2.547  -1.480  -7.656
   51   2HA   GLY   8          2HA       GLY   8   3.627  -0.469  -6.729
   52    H    ASN   9           H        ASN   9   3.659   1.197  -8.083
   53    HA   ASN   9           HA       ASN   9   5.161   0.838 -10.572
   54   1HB   ASN   9          1HB       ASN   9   3.569   2.841 -11.363
   55   2HB   ASN   9          2HB       ASN   9   3.178   1.164 -11.670
   56   1HD2  ASN   9          1HD2      ASN   9   0.814   3.433  -9.427
   57   2HD2  ASN   9          2HD2      ASN   9   2.235   4.013 -10.225
   58    H    SER  10           H        SER  10   4.226   2.730  -7.832
   59    HA   SER  10           HA       SER  10   5.430   5.182  -8.418
   60   1HB   SER  10          1HB       SER  10   5.275   3.911  -5.672
   61   2HB   SER  10          2HB       SER  10   5.265   5.631  -6.071
   62    HG   SER  10           HG       SER  10   3.164   5.070  -5.693
   63    H    GLY  11           H        GLY  11   6.813   2.128  -7.641
   64   1HA   GLY  11          1HA       GLY  11   9.100   1.612  -7.929
   65   2HA   GLY  11          2HA       GLY  11   9.480   3.317  -7.724
   66    H    GLY  12           H        GLY  12  10.393   3.853  -5.869
   67   1HA   GLY  12          1HA       GLY  12   9.890   2.103  -3.548
   68   2HA   GLY  12          2HA       GLY  12  11.445   2.856  -3.871
   69    H    ALA  13           H        ALA  13   8.136   4.199  -3.962
   70    HA   ALA  13           HA       ALA  13   9.052   6.506  -2.467
   71   1HB   ALA  13          1HB       ALA  13   6.459   5.760  -3.778
   72   2HB   ALA  13          2HB       ALA  13   6.577   7.157  -2.710
   73   3HB   ALA  13          3HB       ALA  13   7.558   7.081  -4.174
   74    HA   PRO  14           HA       PRO  14   7.852   5.085   1.544
   75   1HB   PRO  14          1HB       PRO  14   6.932   7.810   2.170
   76   2HB   PRO  14          2HB       PRO  14   8.243   6.876   2.895
   77   1HG   PRO  14          1HG       PRO  14   8.729   8.985   1.298
   78   2HG   PRO  14          2HG       PRO  14   9.790   7.565   1.330
   79   1HD   PRO  14          1HD       PRO  14   7.704   8.327  -0.680
   80   2HD   PRO  14          2HD       PRO  14   9.308   7.610  -0.935
   81    H    CYS  15           H        CYS  15   6.041   4.103   2.247
   82    HA   CYS  15           HA       CYS  15   3.550   4.494   0.952
   83   1HB   CYS  15          1HB       CYS  15   3.723   3.228   3.670
   84   2HB   CYS  15          2HB       CYS  15   2.725   2.769   2.301
   85    H    VAL  16           H        VAL  16   1.810   5.753   1.531
   86    HA   VAL  16           HA       VAL  16   2.218   7.579   3.789
   87    HB   VAL  16           HB       VAL  16   0.256   7.752   1.490
   88   1HG1  VAL  16          1HG1      VAL  16  -0.450   8.770   3.738
   89   2HG1  VAL  16          2HG1      VAL  16   0.846   9.935   3.466
   90   3HG1  VAL  16          3HG1      VAL  16  -0.486   9.814   2.316
   91   1HG2  VAL  16          1HG2      VAL  16   2.853   9.124   2.107
   92   2HG2  VAL  16          2HG2      VAL  16   2.397   8.233   0.654
   93   3HG2  VAL  16          3HG2      VAL  16   1.668   9.802   0.990
   94    H    PHE  17           H        PHE  17   1.306   6.998   5.653
   95    HA   PHE  17           HA       PHE  17  -1.261   5.593   5.551
   96   1HB   PHE  17          1HB       PHE  17   0.863   5.562   7.702
   97   2HB   PHE  17          2HB       PHE  17  -0.695   4.775   7.821
   98    HD1  PHE  17           1HD      PHE  17  -1.234   2.872   6.287
   99    HD2  PHE  17           2HD      PHE  17   2.645   4.579   6.582
  100    HE1  PHE  17           1HE      PHE  17  -0.275   0.859   5.264
  101    HE2  PHE  17           2HE      PHE  17   3.624   2.573   5.558
  102    HZ   PHE  17           HZ       PHE  17   2.175   0.684   4.880
  103    HA   PRO  18           HA       PRO  18  -2.781   5.084   6.817
  104   1HB   PRO  18          1HB       PRO  18  -5.415   6.052   7.155
  105   2HB   PRO  18          2HB       PRO  18  -4.451   5.169   8.338
  106   1HG   PRO  18          1HG       PRO  18  -5.282   7.837   8.530
  107   2HG   PRO  18          2HG       PRO  18  -4.063   7.042   9.540
  108   1HD   PRO  18          1HD       PRO  18  -3.706   8.855   7.207
  109   2HD   PRO  18          2HD       PRO  18  -2.678   8.630   8.640
  110    H    PHE  19           H        PHE  19  -3.308   4.318   4.842
  111    HA   PHE  19           HA       PHE  19  -4.404   6.270   2.926
  112   1HB   PHE  19          1HB       PHE  19  -3.491   4.972   1.123
  113   2HB   PHE  19          2HB       PHE  19  -2.208   5.299   2.278
  114    HD1  PHE  19           1HD      PHE  19  -4.337   2.729   0.768
  115    HD2  PHE  19           2HD      PHE  19  -1.198   3.512   3.541
  116    HE1  PHE  19           1HE      PHE  19  -3.764   0.347   0.782
  117    HE2  PHE  19           2HE      PHE  19  -0.637   1.114   3.562
  118    HZ   PHE  19           HZ       PHE  19  -1.900  -0.461   2.183
  119    H    THR  20           H        THR  20  -6.357   5.952   2.093
  120    HA   THR  20           HA       THR  20  -7.816   3.653   3.134
  121    HB   THR  20           HB       THR  20  -8.783   6.210   1.829
  122    HG1  THR  20           1HG      THR  20  -8.150   6.817   3.773
  123   1HG2  THR  20          1HG2      THR  20 -10.932   5.461   3.147
  124   2HG2  THR  20          2HG2      THR  20 -10.634   4.941   1.488
  125   3HG2  THR  20          3HG2      THR  20 -10.277   3.854   2.830
  126    H    PHE  21           H        PHE  21  -8.497   2.026   2.035
  127    HA   PHE  21           HA       PHE  21  -8.717   2.178  -0.905
  128   1HB   PHE  21          1HB       PHE  21  -6.607   0.979   0.041
  129   2HB   PHE  21          2HB       PHE  21  -7.729  -0.251   0.565
  130    HD1  PHE  21           1HD      PHE  21  -8.733   1.230  -2.560
  131    HD2  PHE  21           2HD      PHE  21  -6.226  -1.706  -0.784
  132    HE1  PHE  21           1HE      PHE  21  -8.561   0.057  -4.702
  133    HE2  PHE  21           2HE      PHE  21  -6.040  -2.872  -2.922
  134    HZ   PHE  21           HZ       PHE  21  -7.210  -1.979  -4.909
  135    H    LEU  22           H        LEU  22 -10.421   0.859  -1.694
  136    HA   LEU  22           HA       LEU  22 -12.574   0.224  -1.685
  137   1HB   LEU  22          1HB       LEU  22 -11.114  -1.701   0.018
  138   2HB   LEU  22          2HB       LEU  22 -12.664  -2.068  -0.720
  139    HG   LEU  22           HG       LEU  22 -11.449  -2.864  -2.422
  140   1HD1  LEU  22          1HD1      LEU  22 -11.981  -0.551  -3.262
  141   2HD1  LEU  22          2HD1      LEU  22 -10.250  -0.277  -3.049
  142   3HD1  LEU  22          3HD1      LEU  22 -10.819  -1.543  -4.136
  143   1HD2  LEU  22          1HD2      LEU  22  -9.461  -2.256  -0.608
  144   2HD2  LEU  22          2HD2      LEU  22  -9.469  -3.479  -1.882
  145   3HD2  LEU  22          3HD2      LEU  22  -8.886  -1.847  -2.220
  146    H    GLY  23           H        GLY  23 -12.258   2.254   0.303
  147   1HA   GLY  23          1HA       GLY  23 -13.817   3.167   1.779
  148   2HA   GLY  23          2HA       GLY  23 -14.560   1.589   1.936
  149    H    ASN  24           H        ASN  24 -11.411   0.890   2.536
  150    HA   ASN  24           HA       ASN  24 -11.818   1.389   5.402
  151   1HB   ASN  24          1HB       ASN  24 -10.302  -0.815   4.001
  152   2HB   ASN  24          2HB       ASN  24 -10.384  -0.596   5.743
  153   1HD2  ASN  24          1HD2      ASN  24 -13.292  -2.472   3.781
  154   2HD2  ASN  24          2HD2      ASN  24 -11.795  -2.005   3.073
  155    H    LYS  25           H        LYS  25 -10.362   2.439   6.549
  156    HA   LYS  25           HA       LYS  25  -8.199   3.775   5.254
  157   1HB   LYS  25          1HB       LYS  25  -9.095   3.652   8.146
  158   2HB   LYS  25          2HB       LYS  25  -7.975   4.805   7.466
  159   1HG   LYS  25          1HG       LYS  25  -9.614   5.946   6.292
  160   2HG   LYS  25          2HG       LYS  25 -10.721   4.576   6.338
  161   1HD   LYS  25          1HD       LYS  25 -11.552   6.270   7.798
  162   2HD   LYS  25          2HD       LYS  25 -10.968   4.932   8.791
  163   1HE   LYS  25          1HE       LYS  25  -9.203   7.278   8.168
  164   2HE   LYS  25          2HE       LYS  25 -10.403   7.382   9.455
  165   1HZ   LYS  25          1HZ       LYS  25  -8.465   5.147   9.386
  166   2HZ   LYS  25          2HZ       LYS  25  -8.028   6.655  10.030
  167   3HZ   LYS  25          3HZ       LYS  25  -9.318   5.782  10.709
  168    H    TYR  26           H        TYR  26  -6.154   2.927   5.102
  169    HA   TYR  26           HA       TYR  26  -5.554   0.676   6.871
  170   1HB   TYR  26          1HB       TYR  26  -4.253   1.428   4.254
  171   2HB   TYR  26          2HB       TYR  26  -3.891   0.007   5.221
  172    HD1  TYR  26           1HD      TYR  26  -6.829  -0.585   5.962
  173    HD2  TYR  26           2HD      TYR  26  -4.900   0.280   2.282
  174    HE1  TYR  26           1HE      TYR  26  -8.541  -1.861   4.763
  175    HE2  TYR  26           2HE      TYR  26  -6.600  -0.987   1.087
  176    HH   TYR  26           HH       TYR  26  -9.351  -1.599   1.928
  177    H    GLU  27           H        GLU  27  -4.387   1.094   8.487
  178    HA   GLU  27           HA       GLU  27  -2.547   3.346   8.513
  179   1HB   GLU  27          1HB       GLU  27  -3.701   1.573  10.634
  180   2HB   GLU  27          2HB       GLU  27  -2.391   2.678  10.964
  181   1HG   GLU  27          1HG       GLU  27  -3.777   4.544  10.204
  182   2HG   GLU  27          2HG       GLU  27  -5.103   3.420   9.924
  183    H    SER  28           H        SER  28  -2.580   0.016   8.074
  184    HA   SER  28           HA       SER  28   0.333  -0.091   8.259
  185   1HB   SER  28          1HB       SER  28  -0.092  -2.581   8.830
  186   2HB   SER  28          2HB       SER  28  -0.298  -1.404  10.118
  187    HG   SER  28           HG       SER  28  -2.591  -1.787   8.690
  188    H    CYS  29           H        CYS  29   0.956  -2.295   6.956
  189    HA   CYS  29           HA       CYS  29   0.198  -1.808   4.296
  190   1HB   CYS  29          1HB       CYS  29   1.355  -4.331   5.478
  191   2HB   CYS  29          2HB       CYS  29   1.262  -3.959   3.771
  192    H    THR  30           H        THR  30  -0.796  -3.384   2.868
  193    HA   THR  30           HA       THR  30  -2.863  -5.057   4.080
  194    HB   THR  30           HB       THR  30  -3.870  -2.762   3.689
  195    HG1  THR  30           1HG      THR  30  -5.363  -4.323   3.618
  196   1HG2  THR  30          1HG2      THR  30  -4.392  -2.717   1.011
  197   2HG2  THR  30          2HG2      THR  30  -3.211  -1.704   1.837
  198   3HG2  THR  30          3HG2      THR  30  -2.695  -3.201   1.057
  199    H    SER  31           H        SER  31  -4.007  -6.271   2.302
  200    HA   SER  31           HA       SER  31  -2.229  -6.698   0.019
  201   1HB   SER  31          1HB       SER  31  -2.882  -9.159   0.167
  202   2HB   SER  31          2HB       SER  31  -1.784  -8.569   1.428
  203    HG   SER  31           HG       SER  31  -3.522  -9.870   2.251
  204    H    ALA  32           H        ALA  32  -4.606  -5.114   0.612
  205    HA   ALA  32           HA       ALA  32  -6.959  -6.145  -0.507
  206   1HB   ALA  32          1HB       ALA  32  -6.346  -3.859   0.794
  207   2HB   ALA  32          2HB       ALA  32  -6.420  -3.253  -0.859
  208   3HB   ALA  32          3HB       ALA  32  -7.818  -4.060  -0.156
  209    H    GLY  33           H        GLY  33  -7.792  -6.157  -2.551
  210   1HA   GLY  33          1HA       GLY  33  -7.841  -5.920  -4.852
  211   2HA   GLY  33          2HA       GLY  33  -6.504  -4.784  -4.722
  212    H    ARG  34           H        ARG  34  -5.322  -7.244  -3.052
  213    HA   ARG  34           HA       ARG  34  -4.112  -8.494  -5.413
  214   1HB   ARG  34          1HB       ARG  34  -3.051  -8.314  -2.587
  215   2HB   ARG  34          2HB       ARG  34  -2.225  -9.027  -3.950
  216   1HG   ARG  34          1HG       ARG  34  -2.669  -6.542  -4.902
  217   2HG   ARG  34          2HG       ARG  34  -2.507  -6.217  -3.175
  218   1HD   ARG  34          1HD       ARG  34  -0.355  -6.121  -4.461
  219   2HD   ARG  34          2HD       ARG  34  -0.353  -7.255  -3.106
  220    HE   ARG  34           HE       ARG  34  -0.019  -8.954  -4.582
  221   1HH1  ARG  34          1HH1      ARG  34  -1.304  -6.222  -6.369
  222   2HH1  ARG  34          2HH1      ARG  34  -1.221  -7.026  -7.904
  223   1HH2  ARG  34          1HH2      ARG  34   0.044 -10.017  -6.595
  224   2HH2  ARG  34          2HH2      ARG  34  -0.496  -9.197  -8.027
  225    H    SER  35           H        SER  35  -4.141  -9.564  -2.071
  226    HA   SER  35           HA       SER  35  -4.755 -11.485  -1.042
  227   1HB   SER  35          1HB       SER  35  -7.023 -10.716  -2.002
  228   2HB   SER  35          2HB       SER  35  -6.786 -11.965  -3.224
  229    HG   SER  35           HG       SER  35  -7.355 -13.407  -1.807
  230    H    ASP  36           H        ASP  36  -2.866 -11.412  -3.426
  231    HA   ASP  36           HA       ASP  36  -3.010 -14.179  -4.313
  232   1HB   ASP  36          1HB       ASP  36  -1.724 -13.543  -6.114
  233   2HB   ASP  36          2HB       ASP  36  -2.527 -12.032  -5.745
  234    H    GLY  37           H        GLY  37  -1.183 -12.010  -2.385
  235   1HA   GLY  37          1HA       GLY  37  -0.138 -13.657  -0.554
  236   2HA   GLY  37          2HA       GLY  37   0.967 -13.892  -1.895
  237    H    LYS  38           H        LYS  38   1.529 -11.544  -2.918
  238    HA   LYS  38           HA       LYS  38   3.162 -10.306  -1.002
  239   1HB   LYS  38          1HB       LYS  38   2.284  -9.208  -3.676
  240   2HB   LYS  38          2HB       LYS  38   3.708  -8.733  -2.761
  241   1HG   LYS  38          1HG       LYS  38   4.465 -10.121  -4.477
  242   2HG   LYS  38          2HG       LYS  38   4.519 -11.119  -3.039
  243   1HD   LYS  38          1HD       LYS  38   2.428 -12.183  -3.713
  244   2HD   LYS  38          2HD       LYS  38   2.348 -11.145  -5.138
  245   1HE   LYS  38          1HE       LYS  38   4.346 -12.155  -6.035
  246   2HE   LYS  38          2HE       LYS  38   4.579 -13.090  -4.553
  247   1HZ   LYS  38          1HZ       LYS  38   1.991 -13.444  -5.815
  248   2HZ   LYS  38          2HZ       LYS  38   3.302 -13.997  -6.740
  249   3HZ   LYS  38          3HZ       LYS  38   3.063 -14.603  -5.172
  250    H    MET  39           H        MET  39   2.906  -8.538   0.257
  251    HA   MET  39           HA       MET  39   0.278  -7.260   0.238
  252   1HB   MET  39          1HB       MET  39   2.478  -7.287   2.312
  253   2HB   MET  39          2HB       MET  39   0.993  -6.368   2.450
  254   1HG   MET  39          1HG       MET  39  -0.290  -8.461   2.338
  255   2HG   MET  39          2HG       MET  39   1.226  -9.354   2.296
  256   1HE   MET  39          1HE       MET  39   0.152 -10.733   4.227
  257   2HE   MET  39          2HE       MET  39  -0.082 -10.149   5.879
  258   3HE   MET  39          3HE       MET  39  -1.225  -9.701   4.612
  259    H    TRP  40           H        TRP  40   0.246  -4.876   0.544
  260    HA   TRP  40           HA       TRP  40   2.671  -3.543  -0.400
  261   1HB   TRP  40          1HB       TRP  40   1.428  -2.329  -2.147
  262   2HB   TRP  40          2HB       TRP  40   1.445  -4.066  -2.448
  263    HD1  TRP  40           HD1      TRP  40  -0.946  -5.360  -1.611
  264    HE1  TRP  40           1HE      TRP  40  -3.352  -4.492  -1.787
  265    HE3  TRP  40           3HE      TRP  40   0.035  -0.394  -2.185
  266    HZ2  TRP  40           2HZ      TRP  40  -4.651  -2.029  -2.089
  267    HZ3  TRP  40           3HZ      TRP  40  -1.855   1.166  -2.376
  268    HH2  TRP  40           HH2      TRP  40  -4.152   0.354  -2.336
  269    H    CYS  41           H        CYS  41   1.868  -1.078  -0.812
  270    HA   CYS  41           HA       CYS  41   0.131  -0.070   1.268
  271   1HB   CYS  41          1HB       CYS  41   1.959   1.422   2.179
  272   2HB   CYS  41          2HB       CYS  41   2.132  -0.281   2.597
  273    H    ALA  42           H        ALA  42  -0.687   1.939   0.664
  274    HA   ALA  42           HA       ALA  42  -0.085   2.747  -2.027
  275   1HB   ALA  42          1HB       ALA  42  -1.940   3.862   0.053
  276   2HB   ALA  42          2HB       ALA  42  -1.696   4.629  -1.514
  277   3HB   ALA  42          3HB       ALA  42  -2.344   2.987  -1.429
  278    H    THR  43           H        THR  43   0.655   4.829  -2.667
  279    HA   THR  43           HA       THR  43   2.530   5.934  -0.703
  280    HB   THR  43           HB       THR  43   3.808   6.725  -2.632
  281    HG1  THR  43           1HG      THR  43   2.520   7.119  -4.286
  282   1HG2  THR  43          1HG2      THR  43   3.962   4.356  -3.825
  283   2HG2  THR  43          2HG2      THR  43   4.608   4.637  -2.208
  284   3HG2  THR  43          3HG2      THR  43   3.032   3.872  -2.408
  285    H    THR  44           H        THR  44  -0.417   6.442  -1.316
  286    HA   THR  44           HA       THR  44  -0.238   9.348  -1.129
  287    HB   THR  44           HB       THR  44  -2.310   9.514  -2.545
  288    HG1  THR  44           1HG      THR  44  -3.230   7.749  -3.159
  289   1HG2  THR  44          1HG2      THR  44  -0.817   8.434  -4.639
  290   2HG2  THR  44          2HG2      THR  44  -0.865  10.116  -4.105
  291   3HG2  THR  44          3HG2      THR  44   0.368   9.021  -3.470
  292    H    ALA  45           H        ALA  45  -1.854  10.283   0.169
  293    HA   ALA  45           HA       ALA  45  -2.714   8.877   2.390
  294   1HB   ALA  45          1HB       ALA  45  -3.456  11.478   1.175
  295   2HB   ALA  45          2HB       ALA  45  -4.516  10.829   2.426
  296   3HB   ALA  45          3HB       ALA  45  -2.809  11.112   2.775
  297    H    ASN  46           H        ASN  46  -4.537   9.543  -0.587
  298    HA   ASN  46           HA       ASN  46  -6.444   7.485   0.299
  299   1HB   ASN  46          1HB       ASN  46  -7.413   9.840   0.123
  300   2HB   ASN  46          2HB       ASN  46  -7.159   9.703  -1.621
  301   1HD2  ASN  46          1HD2      ASN  46 -10.391   8.176   0.074
  302   2HD2  ASN  46          2HD2      ASN  46  -9.283   9.235   0.858
  303    H    TYR  47           H        TYR  47  -5.893   5.722  -0.727
  304    HA   TYR  47           HA       TYR  47  -4.488   5.722  -3.191
  305   1HB   TYR  47          1HB       TYR  47  -4.168   3.964  -1.515
  306   2HB   TYR  47          2HB       TYR  47  -5.829   3.424  -1.759
  307    HD1  TYR  47           1HD      TYR  47  -2.658   3.993  -3.632
  308    HD2  TYR  47           2HD      TYR  47  -6.267   1.767  -3.321
  309    HE1  TYR  47           1HE      TYR  47  -1.919   2.556  -5.480
  310    HE2  TYR  47           2HE      TYR  47  -5.534   0.332  -5.169
  311    HH   TYR  47           HH       TYR  47  -3.052  -0.318  -6.120
  312    H    ASP  48           H        ASP  48  -7.884   5.348  -2.383
  313    HA   ASP  48           HA       ASP  48  -8.657   4.253  -4.853
  314   1HB   ASP  48          1HB       ASP  48 -10.055   5.526  -2.574
  315   2HB   ASP  48          2HB       ASP  48 -10.915   5.458  -4.108
  316    H    ASP  49           H        ASP  49  -7.909   7.451  -3.864
  317    HA   ASP  49           HA       ASP  49  -9.189   8.739  -6.101
  318   1HB   ASP  49          1HB       ASP  49  -7.385   9.729  -3.897
  319   2HB   ASP  49          2HB       ASP  49  -7.950  10.766  -5.193
  320    H    ASP  50           H        ASP  50  -5.797   8.535  -5.000
  321    HA   ASP  50           HA       ASP  50  -4.864   9.389  -7.603
  322   1HB   ASP  50          1HB       ASP  50  -3.388   8.732  -5.052
  323   2HB   ASP  50          2HB       ASP  50  -2.613   9.315  -6.519
  324    H    ARG  51           H        ARG  51  -5.276   6.339  -6.055
  325    HA   ARG  51           HA       ARG  51  -4.561   4.272  -6.443
  326   1HB   ARG  51          1HB       ARG  51  -5.006   5.297  -9.210
  327   2HB   ARG  51          2HB       ARG  51  -4.805   3.590  -8.814
  328   1HG   ARG  51          1HG       ARG  51  -6.664   4.502  -6.985
  329   2HG   ARG  51          2HG       ARG  51  -7.130   5.288  -8.502
  330   1HD   ARG  51          1HD       ARG  51  -7.023   3.088  -9.602
  331   2HD   ARG  51          2HD       ARG  51  -6.676   2.363  -8.035
  332    HE   ARG  51           HE       ARG  51  -9.240   3.177  -9.036
  333   1HH1  ARG  51          1HH1      ARG  51  -7.352   2.638  -6.137
  334   2HH1  ARG  51          2HH1      ARG  51  -8.745   2.490  -5.106
  335   1HH2  ARG  51          1HH2      ARG  51 -11.058   2.950  -7.690
  336   2HH2  ARG  51          2HH2      ARG  51 -10.850   2.627  -5.997
  337    H    LYS  52           H        LYS  52  -2.357   5.478  -5.707
  338    HA   LYS  52           HA       LYS  52  -0.349   4.365  -7.533
  339   1HB   LYS  52          1HB       LYS  52  -0.173   6.847  -5.824
  340   2HB   LYS  52          2HB       LYS  52   1.271   6.002  -6.360
  341   1HG   LYS  52          1HG       LYS  52   0.581   6.335  -8.692
  342   2HG   LYS  52          2HG       LYS  52  -0.838   7.223  -8.131
  343   1HD   LYS  52          1HD       LYS  52   0.575   8.910  -7.115
  344   2HD   LYS  52          2HD       LYS  52   2.020   7.995  -7.539
  345   1HE   LYS  52          1HE       LYS  52   0.048   9.191  -9.483
  346   2HE   LYS  52          2HE       LYS  52   1.626   9.863  -9.077
  347   1HZ   LYS  52          1HZ       LYS  52   2.466   7.534  -9.837
  348   2HZ   LYS  52          2HZ       LYS  52   0.986   7.450 -10.653
  349   3HZ   LYS  52          3HZ       LYS  52   2.074   8.711 -11.004
  350    H    TRP  53           H        TRP  53   0.631   2.669  -6.730
  351    HA   TRP  53           HA       TRP  53   0.757   2.386  -3.807
  352   1HB   TRP  53          1HB       TRP  53   0.005   0.096  -4.020
  353   2HB   TRP  53          2HB       TRP  53  -1.170   1.183  -4.690
  354    HD1  TRP  53           HD1      TRP  53  -0.826   1.437  -7.600
  355    HE1  TRP  53           1HE      TRP  53  -0.431  -0.533  -9.217
  356    HE3  TRP  53           3HE      TRP  53   0.774  -1.902  -4.224
  357    HZ2  TRP  53           2HZ      TRP  53   0.461  -3.245  -9.032
  358    HZ3  TRP  53           3HZ      TRP  53   1.395  -4.205  -4.969
  359    HH2  TRP  53           HH2      TRP  53   1.240  -4.846  -7.321
  360    H    GLY  54           H        GLY  54   1.925   0.331  -3.243
  361   1HA   GLY  54          1HA       GLY  54   3.964  -0.683  -4.922
  362   2HA   GLY  54          2HA       GLY  54   4.618   0.496  -3.785
  363    H    PHE  55           H        PHE  55   5.048  -2.428  -3.929
  364    HA   PHE  55           HA       PHE  55   3.610  -3.778  -1.931
  365   1HB   PHE  55          1HB       PHE  55   6.318  -4.191  -3.150
  366   2HB   PHE  55          2HB       PHE  55   5.694  -5.252  -1.906
  367    HD1  PHE  55           1HD      PHE  55   2.845  -4.419  -3.529
  368    HD2  PHE  55           2HD      PHE  55   6.462  -6.543  -4.225
  369    HE1  PHE  55           1HE      PHE  55   1.711  -5.806  -5.232
  370    HE2  PHE  55           2HE      PHE  55   5.334  -7.920  -5.922
  371    HZ   PHE  55           HZ       PHE  55   2.959  -7.545  -6.428
  372    H    CYS  56           H        CYS  56   4.566  -4.695   0.030
  373    HA   CYS  56           HA       CYS  56   6.049  -2.655   1.544
  374   1HB   CYS  56          1HB       CYS  56   4.127  -4.837   2.384
  375   2HB   CYS  56          2HB       CYS  56   5.239  -4.104   3.543
  376    HA   PRO  57           HA       PRO  57   9.575  -5.281   1.798
  377   1HB   PRO  57          1HB       PRO  57  10.381  -5.392   4.346
  378   2HB   PRO  57          2HB       PRO  57  10.442  -3.887   3.409
  379   1HG   PRO  57          1HG       PRO  57   8.279  -4.891   5.192
  380   2HG   PRO  57          2HG       PRO  57   9.123  -3.332   5.319
  381   1HD   PRO  57          1HD       PRO  57   6.765  -3.442   4.117
  382   2HD   PRO  57          2HD       PRO  57   8.080  -2.520   3.350
  383    H    ASP  58           H        ASP  58  10.471  -6.923   3.890
  384    HA   ASP  58           HA       ASP  58   9.383  -9.383   3.113
  385   1HB   ASP  58          1HB       ASP  58  11.676  -9.029   4.039
  386   2HB   ASP  58          2HB       ASP  58  10.955  -8.850   5.634
  387    H    GLN  59           H        GLN  59   7.915 -10.755   3.970
  388    HA   GLN  59           HA       GLN  59   6.192  -9.690   6.091
  389   1HB   GLN  59          1HB       GLN  59   5.734 -11.974   4.157
  390   2HB   GLN  59          2HB       GLN  59   4.563 -11.384   5.322
  391   1HG   GLN  59          1HG       GLN  59   4.499  -9.239   4.159
  392   2HG   GLN  59          2HG       GLN  59   5.675  -9.842   2.992
  393   1HE2  GLN  59          1HE2      GLN  59   3.187 -11.081   0.950
  394   2HE2  GLN  59          2HE2      GLN  59   4.730 -10.322   1.137
  395    H    GLY  60           H        GLY  60   7.495 -12.830   5.049
  396   1HA   GLY  60          1HA       GLY  60   8.726 -13.555   7.417
  397   2HA   GLY  60          2HA       GLY  60   7.055 -14.090   7.551
  Start of MODEL   46
    1    H    SER   1           1H       SER   1  18.149   7.670   3.891
    2    HA   SER   1           HA       SER   1  17.548   5.612   5.168
    3   1HB   SER   1          1HB       SER   1  17.810   6.984   7.362
    4   2HB   SER   1          2HB       SER   1  16.215   7.622   6.985
    5    HG   SER   1           HG       SER   1  16.516   5.579   8.364
    6    H    TRP   2           H        TRP   2  16.199   5.077   3.586
    7    HA   TRP   2           HA       TRP   2  13.595   6.311   3.400
    8   1HB   TRP   2          1HB       TRP   2  15.077   7.748   1.974
    9   2HB   TRP   2          2HB       TRP   2  15.434   6.333   0.991
   10    HD1  TRP   2           HD1      TRP   2  13.046   5.188  -0.151
   11    HE1  TRP   2           1HE      TRP   2  11.144   6.481  -1.304
   12    HE3  TRP   2           3HE      TRP   2  13.868   9.810   1.870
   13    HZ2  TRP   2           2HZ      TRP   2  10.110   9.108  -1.331
   14    HZ3  TRP   2           3HZ      TRP   2  12.360  11.654   1.250
   15    HH2  TRP   2           HH2      TRP   2  10.519  11.308  -0.321
   16    H    MET   3           H        MET   3  12.482   4.435   3.605
   17    HA   MET   3           HA       MET   3  13.426   2.056   2.236
   18   1HB   MET   3          1HB       MET   3  11.490   0.960   3.429
   19   2HB   MET   3          2HB       MET   3  12.742   1.618   4.461
   20   1HG   MET   3          1HG       MET   3  11.388   3.438   5.107
   21   2HG   MET   3          2HG       MET   3  10.217   3.111   3.827
   22   1HE   MET   3          1HE       MET   3   9.085   3.828   6.010
   23   2HE   MET   3          2HE       MET   3   7.845   2.595   6.237
   24   3HE   MET   3          3HE       MET   3   9.048   2.880   7.495
   25    H    SER   4           H        SER   4  12.854   1.745   0.200
   26    HA   SER   4           HA       SER   4  10.422   2.963  -0.834
   27   1HB   SER   4          1HB       SER   4  12.545   1.370  -2.288
   28   2HB   SER   4          2HB       SER   4  11.263   2.321  -3.029
   29    HG   SER   4           HG       SER   4  12.219   4.187  -2.308
   30    H    THR   5           H        THR   5   8.923   1.712  -2.144
   31    HA   THR   5           HA       THR   5   8.231  -0.760  -0.844
   32    HB   THR   5           HB       THR   5   6.283  -0.654  -2.459
   33    HG1  THR   5           1HG      THR   5   7.000   2.004  -2.944
   34   1HG2  THR   5          1HG2      THR   5   5.400   1.580  -1.471
   35   2HG2  THR   5          2HG2      THR   5   5.617   0.163  -0.443
   36   3HG2  THR   5          3HG2      THR   5   6.826   1.447  -0.440
   37    H    VAL   6           H        VAL   6   7.366  -2.534  -2.230
   38    HA   VAL   6           HA       VAL   6   9.244  -3.199  -4.413
   39    HB   VAL   6           HB       VAL   6   7.610  -5.407  -3.491
   40   1HG1  VAL   6          1HG1      VAL   6  10.363  -4.849  -4.225
   41   2HG1  VAL   6          2HG1      VAL   6  10.214  -6.052  -2.941
   42   3HG1  VAL   6          3HG1      VAL   6   9.390  -6.298  -4.483
   43   1HG2  VAL   6          1HG2      VAL   6   7.659  -4.228  -1.346
   44   2HG2  VAL   6          2HG2      VAL   6   8.565  -5.741  -1.287
   45   3HG2  VAL   6          3HG2      VAL   6   9.419  -4.201  -1.411
   46    H    GLY   7           H        GLY   7   7.770  -5.161  -5.603
   47   1HA   GLY   7          1HA       GLY   7   6.176  -5.310  -7.300
   48   2HA   GLY   7          2HA       GLY   7   5.102  -4.991  -5.973
   49    H    GLY   8           H        GLY   8   3.690  -3.583  -6.414
   50   1HA   GLY   8          1HA       GLY   8   2.562  -1.883  -7.495
   51   2HA   GLY   8          2HA       GLY   8   3.744  -0.981  -6.585
   52    H    ASN   9           H        ASN   9   3.909   0.711  -7.859
   53    HA   ASN   9           HA       ASN   9   5.516   0.452 -10.229
   54   1HB   ASN   9          1HB       ASN   9   3.996   1.713 -11.704
   55   2HB   ASN   9          2HB       ASN   9   3.356   0.141 -11.276
   56   1HD2  ASN   9          1HD2      ASN   9   1.333   2.475  -8.874
   57   2HD2  ASN   9          2HD2      ASN   9   2.901   1.806  -8.596
   58    H    SER  10           H        SER  10   5.508   1.680  -7.531
   59    HA   SER  10           HA       SER  10   5.526   4.531  -8.068
   60   1HB   SER  10          1HB       SER  10   6.559   4.176  -5.541
   61   2HB   SER  10          2HB       SER  10   4.861   4.444  -5.917
   62    HG   SER  10           HG       SER  10   4.565   2.541  -5.079
   63    H    GLY  11           H        GLY  11   7.741   1.893  -7.916
   64   1HA   GLY  11          1HA       GLY  11   9.950   1.860  -8.609
   65   2HA   GLY  11          2HA       GLY  11   9.901   3.609  -8.763
   66    H    GLY  12           H        GLY  12   9.975   4.864  -6.717
   67   1HA   GLY  12          1HA       GLY  12  11.503   3.384  -4.670
   68   2HA   GLY  12          2HA       GLY  12  12.009   4.965  -5.239
   69    H    ALA  13           H        ALA  13   8.629   4.767  -5.033
   70    HA   ALA  13           HA       ALA  13   8.644   6.572  -2.786
   71   1HB   ALA  13          1HB       ALA  13   7.005   6.297  -4.938
   72   2HB   ALA  13          2HB       ALA  13   6.043   5.561  -3.654
   73   3HB   ALA  13          3HB       ALA  13   6.623   7.218  -3.483
   74    HA   PRO  14           HA       PRO  14   7.756   3.466   0.247
   75   1HB   PRO  14          1HB       PRO  14   7.464   5.114   2.359
   76   2HB   PRO  14          2HB       PRO  14   9.033   4.799   1.615
   77   1HG   PRO  14          1HG       PRO  14   7.359   7.219   1.498
   78   2HG   PRO  14          2HG       PRO  14   9.104   7.048   1.264
   79   1HD   PRO  14          1HD       PRO  14   7.079   7.284  -0.747
   80   2HD   PRO  14          2HD       PRO  14   8.823   7.048  -0.976
   81    H    CYS  15           H        CYS  15   6.094   3.215   2.140
   82    HA   CYS  15           HA       CYS  15   3.486   3.519   0.929
   83   1HB   CYS  15          1HB       CYS  15   3.930   2.519   3.735
   84   2HB   CYS  15          2HB       CYS  15   2.677   2.067   2.590
   85    H    VAL  16           H        VAL  16   1.715   4.648   1.849
   86    HA   VAL  16           HA       VAL  16   2.472   6.717   3.818
   87    HB   VAL  16           HB       VAL  16   0.394   6.935   1.618
   88   1HG1  VAL  16          1HG1      VAL  16  -0.081   8.123   3.839
   89   2HG1  VAL  16          2HG1      VAL  16   1.293   9.155   3.437
   90   3HG1  VAL  16          3HG1      VAL  16  -0.113   9.101   2.372
   91   1HG2  VAL  16          1HG2      VAL  16   3.212   7.778   1.864
   92   2HG2  VAL  16          2HG2      VAL  16   2.266   7.378   0.428
   93   3HG2  VAL  16          3HG2      VAL  16   2.096   8.964   1.183
   94    H    PHE  17           H        PHE  17   1.529   6.411   5.749
   95    HA   PHE  17           HA       PHE  17  -1.090   5.093   5.787
   96   1HB   PHE  17          1HB       PHE  17   1.180   4.905   7.762
   97   2HB   PHE  17          2HB       PHE  17  -0.421   4.248   8.030
   98    HD1  PHE  17           1HD      PHE  17  -1.259   2.707   5.947
   99    HD2  PHE  17           2HD      PHE  17   2.763   3.472   7.091
  100    HE1  PHE  17           1HE      PHE  17  -0.549   0.629   4.849
  101    HE2  PHE  17           2HE      PHE  17   3.488   1.398   5.998
  102    HZ   PHE  17           HZ       PHE  17   1.833  -0.055   4.858
  103    HA   PRO  18           HA       PRO  18  -2.517   4.618   7.031
  104   1HB   PRO  18          1HB       PRO  18  -5.090   5.567   7.618
  105   2HB   PRO  18          2HB       PRO  18  -4.035   4.673   8.713
  106   1HG   PRO  18          1HG       PRO  18  -4.864   7.361   8.977
  107   2HG   PRO  18          2HG       PRO  18  -3.629   6.531   9.937
  108   1HD   PRO  18          1HD       PRO  18  -3.316   8.387   7.642
  109   2HD   PRO  18          2HD       PRO  18  -2.229   8.090   9.017
  110    H    PHE  19           H        PHE  19  -3.289   3.971   5.057
  111    HA   PHE  19           HA       PHE  19  -4.333   6.146   3.370
  112   1HB   PHE  19          1HB       PHE  19  -3.760   4.858   1.414
  113   2HB   PHE  19          2HB       PHE  19  -2.350   5.023   2.440
  114    HD1  PHE  19           1HD      PHE  19  -1.630   3.036   3.822
  115    HD2  PHE  19           2HD      PHE  19  -4.541   2.785   0.737
  116    HE1  PHE  19           1HE      PHE  19  -1.237   0.615   3.648
  117    HE2  PHE  19           2HE      PHE  19  -4.160   0.363   0.561
  118    HZ   PHE  19           HZ       PHE  19  -2.503  -0.724   2.017
  119    H    THR  20           H        THR  20  -5.713   4.705   1.485
  120    HA   THR  20           HA       THR  20  -7.611   3.055   2.946
  121    HB   THR  20           HB       THR  20  -8.443   5.590   1.495
  122    HG1  THR  20           1HG      THR  20  -7.654   5.208   4.008
  123   1HG2  THR  20          1HG2      THR  20 -10.295   4.062   3.230
  124   2HG2  THR  20          2HG2      THR  20 -10.631   5.118   1.857
  125   3HG2  THR  20          3HG2      THR  20 -10.013   3.489   1.587
  126    H    PHE  21           H        PHE  21  -8.232   1.419   1.754
  127    HA   PHE  21           HA       PHE  21  -8.059   1.682  -1.186
  128   1HB   PHE  21          1HB       PHE  21  -6.313   0.172  -0.122
  129   2HB   PHE  21          2HB       PHE  21  -7.641  -0.837   0.402
  130    HD1  PHE  21           1HD      PHE  21  -6.157   0.594  -2.696
  131    HD2  PHE  21           2HD      PHE  21  -8.469  -2.526  -0.969
  132    HE1  PHE  21           1HE      PHE  21  -6.033  -0.652  -4.797
  133    HE2  PHE  21           2HE      PHE  21  -8.341  -3.779  -3.065
  134    HZ   PHE  21           HZ       PHE  21  -7.129  -2.850  -4.994
  135    H    LEU  22           H        LEU  22  -9.765   1.080  -2.257
  136    HA   LEU  22           HA       LEU  22 -11.959   0.761  -2.625
  137   1HB   LEU  22          1HB       LEU  22 -10.515  -1.651  -1.778
  138   2HB   LEU  22          2HB       LEU  22 -12.189  -1.798  -2.284
  139    HG   LEU  22           HG       LEU  22 -10.516  -2.210  -4.091
  140   1HD1  LEU  22          1HD1      LEU  22 -12.895  -0.865  -4.100
  141   2HD1  LEU  22          2HD1      LEU  22 -11.822   0.127  -5.092
  142   3HD1  LEU  22          3HD1      LEU  22 -12.072  -1.570  -5.495
  143   1HD2  LEU  22          1HD2      LEU  22  -9.072  -0.219  -3.256
  144   2HD2  LEU  22          2HD2      LEU  22  -9.173  -0.597  -4.975
  145   3HD2  LEU  22          3HD2      LEU  22 -10.138   0.720  -4.303
  146    H    GLY  23           H        GLY  23 -11.979   2.074  -0.325
  147   1HA   GLY  23          1HA       GLY  23 -13.790   2.578   1.094
  148   2HA   GLY  23          2HA       GLY  23 -14.313   0.914   0.983
  149    H    ASN  24           H        ASN  24 -11.196   0.395   1.830
  150    HA   ASN  24           HA       ASN  24 -11.897   0.688   4.676
  151   1HB   ASN  24          1HB       ASN  24 -10.131  -1.392   3.384
  152   2HB   ASN  24          2HB       ASN  24 -10.609  -1.324   5.076
  153   1HD2  ASN  24          1HD2      ASN  24 -12.904  -3.154   2.406
  154   2HD2  ASN  24          2HD2      ASN  24 -11.298  -2.611   2.104
  155    H    LYS  25           H        LYS  25 -10.528   1.638   6.051
  156    HA   LYS  25           HA       LYS  25  -8.296   3.140   5.104
  157   1HB   LYS  25          1HB       LYS  25  -9.183   2.595   7.940
  158   2HB   LYS  25          2HB       LYS  25  -8.243   3.942   7.360
  159   1HG   LYS  25          1HG       LYS  25 -11.049   3.492   6.437
  160   2HG   LYS  25          2HG       LYS  25 -10.687   4.357   7.931
  161   1HD   LYS  25          1HD       LYS  25  -9.322   5.958   6.656
  162   2HD   LYS  25          2HD       LYS  25  -9.737   5.100   5.169
  163   1HE   LYS  25          1HE       LYS  25 -12.055   5.654   5.425
  164   2HE   LYS  25          2HE       LYS  25 -11.769   6.325   7.030
  165   1HZ   LYS  25          1HZ       LYS  25 -10.120   7.835   5.649
  166   2HZ   LYS  25          2HZ       LYS  25 -11.221   7.485   4.412
  167   3HZ   LYS  25          3HZ       LYS  25 -11.763   8.230   5.839
  168    H    TYR  26           H        TYR  26  -6.154   2.380   5.053
  169    HA   TYR  26           HA       TYR  26  -5.627   0.032   6.742
  170   1HB   TYR  26          1HB       TYR  26  -4.303   0.787   4.143
  171   2HB   TYR  26          2HB       TYR  26  -3.933  -0.622   5.120
  172    HD1  TYR  26           1HD      TYR  26  -6.917  -1.189   5.804
  173    HD2  TYR  26           2HD      TYR  26  -4.852  -0.452   2.179
  174    HE1  TYR  26           1HE      TYR  26  -8.604  -2.470   4.582
  175    HE2  TYR  26           2HE      TYR  26  -6.528  -1.722   0.948
  176    HH   TYR  26           HH       TYR  26  -9.070  -2.313   1.365
  177    H    GLU  27           H        GLU  27  -4.390   0.399   8.343
  178    HA   GLU  27           HA       GLU  27  -2.602   2.700   8.378
  179   1HB   GLU  27          1HB       GLU  27  -3.581   0.856  10.545
  180   2HB   GLU  27          2HB       GLU  27  -2.495   2.195  10.802
  181   1HG   GLU  27          1HG       GLU  27  -4.206   3.739   9.958
  182   2HG   GLU  27          2HG       GLU  27  -5.306   2.376   9.775
  183    H    SER  28           H        SER  28  -2.613  -0.623   7.945
  184    HA   SER  28           HA       SER  28   0.304  -0.762   8.185
  185   1HB   SER  28          1HB       SER  28  -0.148  -3.258   8.621
  186   2HB   SER  28          2HB       SER  28  -0.469  -2.152   9.952
  187    HG   SER  28           HG       SER  28  -2.290  -3.486   8.253
  188    H    CYS  29           H        CYS  29   0.867  -3.013   6.821
  189    HA   CYS  29           HA       CYS  29   0.143  -2.328   4.167
  190   1HB   CYS  29          1HB       CYS  29   1.488  -4.817   5.208
  191   2HB   CYS  29          2HB       CYS  29   1.322  -4.407   3.515
  192    H    THR  30           H        THR  30  -0.807  -3.968   2.661
  193    HA   THR  30           HA       THR  30  -2.883  -5.616   3.911
  194    HB   THR  30           HB       THR  30  -3.891  -3.365   3.479
  195    HG1  THR  30           1HG      THR  30  -5.384  -4.904   3.322
  196   1HG2  THR  30          1HG2      THR  30  -4.351  -2.874   1.023
  197   2HG2  THR  30          2HG2      THR  30  -2.748  -2.483   1.644
  198   3HG2  THR  30          3HG2      THR  30  -2.990  -3.940   0.679
  199    H    SER  31           H        SER  31  -4.101  -6.789   2.103
  200    HA   SER  31           HA       SER  31  -2.320  -7.406  -0.143
  201   1HB   SER  31          1HB       SER  31  -2.976  -9.811   0.093
  202   2HB   SER  31          2HB       SER  31  -2.025  -9.210   1.460
  203    HG   SER  31           HG       SER  31  -4.061  -8.896   2.566
  204    H    ALA  32           H        ALA  32  -4.672  -5.731   0.412
  205    HA   ALA  32           HA       ALA  32  -7.048  -6.752  -0.660
  206   1HB   ALA  32          1HB       ALA  32  -6.166  -4.362   0.481
  207   2HB   ALA  32          2HB       ALA  32  -6.698  -3.911  -1.140
  208   3HB   ALA  32          3HB       ALA  32  -7.810  -4.728  -0.041
  209    H    GLY  33           H        GLY  33  -7.949  -6.760  -2.647
  210   1HA   GLY  33          1HA       GLY  33  -8.123  -6.576  -4.935
  211   2HA   GLY  33          2HA       GLY  33  -6.814  -5.406  -4.889
  212    H    ARG  34           H        ARG  34  -5.629  -8.006  -3.304
  213    HA   ARG  34           HA       ARG  34  -4.330  -8.976  -5.741
  214   1HB   ARG  34          1HB       ARG  34  -3.487  -9.385  -2.870
  215   2HB   ARG  34          2HB       ARG  34  -2.571  -9.779  -4.307
  216   1HG   ARG  34          1HG       ARG  34  -3.070  -7.137  -4.693
  217   2HG   ARG  34          2HG       ARG  34  -2.880  -7.228  -2.939
  218   1HD   ARG  34          1HD       ARG  34  -0.762  -6.803  -4.213
  219   2HD   ARG  34          2HD       ARG  34  -0.715  -8.218  -3.146
  220    HE   ARG  34           HE       ARG  34  -0.522  -9.568  -4.998
  221   1HH1  ARG  34          1HH1      ARG  34  -1.411  -6.337  -6.009
  222   2HH1  ARG  34          2HH1      ARG  34  -1.339  -6.699  -7.709
  223   1HH2  ARG  34          1HH2      ARG  34  -0.478 -10.072  -7.226
  224   2HH2  ARG  34          2HH2      ARG  34  -0.819  -8.831  -8.397
  225    H    SER  35           H        SER  35  -4.729 -10.911  -6.505
  226    HA   SER  35           HA       SER  35  -6.437 -12.710  -4.962
  227   1HB   SER  35          1HB       SER  35  -5.614 -12.871  -7.874
  228   2HB   SER  35          2HB       SER  35  -6.845 -13.853  -7.076
  229    HG   SER  35           HG       SER  35  -7.881 -12.177  -8.122
  230    H    ASP  36           H        ASP  36  -3.254 -12.261  -5.099
  231    HA   ASP  36           HA       ASP  36  -2.586 -15.106  -5.238
  232   1HB   ASP  36          1HB       ASP  36  -0.172 -14.035  -5.025
  233   2HB   ASP  36          2HB       ASP  36  -0.989 -14.168  -6.568
  234    H    GLY  37           H        GLY  37  -0.902 -12.652  -3.456
  235   1HA   GLY  37          1HA       GLY  37  -1.884 -13.210  -0.915
  236   2HA   GLY  37          2HA       GLY  37  -0.515 -14.271  -1.195
  237    H    LYS  38           H        LYS  38   0.681 -12.156  -2.957
  238    HA   LYS  38           HA       LYS  38   2.533 -11.042  -1.272
  239   1HB   LYS  38          1HB       LYS  38   1.444  -9.849  -3.838
  240   2HB   LYS  38          2HB       LYS  38   2.976  -9.440  -3.090
  241   1HG   LYS  38          1HG       LYS  38   3.934 -11.467  -3.631
  242   2HG   LYS  38          2HG       LYS  38   2.380 -12.247  -3.909
  243   1HD   LYS  38          1HD       LYS  38   2.059 -10.886  -5.908
  244   2HD   LYS  38          2HD       LYS  38   3.586 -10.056  -5.600
  245   1HE   LYS  38          1HE       LYS  38   4.718 -12.292  -5.758
  246   2HE   LYS  38          2HE       LYS  38   3.174 -12.954  -6.299
  247   1HZ   LYS  38          1HZ       LYS  38   3.638 -10.735  -7.879
  248   2HZ   LYS  38          2HZ       LYS  38   5.129 -11.537  -7.790
  249   3HZ   LYS  38          3HZ       LYS  38   3.752 -12.365  -8.342
  250    H    MET  39           H        MET  39   2.363  -9.553   0.351
  251    HA   MET  39           HA       MET  39   0.010  -7.866   0.397
  252   1HB   MET  39          1HB       MET  39   2.255  -8.088   2.426
  253   2HB   MET  39          2HB       MET  39   0.770  -7.180   2.623
  254   1HG   MET  39          1HG       MET  39   0.373  -9.110   3.830
  255   2HG   MET  39          2HG       MET  39  -0.444  -9.402   2.297
  256   1HE   MET  39          1HE       MET  39   0.094 -11.517   4.378
  257   2HE   MET  39          2HE       MET  39  -0.449 -12.192   2.842
  258   3HE   MET  39          3HE       MET  39   0.971 -12.863   3.647
  259    H    TRP  40           H        TRP  40   0.016  -5.677   0.261
  260    HA   TRP  40           HA       TRP  40   2.551  -4.389  -0.496
  261   1HB   TRP  40          1HB       TRP  40   1.266  -3.091  -2.190
  262   2HB   TRP  40          2HB       TRP  40   1.308  -4.816  -2.547
  263    HD1  TRP  40           HD1      TRP  40  -1.057  -6.163  -1.633
  264    HE1  TRP  40           1HE      TRP  40  -3.492  -5.349  -1.810
  265    HE3  TRP  40           3HE      TRP  40  -0.183  -1.201  -2.316
  266    HZ2  TRP  40           2HZ      TRP  40  -4.851  -2.915  -2.151
  267    HZ3  TRP  40           3HZ      TRP  40  -2.103   0.314  -2.531
  268    HH2  TRP  40           HH2      TRP  40  -4.388  -0.528  -2.459
  269    H    CYS  41           H        CYS  41   1.486  -1.885  -0.971
  270    HA   CYS  41           HA       CYS  41  -0.110  -0.924   1.206
  271   1HB   CYS  41          1HB       CYS  41   1.664   0.505   2.197
  272   2HB   CYS  41          2HB       CYS  41   2.033  -1.207   2.394
  273    H    ALA  42           H        ALA  42  -0.663   1.338   0.827
  274    HA   ALA  42           HA       ALA  42  -0.284   2.063  -1.950
  275   1HB   ALA  42          1HB       ALA  42  -1.848   3.367   0.269
  276   2HB   ALA  42          2HB       ALA  42  -1.732   4.027  -1.361
  277   3HB   ALA  42          3HB       ALA  42  -2.479   2.451  -1.099
  278    H    THR  43           H        THR  43   0.783   3.868  -2.683
  279    HA   THR  43           HA       THR  43   2.746   4.926  -0.789
  280    HB   THR  43           HB       THR  43   4.041   5.534  -2.791
  281    HG1  THR  43           1HG      THR  43   2.838   5.828  -4.511
  282   1HG2  THR  43          1HG2      THR  43   3.051   2.708  -3.043
  283   2HG2  THR  43          2HG2      THR  43   4.632   3.343  -3.496
  284   3HG2  THR  43          3HG2      THR  43   4.180   3.241  -1.795
  285    H    THR  44           H        THR  44  -0.147   5.644  -1.424
  286    HA   THR  44           HA       THR  44   0.233   8.539  -1.333
  287    HB   THR  44           HB       THR  44  -1.844   8.783  -2.742
  288    HG1  THR  44           1HG      THR  44  -2.865   6.975  -3.046
  289   1HG2  THR  44          1HG2      THR  44  -0.506   7.647  -4.854
  290   2HG2  THR  44          2HG2      THR  44  -0.306   9.296  -4.257
  291   3HG2  THR  44          3HG2      THR  44   0.779   8.017  -3.707
  292    H    ALA  45           H        ALA  45  -1.411   9.620  -0.120
  293    HA   ALA  45           HA       ALA  45  -2.313   8.277   2.165
  294   1HB   ALA  45          1HB       ALA  45  -3.269  10.874   0.962
  295   2HB   ALA  45          2HB       ALA  45  -3.696  10.298   2.573
  296   3HB   ALA  45          3HB       ALA  45  -2.015  10.660   2.185
  297    H    ASN  46           H        ASN  46  -4.043   9.020  -0.836
  298    HA   ASN  46           HA       ASN  46  -6.136   7.167   0.089
  299   1HB   ASN  46          1HB       ASN  46  -6.935   9.547  -0.008
  300   2HB   ASN  46          2HB       ASN  46  -6.612   9.527  -1.742
  301   1HD2  ASN  46          1HD2      ASN  46  -9.946   7.922  -0.204
  302   2HD2  ASN  46          2HD2      ASN  46  -8.734   8.665   0.769
  303    H    TYR  47           H        TYR  47  -5.842   5.373  -0.995
  304    HA   TYR  47           HA       TYR  47  -4.525   5.289  -3.527
  305   1HB   TYR  47          1HB       TYR  47  -4.330   3.527  -1.770
  306   2HB   TYR  47          2HB       TYR  47  -5.991   3.061  -2.114
  307    HD1  TYR  47           1HD      TYR  47  -6.524   2.267  -4.501
  308    HD2  TYR  47           2HD      TYR  47  -2.578   2.656  -2.996
  309    HE1  TYR  47           1HE      TYR  47  -5.705   0.746  -6.252
  310    HE2  TYR  47           2HE      TYR  47  -1.756   1.141  -4.731
  311    HH   TYR  47           HH       TYR  47  -3.803  -0.781  -6.615
  312    H    ASP  48           H        ASP  48  -7.872   5.084  -2.478
  313    HA   ASP  48           HA       ASP  48  -9.090   4.021  -4.689
  314   1HB   ASP  48          1HB       ASP  48  -9.965   6.086  -2.707
  315   2HB   ASP  48          2HB       ASP  48 -11.011   5.658  -4.055
  316    H    ASP  49           H        ASP  49  -7.874   7.296  -4.308
  317    HA   ASP  49           HA       ASP  49  -8.979   8.060  -6.889
  318   1HB   ASP  49          1HB       ASP  49  -7.637   9.595  -4.683
  319   2HB   ASP  49          2HB       ASP  49  -7.986  10.319  -6.244
  320    H    ASP  50           H        ASP  50  -5.767   8.133  -5.311
  321    HA   ASP  50           HA       ASP  50  -4.476   8.787  -7.796
  322   1HB   ASP  50          1HB       ASP  50  -3.347   8.126  -5.079
  323   2HB   ASP  50          2HB       ASP  50  -2.373   8.608  -6.462
  324    H    ARG  51           H        ARG  51  -5.083   5.841  -6.081
  325    HA   ARG  51           HA       ARG  51  -4.434   3.710  -6.330
  326   1HB   ARG  51          1HB       ARG  51  -4.713   4.491  -9.207
  327   2HB   ARG  51          2HB       ARG  51  -4.819   2.856  -8.562
  328   1HG   ARG  51          1HG       ARG  51  -6.563   4.208  -6.982
  329   2HG   ARG  51          2HG       ARG  51  -6.789   5.003  -8.545
  330   1HD   ARG  51          1HD       ARG  51  -6.891   2.040  -8.064
  331   2HD   ARG  51          2HD       ARG  51  -8.299   3.096  -8.183
  332    HE   ARG  51           HE       ARG  51  -6.664   3.387 -10.479
  333   1HH1  ARG  51          1HH1      ARG  51  -8.921   1.165  -8.987
  334   2HH1  ARG  51          2HH1      ARG  51  -9.372   0.415 -10.488
  335   1HH2  ARG  51          1HH2      ARG  51  -7.345   2.486 -12.461
  336   2HH2  ARG  51          2HH2      ARG  51  -8.521   1.209 -12.473
  337    H    LYS  52           H        LYS  52  -2.146   4.885  -5.695
  338    HA   LYS  52           HA       LYS  52  -0.244   3.601  -7.514
  339   1HB   LYS  52          1HB       LYS  52   0.041   6.121  -5.911
  340   2HB   LYS  52          2HB       LYS  52   1.469   5.159  -6.281
  341   1HG   LYS  52          1HG       LYS  52   0.850   5.281  -8.688
  342   2HG   LYS  52          2HG       LYS  52  -0.450   6.388  -8.248
  343   1HD   LYS  52          1HD       LYS  52   1.130   8.005  -7.441
  344   2HD   LYS  52          2HD       LYS  52   2.466   6.867  -7.638
  345   1HE   LYS  52          1HE       LYS  52   1.979   6.816 -10.083
  346   2HE   LYS  52          2HE       LYS  52   0.773   8.078  -9.826
  347   1HZ   LYS  52          1HZ       LYS  52   3.653   8.367  -9.134
  348   2HZ   LYS  52          2HZ       LYS  52   2.971   8.886 -10.602
  349   3HZ   LYS  52          3HZ       LYS  52   2.471   9.586  -9.134
  350    H    TRP  53           H        TRP  53   0.642   1.853  -6.744
  351    HA   TRP  53           HA       TRP  53   0.692   1.466  -3.833
  352   1HB   TRP  53          1HB       TRP  53  -0.025  -0.815  -4.186
  353   2HB   TRP  53          2HB       TRP  53  -1.156   0.274  -4.891
  354    HD1  TRP  53           HD1      TRP  53  -0.728   0.625  -7.736
  355    HE1  TRP  53           1HE      TRP  53  -0.210  -1.260  -9.420
  356    HE3  TRP  53           3HE      TRP  53   0.888  -2.788  -4.438
  357    HZ2  TRP  53           2HZ      TRP  53   0.778  -3.938  -9.294
  358    HZ3  TRP  53           3HZ      TRP  53   1.622  -5.027  -5.244
  359    HH2  TRP  53           HH2      TRP  53   1.567  -5.579  -7.631
  360    H    GLY  54           H        GLY  54   1.901  -0.489  -3.239
  361   1HA   GLY  54          1HA       GLY  54   4.152  -1.353  -4.768
  362   2HA   GLY  54          2HA       GLY  54   4.606  -0.185  -3.528
  363    H    PHE  55           H        PHE  55   4.977  -3.234  -3.848
  364    HA   PHE  55           HA       PHE  55   3.462  -4.548  -1.901
  365   1HB   PHE  55          1HB       PHE  55   6.184  -5.077  -3.060
  366   2HB   PHE  55          2HB       PHE  55   5.506  -6.097  -1.808
  367    HD1  PHE  55           1HD      PHE  55   2.598  -5.771  -2.926
  368    HD2  PHE  55           2HD      PHE  55   6.323  -6.883  -4.660
  369    HE1  PHE  55           1HE      PHE  55   1.410  -7.161  -4.572
  370    HE2  PHE  55           2HE      PHE  55   5.130  -8.265  -6.314
  371    HZ   PHE  55           HZ       PHE  55   2.681  -8.384  -6.278
  372    H    CYS  56           H        CYS  56   4.007  -5.230   0.197
  373    HA   CYS  56           HA       CYS  56   4.998  -3.165   1.854
  374   1HB   CYS  56          1HB       CYS  56   3.287  -5.007   2.395
  375   2HB   CYS  56          2HB       CYS  56   4.670  -6.057   2.665
  376    HA   PRO  57           HA       PRO  57   9.275  -4.369   1.319
  377   1HB   PRO  57          1HB       PRO  57  10.447  -2.273   2.410
  378   2HB   PRO  57          2HB       PRO  57   9.587  -2.123   0.869
  379   1HG   PRO  57          1HG       PRO  57   8.604  -1.568   3.624
  380   2HG   PRO  57          2HG       PRO  57   8.529  -0.494   2.216
  381   1HD   PRO  57          1HD       PRO  57   6.424  -1.993   2.983
  382   2HD   PRO  57          2HD       PRO  57   6.770  -1.694   1.265
  383    H    ASP  58           H        ASP  58   7.517  -4.415   3.921
  384    HA   ASP  58           HA       ASP  58   9.500  -5.817   5.502
  385   1HB   ASP  58          1HB       ASP  58   9.511  -3.337   6.144
  386   2HB   ASP  58          2HB       ASP  58   7.898  -3.606   6.789
  387    H    GLN  59           H        GLN  59   8.048  -7.527   4.756
  388    HA   GLN  59           HA       GLN  59   5.323  -7.547   5.710
  389   1HB   GLN  59          1HB       GLN  59   6.919  -9.800   4.478
  390   2HB   GLN  59          2HB       GLN  59   5.173  -9.737   4.666
  391   1HG   GLN  59          1HG       GLN  59   5.223  -7.693   3.186
  392   2HG   GLN  59          2HG       GLN  59   6.905  -8.097   2.845
  393   1HE2  GLN  59          1HE2      GLN  59   6.057 -10.324   0.356
  394   2HE2  GLN  59          2HE2      GLN  59   7.206  -9.254   1.076
  395    H    GLY  60           H        GLY  60   4.487  -8.683   7.388
  396   1HA   GLY  60          1HA       GLY  60   5.842 -10.710   8.826
  397   2HA   GLY  60          2HA       GLY  60   6.046  -9.167   9.643
  Start of MODEL   47
    1    H    SER   1           1H       SER   1   7.939   3.925   8.006
    2    HA   SER   1           HA       SER   1  10.163   3.074   9.112
    3   1HB   SER   1          1HB       SER   1  11.163   1.533   7.348
    4   2HB   SER   1          2HB       SER   1   9.954   0.800   8.405
    5    HG   SER   1           HG       SER   1   9.848   0.529   5.949
    6    H    TRP   2           H        TRP   2  12.124   3.623   7.685
    7    HA   TRP   2           HA       TRP   2  11.417   6.005   6.175
    8   1HB   TRP   2          1HB       TRP   2  13.859   6.477   6.259
    9   2HB   TRP   2          2HB       TRP   2  13.130   6.269   7.846
   10    HD1  TRP   2           HD1      TRP   2  15.146   4.108   5.311
   11    HE1  TRP   2           1HE      TRP   2  16.619   2.486   6.661
   12    HE3  TRP   2           3HE      TRP   2  13.631   5.374  10.027
   13    HZ2  TRP   2           2HZ      TRP   2  17.091   1.845   9.371
   14    HZ3  TRP   2           3HZ      TRP   2  14.642   4.213  11.945
   15    HH2  TRP   2           HH2      TRP   2  16.338   2.483  11.621
   16    H    MET   3           H        MET   3  12.268   2.781   5.516
   17    HA   MET   3           HA       MET   3  13.669   3.174   3.087
   18   1HB   MET   3          1HB       MET   3  13.332   0.811   2.708
   19   2HB   MET   3          2HB       MET   3  13.816   1.091   4.370
   20   1HG   MET   3          1HG       MET   3  11.458   0.855   5.059
   21   2HG   MET   3          2HG       MET   3  11.035   0.510   3.383
   22   1HE   MET   3          1HE       MET   3  12.293  -1.110   2.024
   23   2HE   MET   3          2HE       MET   3  13.806  -1.729   2.687
   24   3HE   MET   3          3HE       MET   3  12.403  -2.791   2.544
   25    H    SER   4           H        SER   4  12.853   2.251   0.982
   26    HA   SER   4           HA       SER   4  10.289   3.516   0.381
   27   1HB   SER   4          1HB       SER   4  12.349   2.431  -1.549
   28   2HB   SER   4          2HB       SER   4  11.006   3.513  -1.920
   29    HG   SER   4           HG       SER   4  12.389   5.044  -1.544
   30    H    THR   5           H        THR   5   9.329   2.277  -1.753
   31    HA   THR   5           HA       THR   5   8.403  -0.233  -0.675
   32    HB   THR   5           HB       THR   5   6.923  -0.144  -2.747
   33    HG1  THR   5           1HG      THR   5   8.357   1.375  -3.832
   34   1HG2  THR   5          1HG2      THR   5   6.123   2.328  -1.657
   35   2HG2  THR   5          2HG2      THR   5   5.447   0.721  -1.373
   36   3HG2  THR   5          3HG2      THR   5   6.743   1.324  -0.345
   37    H    VAL   6           H        VAL   6   7.833  -1.868  -2.421
   38    HA   VAL   6           HA       VAL   6   9.910  -2.430  -4.348
   39    HB   VAL   6           HB       VAL   6  10.824  -3.821  -2.780
   40   1HG1  VAL   6          1HG1      VAL   6   8.221  -3.559  -1.412
   41   2HG1  VAL   6          2HG1      VAL   6   9.197  -4.973  -1.019
   42   3HG1  VAL   6          3HG1      VAL   6   9.851  -3.352  -0.775
   43   1HG2  VAL   6          1HG2      VAL   6   9.568  -5.257  -4.509
   44   2HG2  VAL   6          2HG2      VAL   6  10.242  -6.028  -3.071
   45   3HG2  VAL   6          3HG2      VAL   6   8.519  -5.660  -3.152
   46    H    GLY   7           H        GLY   7   8.908  -4.170  -5.878
   47   1HA   GLY   7          1HA       GLY   7   6.999  -4.984  -6.998
   48   2HA   GLY   7          2HA       GLY   7   6.153  -4.803  -5.487
   49    H    GLY   8           H        GLY   8   4.305  -4.001  -6.492
   50   1HA   GLY   8          1HA       GLY   8   2.904  -2.385  -7.315
   51   2HA   GLY   8          2HA       GLY   8   3.943  -1.292  -6.431
   52    H    ASN   9           H        ASN   9   3.587   0.339  -7.917
   53    HA   ASN   9           HA       ASN   9   5.018   0.005 -10.471
   54   1HB   ASN   9          1HB       ASN   9   3.395   1.284 -11.615
   55   2HB   ASN   9          2HB       ASN   9   2.455   0.194 -10.624
   56   1HD2  ASN   9          1HD2      ASN   9   0.911   2.654  -8.802
   57   2HD2  ASN   9          2HD2      ASN   9   1.253   0.979  -9.033
   58    H    SER  10           H        SER  10   4.254   1.949  -7.685
   59    HA   SER  10           HA       SER  10   5.385   4.382  -8.391
   60   1HB   SER  10          1HB       SER  10   5.598   3.188  -5.629
   61   2HB   SER  10          2HB       SER  10   5.433   4.884  -6.075
   62    HG   SER  10           HG       SER  10   3.408   4.292  -5.503
   63    H    GLY  11           H        GLY  11   6.938   1.501  -7.028
   64   1HA   GLY  11          1HA       GLY  11   9.129   0.813  -7.481
   65   2HA   GLY  11          2HA       GLY  11   9.481   2.411  -8.115
   66    H    GLY  12           H        GLY  12  10.121   4.061  -6.700
   67   1HA   GLY  12          1HA       GLY  12  10.970   3.051  -4.059
   68   2HA   GLY  12          2HA       GLY  12  11.869   4.231  -4.998
   69    H    ALA  13           H        ALA  13   8.425   4.025  -4.077
   70    HA   ALA  13           HA       ALA  13   8.719   6.731  -2.947
   71   1HB   ALA  13          1HB       ALA  13   6.933   5.802  -4.877
   72   2HB   ALA  13          2HB       ALA  13   5.979   5.943  -3.400
   73   3HB   ALA  13          3HB       ALA  13   6.862   7.341  -4.017
   74    HA   PRO  14           HA       PRO  14   7.601   4.960   0.949
   75   1HB   PRO  14          1HB       PRO  14   6.707   7.120   2.286
   76   2HB   PRO  14          2HB       PRO  14   8.409   6.923   1.847
   77   1HG   PRO  14          1HG       PRO  14   6.302   8.612   0.579
   78   2HG   PRO  14          2HG       PRO  14   8.021   8.959   0.825
   79   1HD   PRO  14          1HD       PRO  14   6.892   8.098  -1.557
   80   2HD   PRO  14          2HD       PRO  14   8.609   7.959  -1.138
   81    H    CYS  15           H        CYS  15   5.867   4.112   2.081
   82    HA   CYS  15           HA       CYS  15   3.306   4.207   0.756
   83   1HB   CYS  15          1HB       CYS  15   3.717   2.968   3.470
   84   2HB   CYS  15          2HB       CYS  15   2.653   2.452   2.169
   85    H    VAL  16           H        VAL  16   1.904   5.848   1.138
   86    HA   VAL  16           HA       VAL  16   2.201   7.513   3.466
   87    HB   VAL  16           HB       VAL  16   0.064   7.599   1.326
   88   1HG1  VAL  16          1HG1      VAL  16   0.891   9.664   3.375
   89   2HG1  VAL  16          2HG1      VAL  16  -0.288   9.905   2.086
   90   3HG1  VAL  16          3HG1      VAL  16  -0.614   8.744   3.371
   91   1HG2  VAL  16          1HG2      VAL  16   2.839   8.318   1.250
   92   2HG2  VAL  16          2HG2      VAL  16   1.624   8.430  -0.023
   93   3HG2  VAL  16          3HG2      VAL  16   1.848   9.769   1.102
   94    H    PHE  17           H        PHE  17   1.505   6.788   5.360
   95    HA   PHE  17           HA       PHE  17  -1.024   5.310   5.453
   96   1HB   PHE  17          1HB       PHE  17   1.355   5.328   7.309
   97   2HB   PHE  17          2HB       PHE  17  -0.182   4.599   7.730
   98    HD1  PHE  17           1HD      PHE  17  -0.262   3.893   4.482
   99    HD2  PHE  17           2HD      PHE  17   2.122   2.985   7.874
  100    HE1  PHE  17           1HE      PHE  17   0.449   1.797   3.423
  101    HE2  PHE  17           2HE      PHE  17   2.843   0.891   6.834
  102    HZ   PHE  17           HZ       PHE  17   2.011   0.265   4.587
  103    HA   PRO  18           HA       PRO  18  -2.471   4.765   6.640
  104   1HB   PRO  18          1HB       PRO  18  -5.074   5.321   7.091
  105   2HB   PRO  18          2HB       PRO  18  -3.940   4.934   8.388
  106   1HG   PRO  18          1HG       PRO  18  -5.130   7.533   7.629
  107   2HG   PRO  18          2HG       PRO  18  -4.530   6.986   9.201
  108   1HD   PRO  18          1HD       PRO  18  -3.197   8.661   7.341
  109   2HD   PRO  18          2HD       PRO  18  -2.528   7.976   8.835
  110    H    PHE  19           H        PHE  19  -3.161   4.021   4.710
  111    HA   PHE  19           HA       PHE  19  -4.212   6.035   2.831
  112   1HB   PHE  19          1HB       PHE  19  -3.375   4.766   1.001
  113   2HB   PHE  19          2HB       PHE  19  -2.063   4.893   2.161
  114    HD1  PHE  19           1HD      PHE  19  -4.472   2.637   0.564
  115    HD2  PHE  19           2HD      PHE  19  -1.231   2.942   3.299
  116    HE1  PHE  19           1HE      PHE  19  -4.164   0.200   0.472
  117    HE2  PHE  19           2HE      PHE  19  -0.921   0.505   3.213
  118    HZ   PHE  19           HZ       PHE  19  -2.393  -0.873   1.793
  119    H    THR  20           H        THR  20  -6.208   5.762   2.016
  120    HA   THR  20           HA       THR  20  -7.726   3.558   3.163
  121    HB   THR  20           HB       THR  20  -8.626   6.044   1.686
  122    HG1  THR  20           1HG      THR  20  -7.783   6.634   3.641
  123   1HG2  THR  20          1HG2      THR  20 -10.776   5.490   3.027
  124   2HG2  THR  20          2HG2      THR  20 -10.475   4.700   1.477
  125   3HG2  THR  20          3HG2      THR  20 -10.151   3.841   2.983
  126    H    PHE  21           H        PHE  21  -8.431   1.903   2.137
  127    HA   PHE  21           HA       PHE  21  -8.633   1.954  -0.793
  128   1HB   PHE  21          1HB       PHE  21  -6.577   0.669   0.215
  129   2HB   PHE  21          2HB       PHE  21  -7.779  -0.513   0.688
  130    HD1  PHE  21           1HD      PHE  21  -8.597   1.166  -2.397
  131    HD2  PHE  21           2HD      PHE  21  -6.404  -2.045  -0.676
  132    HE1  PHE  21           1HE      PHE  21  -8.446   0.078  -4.589
  133    HE2  PHE  21           2HE      PHE  21  -6.258  -3.141  -2.848
  134    HZ   PHE  21           HZ       PHE  21  -7.260  -2.068  -4.836
  135    H    LEU  22           H        LEU  22 -10.392   0.811  -1.560
  136    HA   LEU  22           HA       LEU  22 -12.587   0.319  -1.552
  137   1HB   LEU  22          1HB       LEU  22 -11.207  -1.753   0.039
  138   2HB   LEU  22          2HB       LEU  22 -12.779  -2.011  -0.701
  139    HG   LEU  22           HG       LEU  22 -11.619  -2.774  -2.465
  140   1HD1  LEU  22          1HD1      LEU  22 -11.770  -0.123  -2.902
  141   2HD1  LEU  22          2HD1      LEU  22 -10.085  -0.513  -3.241
  142   3HD1  LEU  22          3HD1      LEU  22 -11.380  -1.363  -4.090
  143   1HD2  LEU  22          1HD2      LEU  22  -9.550  -2.304  -0.652
  144   2HD2  LEU  22          2HD2      LEU  22  -9.711  -3.556  -1.885
  145   3HD2  LEU  22          3HD2      LEU  22  -9.001  -1.997  -2.301
  146    H    GLY  23           H        GLY  23 -12.189   2.238   0.455
  147   1HA   GLY  23          1HA       GLY  23 -13.694   3.192   1.946
  148   2HA   GLY  23          2HA       GLY  23 -14.484   1.639   2.114
  149    H    ASN  24           H        ASN  24 -11.329   0.876   2.665
  150    HA   ASN  24           HA       ASN  24 -11.716   1.351   5.545
  151   1HB   ASN  24          1HB       ASN  24 -10.007  -0.742   4.197
  152   2HB   ASN  24          2HB       ASN  24 -10.415  -0.643   5.902
  153   1HD2  ASN  24          1HD2      ASN  24 -12.676  -2.746   3.475
  154   2HD2  ASN  24          2HD2      ASN  24 -11.061  -2.226   3.156
  155    H    LYS  25           H        LYS  25 -10.140   2.377   6.721
  156    HA   LYS  25           HA       LYS  25  -8.024   3.663   5.280
  157   1HB   LYS  25          1HB       LYS  25  -8.763   3.667   8.215
  158   2HB   LYS  25          2HB       LYS  25  -7.672   4.772   7.418
  159   1HG   LYS  25          1HG       LYS  25  -9.415   5.756   6.144
  160   2HG   LYS  25          2HG       LYS  25 -10.548   4.497   6.645
  161   1HD   LYS  25          1HD       LYS  25 -10.382   5.297   8.966
  162   2HD   LYS  25          2HD       LYS  25  -9.284   6.577   8.430
  163   1HE   LYS  25          1HE       LYS  25 -11.594   7.389   8.686
  164   2HE   LYS  25          2HE       LYS  25 -11.023   7.518   7.024
  165   1HZ   LYS  25          1HZ       LYS  25 -12.602   5.187   7.932
  166   2HZ   LYS  25          2HZ       LYS  25 -13.352   6.620   7.410
  167   3HZ   LYS  25          3HZ       LYS  25 -12.359   5.751   6.345
  168    H    TYR  26           H        TYR  26  -6.074   2.732   5.001
  169    HA   TYR  26           HA       TYR  26  -5.386   0.481   6.734
  170   1HB   TYR  26          1HB       TYR  26  -4.328   1.283   4.022
  171   2HB   TYR  26          2HB       TYR  26  -3.783  -0.114   4.940
  172    HD1  TYR  26           1HD      TYR  26  -6.958  -0.280   5.870
  173    HD2  TYR  26           2HD      TYR  26  -4.756  -0.487   2.250
  174    HE1  TYR  26           1HE      TYR  26  -8.732  -1.631   4.868
  175    HE2  TYR  26           2HE      TYR  26  -6.523  -1.844   1.239
  176    HH   TYR  26           HH       TYR  26  -8.515  -3.533   2.561
  177    H    GLU  27           H        GLU  27  -4.201   0.979   8.344
  178    HA   GLU  27           HA       GLU  27  -2.313   3.169   8.251
  179   1HB   GLU  27          1HB       GLU  27  -3.230   1.396  10.494
  180   2HB   GLU  27          2HB       GLU  27  -2.137   2.746  10.671
  181   1HG   GLU  27          1HG       GLU  27  -3.889   4.254   9.842
  182   2HG   GLU  27          2HG       GLU  27  -4.984   2.877   9.739
  183    H    SER  28           H        SER  28  -2.279  -0.027   7.547
  184    HA   SER  28           HA       SER  28   0.607  -0.195   7.803
  185   1HB   SER  28          1HB       SER  28   0.232  -2.633   8.455
  186   2HB   SER  28          2HB       SER  28  -0.094  -1.439   9.704
  187    HG   SER  28           HG       SER  28  -1.888  -3.011   8.211
  188    H    CYS  29           H        CYS  29   0.997  -2.658   6.625
  189    HA   CYS  29           HA       CYS  29   0.258  -2.105   3.936
  190   1HB   CYS  29          1HB       CYS  29   1.492  -4.576   5.144
  191   2HB   CYS  29          2HB       CYS  29   1.285  -4.312   3.430
  192    H    THR  30           H        THR  30  -0.773  -3.778   2.572
  193    HA   THR  30           HA       THR  30  -2.874  -5.318   3.901
  194    HB   THR  30           HB       THR  30  -3.838  -3.032   3.458
  195    HG1  THR  30           1HG      THR  30  -5.364  -4.541   3.419
  196   1HG2  THR  30          1HG2      THR  30  -4.013  -3.512   0.570
  197   2HG2  THR  30          2HG2      THR  30  -3.803  -2.008   1.467
  198   3HG2  THR  30          3HG2      THR  30  -2.415  -3.050   1.153
  199    H    SER  31           H        SER  31  -4.200  -6.424   2.067
  200    HA   SER  31           HA       SER  31  -2.472  -7.113  -0.196
  201   1HB   SER  31          1HB       SER  31  -3.342  -9.509   0.086
  202   2HB   SER  31          2HB       SER  31  -2.134  -8.964   1.260
  203    HG   SER  31           HG       SER  31  -4.637  -9.848   1.696
  204    H    ALA  32           H        ALA  32  -4.793  -5.402   0.450
  205    HA   ALA  32           HA       ALA  32  -7.166  -6.412  -0.681
  206   1HB   ALA  32          1HB       ALA  32  -6.134  -3.728   0.106
  207   2HB   ALA  32          2HB       ALA  32  -7.528  -3.785  -0.972
  208   3HB   ALA  32          3HB       ALA  32  -7.607  -4.557   0.613
  209    H    GLY  33           H        GLY  33  -8.078  -6.217  -2.653
  210   1HA   GLY  33          1HA       GLY  33  -8.257  -5.859  -4.907
  211   2HA   GLY  33          2HA       GLY  33  -6.976  -4.668  -4.761
  212    H    ARG  34           H        ARG  34  -5.791  -7.509  -3.487
  213    HA   ARG  34           HA       ARG  34  -4.513  -8.088  -6.063
  214   1HB   ARG  34          1HB       ARG  34  -3.560  -8.917  -3.324
  215   2HB   ARG  34          2HB       ARG  34  -2.688  -9.016  -4.835
  216   1HG   ARG  34          1HG       ARG  34  -3.158  -6.396  -4.821
  217   2HG   ARG  34          2HG       ARG  34  -3.147  -6.701  -3.084
  218   1HD   ARG  34          1HD       ARG  34  -0.929  -6.097  -3.978
  219   2HD   ARG  34          2HD       ARG  34  -0.957  -7.690  -3.211
  220    HE   ARG  34           HE       ARG  34  -0.416  -8.616  -5.233
  221   1HH1  ARG  34          1HH1      ARG  34  -1.737  -5.424  -5.806
  222   2HH1  ARG  34          2HH1      ARG  34  -1.362  -5.433  -7.501
  223   1HH2  ARG  34          1HH2      ARG  34   0.107  -8.619  -7.458
  224   2HH2  ARG  34          2HH2      ARG  34  -0.307  -7.251  -8.448
  225    H    SER  35           H        SER  35  -5.048  -9.838  -7.106
  226    HA   SER  35           HA       SER  35  -6.641 -11.895  -5.824
  227   1HB   SER  35          1HB       SER  35  -5.665 -11.688  -8.687
  228   2HB   SER  35          2HB       SER  35  -6.917 -12.780  -8.084
  229    HG   SER  35           HG       SER  35  -7.706 -10.806  -9.103
  230    H    ASP  36           H        ASP  36  -3.426 -11.255  -6.111
  231    HA   ASP  36           HA       ASP  36  -2.544 -13.991  -6.471
  232   1HB   ASP  36          1HB       ASP  36  -0.256 -12.887  -6.123
  233   2HB   ASP  36          2HB       ASP  36  -1.130 -12.496  -7.590
  234    H    GLY  37           H        GLY  37  -1.212 -11.681  -4.213
  235   1HA   GLY  37          1HA       GLY  37  -2.234 -12.484  -1.833
  236   2HA   GLY  37          2HA       GLY  37  -1.029 -13.705  -2.181
  237    H    LYS  38           H        LYS  38   0.498 -11.257  -3.559
  238    HA   LYS  38           HA       LYS  38   2.254 -10.828  -1.382
  239   1HB   LYS  38          1HB       LYS  38   2.093  -8.860  -3.616
  240   2HB   LYS  38          2HB       LYS  38   3.511  -9.546  -2.847
  241   1HG   LYS  38          1HG       LYS  38   1.682 -10.998  -4.729
  242   2HG   LYS  38          2HG       LYS  38   3.204 -10.262  -5.170
  243   1HD   LYS  38          1HD       LYS  38   4.394 -11.772  -3.672
  244   2HD   LYS  38          2HD       LYS  38   2.859 -12.489  -3.164
  245   1HE   LYS  38          1HE       LYS  38   4.100 -12.570  -5.917
  246   2HE   LYS  38          2HE       LYS  38   3.891 -13.924  -4.802
  247   1HZ   LYS  38          1HZ       LYS  38   1.551 -12.394  -5.752
  248   2HZ   LYS  38          2HZ       LYS  38   2.215 -13.639  -6.704
  249   3HZ   LYS  38          3HZ       LYS  38   1.618 -13.980  -5.154
  250    H    MET  39           H        MET  39   2.250  -9.295   0.211
  251    HA   MET  39           HA       MET  39  -0.029  -7.524   0.287
  252   1HB   MET  39          1HB       MET  39   2.205  -7.831   2.309
  253   2HB   MET  39          2HB       MET  39   0.665  -7.021   2.543
  254   1HG   MET  39          1HG       MET  39  -0.530  -9.099   2.362
  255   2HG   MET  39          2HG       MET  39   0.967  -9.954   1.985
  256   1HE   MET  39          1HE       MET  39   3.037  -8.918   3.606
  257   2HE   MET  39          2HE       MET  39   2.962  -9.299   5.325
  258   3HE   MET  39          3HE       MET  39   2.870 -10.594   4.130
  259    H    TRP  40           H        TRP  40   0.068  -5.302   0.279
  260    HA   TRP  40           HA       TRP  40   2.650  -4.080  -0.429
  261   1HB   TRP  40          1HB       TRP  40   1.457  -2.756  -2.165
  262   2HB   TRP  40          2HB       TRP  40   1.482  -4.485  -2.521
  263    HD1  TRP  40           HD1      TRP  40  -0.961  -5.794  -1.697
  264    HE1  TRP  40           1HE      TRP  40  -3.365  -4.911  -1.916
  265    HE3  TRP  40           3HE      TRP  40   0.049  -0.830  -2.293
  266    HZ2  TRP  40           2HZ      TRP  40  -4.654  -2.444  -2.258
  267    HZ3  TRP  40           3HZ      TRP  40  -1.837   0.732  -2.531
  268    HH2  TRP  40           HH2      TRP  40  -4.137  -0.064  -2.522
  269    H    CYS  41           H        CYS  41   1.869  -1.558  -0.899
  270    HA   CYS  41           HA       CYS  41   0.172  -0.507   1.205
  271   1HB   CYS  41          1HB       CYS  41   1.969   0.983   2.091
  272   2HB   CYS  41          2HB       CYS  41   2.293  -0.717   2.416
  273    H    ALA  42           H        ALA  42  -0.675   1.497   0.559
  274    HA   ALA  42           HA       ALA  42  -0.130   2.221  -2.174
  275   1HB   ALA  42          1HB       ALA  42  -2.402   2.373  -1.001
  276   2HB   ALA  42          2HB       ALA  42  -1.790   3.877  -0.305
  277   3HB   ALA  42          3HB       ALA  42  -1.924   3.704  -2.054
  278    H    THR  43           H        THR  43   0.758   4.120  -2.915
  279    HA   THR  43           HA       THR  43   2.540   5.395  -0.978
  280    HB   THR  43           HB       THR  43   3.871   6.044  -2.938
  281    HG1  THR  43           1HG      THR  43   2.766   6.208  -4.730
  282   1HG2  THR  43          1HG2      THR  43   4.162   3.628  -3.885
  283   2HG2  THR  43          2HG2      THR  43   4.601   3.989  -2.216
  284   3HG2  THR  43          3HG2      THR  43   3.067   3.195  -2.572
  285    H    THR  44           H        THR  44  -0.364   5.883  -1.604
  286    HA   THR  44           HA       THR  44  -0.177   8.796  -1.712
  287    HB   THR  44           HB       THR  44  -2.498   8.535  -2.974
  288    HG1  THR  44           1HG      THR  44  -1.090   6.175  -3.659
  289   1HG2  THR  44          1HG2      THR  44   0.027   8.125  -4.550
  290   2HG2  THR  44          2HG2      THR  44  -1.467   8.907  -5.075
  291   3HG2  THR  44          3HG2      THR  44  -0.451   9.672  -3.853
  292    H    ALA  45           H        ALA  45  -1.934   9.844  -0.557
  293    HA   ALA  45           HA       ALA  45  -2.658   8.544   1.824
  294   1HB   ALA  45          1HB       ALA  45  -3.714  11.044   0.530
  295   2HB   ALA  45          2HB       ALA  45  -4.265  10.475   2.107
  296   3HB   ALA  45          3HB       ALA  45  -2.573  10.904   1.867
  297    H    ASN  46           H        ASN  46  -4.434   9.026  -1.174
  298    HA   ASN  46           HA       ASN  46  -6.444   7.125  -0.185
  299   1HB   ASN  46          1HB       ASN  46  -7.391   9.411  -0.418
  300   2HB   ASN  46          2HB       ASN  46  -6.939   9.401  -2.119
  301   1HD2  ASN  46          1HD2      ASN  46 -10.373   7.833  -0.914
  302   2HD2  ASN  46          2HD2      ASN  46  -9.337   8.792   0.071
  303    H    TYR  47           H        TYR  47  -5.953   5.272  -1.128
  304    HA   TYR  47           HA       TYR  47  -4.558   5.128  -3.613
  305   1HB   TYR  47          1HB       TYR  47  -4.298   3.444  -1.792
  306   2HB   TYR  47          2HB       TYR  47  -5.932   2.878  -2.137
  307    HD1  TYR  47           1HD      TYR  47  -2.644   3.436  -3.807
  308    HD2  TYR  47           2HD      TYR  47  -6.249   1.187  -3.695
  309    HE1  TYR  47           1HE      TYR  47  -1.773   1.968  -5.570
  310    HE2  TYR  47           2HE      TYR  47  -5.385  -0.280  -5.464
  311    HH   TYR  47           HH       TYR  47  -3.421  -0.958  -6.500
  312    H    ASP  48           H        ASP  48  -7.909   4.893  -2.683
  313    HA   ASP  48           HA       ASP  48  -8.989   3.567  -4.848
  314   1HB   ASP  48          1HB       ASP  48 -10.113   5.777  -3.143
  315   2HB   ASP  48          2HB       ASP  48 -11.065   4.932  -4.354
  316    H    ASP  49           H        ASP  49  -8.071   6.940  -4.567
  317    HA   ASP  49           HA       ASP  49  -9.172   7.616  -7.146
  318   1HB   ASP  49          1HB       ASP  49  -7.757   9.131  -4.992
  319   2HB   ASP  49          2HB       ASP  49  -7.883   9.832  -6.599
  320    H    ASP  50           H        ASP  50  -5.882   8.237  -5.917
  321    HA   ASP  50           HA       ASP  50  -4.781   8.392  -8.524
  322   1HB   ASP  50          1HB       ASP  50  -3.723   8.572  -5.770
  323   2HB   ASP  50          2HB       ASP  50  -2.567   8.175  -7.032
  324    H    ARG  51           H        ARG  51  -5.265   5.671  -6.488
  325    HA   ARG  51           HA       ARG  51  -4.461   3.563  -6.459
  326   1HB   ARG  51          1HB       ARG  51  -4.833   3.979  -9.400
  327   2HB   ARG  51          2HB       ARG  51  -4.824   2.423  -8.569
  328   1HG   ARG  51          1HG       ARG  51  -6.637   3.715  -7.098
  329   2HG   ARG  51          2HG       ARG  51  -6.889   4.529  -8.646
  330   1HD   ARG  51          1HD       ARG  51  -6.834   1.549  -8.304
  331   2HD   ARG  51          2HD       ARG  51  -8.308   2.514  -8.210
  332    HE   ARG  51           HE       ARG  51  -6.967   3.111 -10.613
  333   1HH1  ARG  51          1HH1      ARG  51  -8.769   0.501  -9.118
  334   2HH1  ARG  51          2HH1      ARG  51  -9.333  -0.131 -10.634
  335   1HH2  ARG  51          1HH2      ARG  51  -7.684   2.268 -12.584
  336   2HH2  ARG  51          2HH2      ARG  51  -8.708   0.864 -12.608
  337    H    LYS  52           H        LYS  52  -2.305   4.896  -5.956
  338    HA   LYS  52           HA       LYS  52  -0.257   3.747  -7.711
  339   1HB   LYS  52          1HB       LYS  52  -0.107   6.188  -5.924
  340   2HB   LYS  52          2HB       LYS  52   1.284   5.480  -6.739
  341   1HG   LYS  52          1HG       LYS  52   0.443   6.024  -8.872
  342   2HG   LYS  52          2HG       LYS  52  -1.156   6.409  -8.233
  343   1HD   LYS  52          1HD       LYS  52  -0.196   8.344  -7.054
  344   2HD   LYS  52          2HD       LYS  52   1.395   7.943  -7.713
  345   1HE   LYS  52          1HE       LYS  52   0.203   9.745  -8.955
  346   2HE   LYS  52          2HE       LYS  52   0.643   8.352  -9.946
  347   1HZ   LYS  52          1HZ       LYS  52  -1.786   7.610  -9.283
  348   2HZ   LYS  52          2HZ       LYS  52  -2.021   9.283  -9.109
  349   3HZ   LYS  52          3HZ       LYS  52  -1.512   8.646 -10.601
  350    H    TRP  53           H        TRP  53   0.678   2.040  -6.894
  351    HA   TRP  53           HA       TRP  53   0.825   1.777  -3.972
  352   1HB   TRP  53          1HB       TRP  53   0.110  -0.509  -4.187
  353   2HB   TRP  53          2HB       TRP  53  -1.048   0.538  -4.931
  354    HD1  TRP  53           HD1      TRP  53  -0.654   0.731  -7.807
  355    HE1  TRP  53           1HE      TRP  53  -0.115  -1.243  -9.388
  356    HE3  TRP  53           3HE      TRP  53   1.036  -2.473  -4.344
  357    HZ2  TRP  53           2HZ      TRP  53   0.913  -3.887  -9.138
  358    HZ3  TRP  53           3HZ      TRP  53   1.803  -4.743  -5.042
  359    HH2  TRP  53           HH2      TRP  53   1.738  -5.419  -7.389
  360    H    GLY  54           H        GLY  54   2.068  -0.081  -3.275
  361   1HA   GLY  54          1HA       GLY  54   4.254  -1.082  -4.858
  362   2HA   GLY  54          2HA       GLY  54   4.752   0.072  -3.619
  363    H    PHE  55           H        PHE  55   5.063  -2.959  -3.909
  364    HA   PHE  55           HA       PHE  55   3.532  -4.316  -2.032
  365   1HB   PHE  55          1HB       PHE  55   6.317  -4.666  -3.088
  366   2HB   PHE  55          2HB       PHE  55   5.701  -5.729  -1.839
  367    HD1  PHE  55           1HD      PHE  55   2.803  -5.187  -3.374
  368    HD2  PHE  55           2HD      PHE  55   6.595  -6.879  -4.303
  369    HE1  PHE  55           1HE      PHE  55   1.745  -6.649  -5.057
  370    HE2  PHE  55           2HE      PHE  55   5.542  -8.340  -5.974
  371    HZ   PHE  55           HZ       PHE  55   3.115  -8.220  -6.355
  372    H    CYS  56           H        CYS  56   4.155  -5.081   0.105
  373    HA   CYS  56           HA       CYS  56   4.737  -3.002   1.894
  374   1HB   CYS  56          1HB       CYS  56   3.544  -5.284   2.279
  375   2HB   CYS  56          2HB       CYS  56   5.164  -5.904   2.569
  376    HA   PRO  57           HA       PRO  57   9.136  -2.803   1.676
  377   1HB   PRO  57          1HB       PRO  57   9.717  -1.656   4.028
  378   2HB   PRO  57          2HB       PRO  57   8.958  -0.766   2.698
  379   1HG   PRO  57          1HG       PRO  57   7.666  -2.146   5.002
  380   2HG   PRO  57          2HG       PRO  57   7.418  -0.473   4.465
  381   1HD   PRO  57          1HD       PRO  57   5.690  -2.375   3.778
  382   2HD   PRO  57          2HD       PRO  57   6.198  -1.166   2.577
  383    H    ASP  58           H        ASP  58   7.565  -4.821   3.513
  384    HA   ASP  58           HA       ASP  58   9.957  -6.316   4.248
  385   1HB   ASP  58          1HB       ASP  58   9.097  -5.180   6.294
  386   2HB   ASP  58          2HB       ASP  58   7.568  -6.024   6.071
  387    H    GLN  59           H        GLN  59   9.690  -7.815   2.661
  388    HA   GLN  59           HA       GLN  59   7.096  -9.169   2.474
  389   1HB   GLN  59          1HB       GLN  59   9.455  -9.199   0.585
  390   2HB   GLN  59          2HB       GLN  59   7.964 -10.090   0.337
  391   1HG   GLN  59          1HG       GLN  59   8.133  -7.093   0.561
  392   2HG   GLN  59          2HG       GLN  59   8.092  -7.984  -0.959
  393   1HE2  GLN  59          1HE2      GLN  59   4.657  -8.154  -1.033
  394   2HE2  GLN  59          2HE2      GLN  59   6.178  -8.272  -1.844
  395    H    GLY  60           H        GLY  60   7.618 -11.587   1.564
  396   1HA   GLY  60          1HA       GLY  60   9.722 -12.861   3.086
  397   2HA   GLY  60          2HA       GLY  60   8.091 -13.198   3.654
  Start of MODEL   48
    1    H    SER   1           1H       SER   1  15.706   2.268   8.132
    2    HA   SER   1           HA       SER   1  16.548   4.698   7.115
    3   1HB   SER   1          1HB       SER   1  16.883   3.108   5.106
    4   2HB   SER   1          2HB       SER   1  17.701   2.704   6.611
    5    HG   SER   1           HG       SER   1  15.833   1.300   5.242
    6    H    TRP   2           H        TRP   2  15.972   4.501   4.391
    7    HA   TRP   2           HA       TRP   2  13.431   5.835   4.304
    8   1HB   TRP   2          1HB       TRP   2  15.623   6.138   2.800
    9   2HB   TRP   2          2HB       TRP   2  14.789   4.958   1.790
   10    HD1  TRP   2           HD1      TRP   2  13.678   8.227   3.594
   11    HE1  TRP   2           1HE      TRP   2  12.287   9.615   1.929
   12    HE3  TRP   2           3HE      TRP   2  13.877   5.080  -0.427
   13    HZ2  TRP   2           2HZ      TRP   2  11.414   9.406  -0.750
   14    HZ3  TRP   2           3HZ      TRP   2  12.747   5.748  -2.507
   15    HH2  TRP   2           HH2      TRP   2  11.539   7.866  -2.663
   16    H    MET   3           H        MET   3  11.648   4.667   4.496
   17    HA   MET   3           HA       MET   3  11.431   1.918   3.898
   18   1HB   MET   3          1HB       MET   3   9.183   3.913   4.191
   19   2HB   MET   3          2HB       MET   3   9.083   2.175   4.425
   20   1HG   MET   3          1HG       MET   3  10.598   2.350   6.348
   21   2HG   MET   3          2HG       MET   3  10.671   4.094   6.119
   22   1HE   MET   3          1HE       MET   3   7.707   1.608   5.776
   23   2HE   MET   3          2HE       MET   3   8.433   1.053   7.283
   24   3HE   MET   3          3HE       MET   3   6.844   1.818   7.300
   25    H    SER   4           H        SER   4  12.170   1.759   1.718
   26    HA   SER   4           HA       SER   4  10.556   2.961  -0.379
   27   1HB   SER   4          1HB       SER   4  12.834   0.980  -0.661
   28   2HB   SER   4          2HB       SER   4  12.174   2.034  -1.911
   29    HG   SER   4           HG       SER   4  13.378   2.987   0.477
   30    H    THR   5           H        THR   5   9.733   1.557  -2.162
   31    HA   THR   5           HA       THR   5   8.518  -0.838  -1.008
   32    HB   THR   5           HB       THR   5   6.923  -0.457  -3.050
   33    HG1  THR   5           1HG      THR   5   7.335   2.228  -2.685
   34   1HG2  THR   5          1HG2      THR   5   6.023   1.632  -1.490
   35   2HG2  THR   5          2HG2      THR   5   5.588  -0.070  -1.333
   36   3HG2  THR   5          3HG2      THR   5   6.907   0.598  -0.367
   37    H    VAL   6           H        VAL   6   7.739  -2.354  -2.739
   38    HA   VAL   6           HA       VAL   6   9.642  -2.919  -4.861
   39    HB   VAL   6           HB       VAL   6  10.563  -4.455  -3.440
   40   1HG1  VAL   6          1HG1      VAL   6   8.207  -3.881  -1.807
   41   2HG1  VAL   6          2HG1      VAL   6   8.830  -5.524  -1.624
   42   3HG1  VAL   6          3HG1      VAL   6   9.883  -4.144  -1.324
   43   1HG2  VAL   6          1HG2      VAL   6   8.250  -5.689  -4.666
   44   2HG2  VAL   6          2HG2      VAL   6   9.911  -6.267  -4.546
   45   3HG2  VAL   6          3HG2      VAL   6   8.789  -6.523  -3.209
   46    H    GLY   7           H        GLY   7   8.454  -4.594  -6.367
   47   1HA   GLY   7          1HA       GLY   7   6.441  -5.234  -7.416
   48   2HA   GLY   7          2HA       GLY   7   5.681  -5.026  -5.865
   49    H    GLY   8           H        GLY   8   3.845  -4.085  -6.762
   50   1HA   GLY   8          1HA       GLY   8   2.509  -2.363  -7.471
   51   2HA   GLY   8          2HA       GLY   8   3.684  -1.350  -6.653
   52    H    ASN   9           H        ASN   9   3.446   0.327  -8.090
   53    HA   ASN   9           HA       ASN   9   4.897  -0.057 -10.585
   54   1HB   ASN   9          1HB       ASN   9   3.262   1.172 -11.921
   55   2HB   ASN   9          2HB       ASN   9   2.566  -0.287 -11.254
   56   1HD2  ASN   9          1HD2      ASN   9   1.169   2.541  -8.886
   57   2HD2  ASN   9          2HD2      ASN   9   2.730   1.808  -8.781
   58    H    SER  10           H        SER  10   4.467   1.628  -7.801
   59    HA   SER  10           HA       SER  10   5.215   4.242  -8.787
   60   1HB   SER  10          1HB       SER  10   5.110   3.292  -5.921
   61   2HB   SER  10          2HB       SER  10   4.987   4.943  -6.517
   62    HG   SER  10           HG       SER  10   2.941   3.982  -5.952
   63    H    GLY  11           H        GLY  11   6.886   1.553  -8.690
   64   1HA   GLY  11          1HA       GLY  11   9.148   1.148  -8.756
   65   2HA   GLY  11          2HA       GLY  11   9.415   2.861  -8.474
   66    H    GLY  12           H        GLY  12  10.114   3.500  -6.506
   67   1HA   GLY  12          1HA       GLY  12   9.888   1.548  -4.305
   68   2HA   GLY  12          2HA       GLY  12  11.405   2.373  -4.641
   69    H    ALA  13           H        ALA  13   8.193   3.835  -4.788
   70    HA   ALA  13           HA       ALA  13   9.033   5.967  -3.061
   71   1HB   ALA  13          1HB       ALA  13   6.307   5.343  -4.188
   72   2HB   ALA  13          2HB       ALA  13   6.752   6.831  -3.352
   73   3HB   ALA  13          3HB       ALA  13   7.507   6.427  -4.894
   74    HA   PRO  14           HA       PRO  14   7.892   4.230   0.816
   75   1HB   PRO  14          1HB       PRO  14   7.190   6.933   1.726
   76   2HB   PRO  14          2HB       PRO  14   8.480   5.868   2.276
   77   1HG   PRO  14          1HG       PRO  14   8.958   8.101   0.836
   78   2HG   PRO  14          2HG       PRO  14   9.984   6.654   0.742
   79   1HD   PRO  14          1HD       PRO  14   7.899   7.638  -1.162
   80   2HD   PRO  14          2HD       PRO  14   9.447   6.828  -1.490
   81    H    CYS  15           H        CYS  15   6.065   3.568   1.897
   82    HA   CYS  15           HA       CYS  15   3.537   4.027   0.634
   83   1HB   CYS  15          1HB       CYS  15   3.763   2.844   3.387
   84   2HB   CYS  15          2HB       CYS  15   2.676   2.405   2.078
   85    H    VAL  16           H        VAL  16   1.707   5.113   1.518
   86    HA   VAL  16           HA       VAL  16   2.370   7.092   3.602
   87    HB   VAL  16           HB       VAL  16   0.210   7.249   1.479
   88   1HG1  VAL  16          1HG1      VAL  16   0.290   8.515   3.942
   89   2HG1  VAL  16          2HG1      VAL  16   0.913   9.719   2.816
   90   3HG1  VAL  16          3HG1      VAL  16  -0.671   8.993   2.543
   91   1HG2  VAL  16          1HG2      VAL  16   2.931   7.724   1.218
   92   2HG2  VAL  16          2HG2      VAL  16   1.653   8.292   0.142
   93   3HG2  VAL  16          3HG2      VAL  16   2.225   9.325   1.452
   94    H    PHE  17           H        PHE  17   1.645   6.410   5.530
   95    HA   PHE  17           HA       PHE  17  -0.965   5.078   5.600
   96   1HB   PHE  17          1HB       PHE  17   1.394   4.816   7.469
   97   2HB   PHE  17          2HB       PHE  17  -0.185   4.121   7.769
   98    HD1  PHE  17           1HD      PHE  17  -1.060   2.861   5.423
   99    HD2  PHE  17           2HD      PHE  17   2.911   3.271   6.880
  100    HE1  PHE  17           1HE      PHE  17  -0.395   0.844   4.184
  101    HE2  PHE  17           2HE      PHE  17   3.601   1.266   5.645
  102    HZ   PHE  17           HZ       PHE  17   1.949   0.021   4.271
  103    HA   PRO  18           HA       PRO  18  -2.328   4.479   6.870
  104   1HB   PRO  18          1HB       PRO  18  -4.898   5.394   7.616
  105   2HB   PRO  18          2HB       PRO  18  -3.821   4.373   8.571
  106   1HG   PRO  18          1HG       PRO  18  -4.591   6.985   9.213
  107   2HG   PRO  18          2HG       PRO  18  -3.225   6.105   9.923
  108   1HD   PRO  18          1HD       PRO  18  -3.241   8.152   7.740
  109   2HD   PRO  18          2HD       PRO  18  -2.042   7.869   9.022
  110    H    PHE  19           H        PHE  19  -3.196   3.936   4.880
  111    HA   PHE  19           HA       PHE  19  -4.329   6.193   3.366
  112   1HB   PHE  19          1HB       PHE  19  -3.863   5.014   1.318
  113   2HB   PHE  19          2HB       PHE  19  -2.399   5.086   2.279
  114    HD1  PHE  19           1HD      PHE  19  -1.680   2.997   3.520
  115    HD2  PHE  19           2HD      PHE  19  -4.711   2.996   0.540
  116    HE1  PHE  19           1HE      PHE  19  -1.368   0.571   3.191
  117    HE2  PHE  19           2HE      PHE  19  -4.402   0.586   0.205
  118    HZ   PHE  19           HZ       PHE  19  -2.724  -0.632   1.532
  119    H    THR  20           H        THR  20  -5.860   4.875   1.506
  120    HA   THR  20           HA       THR  20  -7.657   3.152   3.015
  121    HB   THR  20           HB       THR  20  -8.531   5.817   1.843
  122    HG1  THR  20           1HG      THR  20  -7.533   5.286   4.189
  123   1HG2  THR  20          1HG2      THR  20 -10.313   4.143   3.528
  124   2HG2  THR  20          2HG2      THR  20 -10.709   5.371   2.323
  125   3HG2  THR  20          3HG2      THR  20 -10.165   3.775   1.809
  126    H    PHE  21           H        PHE  21  -8.421   1.616   1.793
  127    HA   PHE  21           HA       PHE  21  -8.381   1.994  -1.128
  128   1HB   PHE  21          1HB       PHE  21  -6.855   0.278   0.064
  129   2HB   PHE  21          2HB       PHE  21  -8.320  -0.659   0.267
  130    HD1  PHE  21           1HD      PHE  21  -8.659   1.055  -2.785
  131    HD2  PHE  21           2HD      PHE  21  -6.593  -2.185  -0.975
  132    HE1  PHE  21           1HE      PHE  21  -8.292   0.043  -4.983
  133    HE2  PHE  21           2HE      PHE  21  -6.224  -3.201  -3.162
  134    HZ   PHE  21           HZ       PHE  21  -7.067  -2.081  -5.191
  135    H    LEU  22           H        LEU  22  -9.880  -0.575  -1.183
  136    HA   LEU  22           HA       LEU  22 -12.344   0.191  -1.891
  137   1HB   LEU  22          1HB       LEU  22 -11.663  -2.479  -0.717
  138   2HB   LEU  22          2HB       LEU  22 -13.003  -2.139  -1.786
  139    HG   LEU  22           HG       LEU  22 -11.546  -3.004  -3.285
  140   1HD1  LEU  22          1HD1      LEU  22 -11.222  -0.146  -3.207
  141   2HD1  LEU  22          2HD1      LEU  22  -9.963  -1.023  -4.076
  142   3HD1  LEU  22          3HD1      LEU  22 -11.655  -1.213  -4.540
  143   1HD2  LEU  22          1HD2      LEU  22  -9.913  -3.170  -1.276
  144   2HD2  LEU  22          2HD2      LEU  22  -9.440  -3.501  -2.944
  145   3HD2  LEU  22          3HD2      LEU  22  -9.082  -1.936  -2.225
  146    H    GLY  23           H        GLY  23 -12.328   1.624   0.166
  147   1HA   GLY  23          1HA       GLY  23 -13.983   2.353   1.659
  148   2HA   GLY  23          2HA       GLY  23 -14.650   0.728   1.683
  149    H    ASN  24           H        ASN  24 -11.305   0.577   2.213
  150    HA   ASN  24           HA       ASN  24 -11.784   0.691   5.121
  151   1HB   ASN  24          1HB       ASN  24  -9.979  -1.309   3.774
  152   2HB   ASN  24          2HB       ASN  24 -10.554  -1.300   5.431
  153   1HD2  ASN  24          1HD2      ASN  24 -12.577  -3.210   2.620
  154   2HD2  ASN  24          2HD2      ASN  24 -10.972  -2.599   2.442
  155    H    LYS  25           H        LYS  25 -10.266   1.678   6.344
  156    HA   LYS  25           HA       LYS  25  -8.154   3.115   5.065
  157   1HB   LYS  25          1HB       LYS  25  -8.933   2.742   7.961
  158   2HB   LYS  25          2HB       LYS  25  -7.791   3.909   7.356
  159   1HG   LYS  25          1HG       LYS  25  -9.514   5.088   6.174
  160   2HG   LYS  25          2HG       LYS  25 -10.696   3.854   6.622
  161   1HD   LYS  25          1HD       LYS  25 -10.525   4.421   8.932
  162   2HD   LYS  25          2HD       LYS  25  -9.165   5.497   8.626
  163   1HE   LYS  25          1HE       LYS  25 -11.165   6.800   8.958
  164   2HE   LYS  25          2HE       LYS  25 -10.628   6.942   7.279
  165   1HZ   LYS  25          1HZ       LYS  25 -12.475   4.775   7.657
  166   2HZ   LYS  25          2HZ       LYS  25 -13.142   6.269   8.125
  167   3HZ   LYS  25          3HZ       LYS  25 -12.530   6.064   6.551
  168    H    TYR  26           H        TYR  26  -6.063   2.352   4.863
  169    HA   TYR  26           HA       TYR  26  -5.424  -0.010   6.466
  170   1HB   TYR  26          1HB       TYR  26  -4.336   0.793   3.767
  171   2HB   TYR  26          2HB       TYR  26  -3.871  -0.637   4.680
  172    HD1  TYR  26           1HD      TYR  26  -6.655  -1.338   5.695
  173    HD2  TYR  26           2HD      TYR  26  -5.249  -0.268   1.835
  174    HE1  TYR  26           1HE      TYR  26  -8.465  -2.624   4.689
  175    HE2  TYR  26           2HE      TYR  26  -7.061  -1.543   0.826
  176    HH   TYR  26           HH       TYR  26  -8.628  -3.791   1.981
  177    H    GLU  27           H        GLU  27  -4.318   0.526   8.090
  178    HA   GLU  27           HA       GLU  27  -2.481   2.760   8.105
  179   1HB   GLU  27          1HB       GLU  27  -3.132   0.790  10.285
  180   2HB   GLU  27          2HB       GLU  27  -2.324   2.324  10.468
  181   1HG   GLU  27          1HG       GLU  27  -4.409   3.430   9.636
  182   2HG   GLU  27          2HG       GLU  27  -5.193   1.855   9.743
  183    H    SER  28           H        SER  28  -2.417  -0.591   7.675
  184    HA   SER  28           HA       SER  28   0.508  -0.579   7.722
  185   1HB   SER  28          1HB       SER  28   0.243  -3.061   8.281
  186   2HB   SER  28          2HB       SER  28  -0.105  -1.937   9.590
  187    HG   SER  28           HG       SER  28  -2.291  -2.241   9.240
  188    H    CYS  29           H        CYS  29   0.978  -2.941   6.426
  189    HA   CYS  29           HA       CYS  29   0.156  -2.302   3.787
  190   1HB   CYS  29          1HB       CYS  29   1.398  -4.857   4.781
  191   2HB   CYS  29          2HB       CYS  29   1.298  -4.333   3.117
  192    H    THR  30           H        THR  30  -0.963  -3.764   2.362
  193    HA   THR  30           HA       THR  30  -2.979  -5.448   3.671
  194    HB   THR  30           HB       THR  30  -4.015  -3.209   3.282
  195    HG1  THR  30           1HG      THR  30  -5.302  -5.092   3.059
  196   1HG2  THR  30          1HG2      THR  30  -4.345  -3.309   0.461
  197   2HG2  THR  30          2HG2      THR  30  -3.650  -2.027   1.455
  198   3HG2  THR  30          3HG2      THR  30  -2.621  -3.316   0.828
  199    H    SER  31           H        SER  31  -4.202  -6.716   1.966
  200    HA   SER  31           HA       SER  31  -2.443  -7.333  -0.297
  201   1HB   SER  31          1HB       SER  31  -3.321  -9.726  -0.030
  202   2HB   SER  31          2HB       SER  31  -2.143  -9.158   1.162
  203    HG   SER  31           HG       SER  31  -3.594  -9.396   2.673
  204    H    ALA  32           H        ALA  32  -4.735  -5.580   0.116
  205    HA   ALA  32           HA       ALA  32  -7.062  -6.639  -1.123
  206   1HB   ALA  32          1HB       ALA  32  -6.299  -4.244   0.184
  207   2HB   ALA  32          2HB       ALA  32  -6.866  -3.788  -1.423
  208   3HB   ALA  32          3HB       ALA  32  -7.914  -4.712  -0.350
  209    H    GLY  33           H        GLY  33  -7.902  -6.285  -3.135
  210   1HA   GLY  33          1HA       GLY  33  -7.930  -5.850  -5.384
  211   2HA   GLY  33          2HA       GLY  33  -6.530  -4.820  -5.152
  212    H    ARG  34           H        ARG  34  -5.468  -7.635  -3.870
  213    HA   ARG  34           HA       ARG  34  -4.242  -8.317  -6.429
  214   1HB   ARG  34          1HB       ARG  34  -3.538  -9.589  -3.799
  215   2HB   ARG  34          2HB       ARG  34  -2.612  -9.519  -5.258
  216   1HG   ARG  34          1HG       ARG  34  -2.403  -7.057  -4.929
  217   2HG   ARG  34          2HG       ARG  34  -3.140  -7.291  -3.336
  218   1HD   ARG  34          1HD       ARG  34  -0.630  -7.316  -3.350
  219   2HD   ARG  34          2HD       ARG  34  -1.347  -8.743  -2.644
  220    HE   ARG  34           HE       ARG  34   0.104  -8.529  -5.104
  221   1HH1  ARG  34          1HH1      ARG  34  -1.786 -10.474  -3.015
  222   2HH1  ARG  34          2HH1      ARG  34  -1.314 -11.954  -3.779
  223   1HH2  ARG  34          1HH2      ARG  34   0.689 -10.298  -6.195
  224   2HH2  ARG  34          2HH2      ARG  34   0.087 -11.847  -5.687
  225    H    SER  35           H        SER  35  -3.644 -10.974  -6.209
  226    HA   SER  35           HA       SER  35  -6.269 -12.267  -5.931
  227   1HB   SER  35          1HB       SER  35  -4.402 -12.744  -8.257
  228   2HB   SER  35          2HB       SER  35  -6.023 -13.404  -8.034
  229    HG   SER  35           HG       SER  35  -5.731 -11.460  -9.441
  230    H    ASP  36           H        ASP  36  -2.761 -12.618  -5.622
  231    HA   ASP  36           HA       ASP  36  -3.217 -15.410  -4.927
  232   1HB   ASP  36          1HB       ASP  36  -0.663 -15.524  -5.070
  233   2HB   ASP  36          2HB       ASP  36  -1.602 -15.467  -6.550
  234    H    GLY  37           H        GLY  37  -0.426 -13.608  -3.827
  235   1HA   GLY  37          1HA       GLY  37  -1.540 -13.708  -1.157
  236   2HA   GLY  37          2HA       GLY  37  -0.147 -14.705  -1.440
  237    H    LYS  38           H        LYS  38   0.763 -11.906  -3.118
  238    HA   LYS  38           HA       LYS  38   2.379 -11.165  -0.910
  239   1HB   LYS  38          1HB       LYS  38   1.856  -9.782  -3.533
  240   2HB   LYS  38          2HB       LYS  38   3.142  -9.362  -2.401
  241   1HG   LYS  38          1HG       LYS  38   4.342 -10.709  -3.710
  242   2HG   LYS  38          2HG       LYS  38   3.671 -11.973  -2.709
  243   1HD   LYS  38          1HD       LYS  38   1.993 -12.415  -4.373
  244   2HD   LYS  38          2HD       LYS  38   2.538 -11.046  -5.341
  245   1HE   LYS  38          1HE       LYS  38   4.760 -12.178  -5.536
  246   2HE   LYS  38          2HE       LYS  38   4.054 -13.588  -4.738
  247   1HZ   LYS  38          1HZ       LYS  38   2.635 -12.521  -7.060
  248   2HZ   LYS  38          2HZ       LYS  38   4.106 -13.312  -7.366
  249   3HZ   LYS  38          3HZ       LYS  38   2.849 -14.132  -6.563
  250    H    MET  39           H        MET  39   2.554  -8.907  -0.117
  251    HA   MET  39           HA       MET  39  -0.088  -7.678   0.150
  252   1HB   MET  39          1HB       MET  39   2.167  -7.480   2.148
  253   2HB   MET  39          2HB       MET  39   0.507  -6.970   2.341
  254   1HG   MET  39          1HG       MET  39   0.594  -8.889   3.603
  255   2HG   MET  39          2HG       MET  39  -0.090  -9.446   2.075
  256   1HE   MET  39          1HE       MET  39   0.667 -11.250   4.000
  257   2HE   MET  39          2HE       MET  39   1.030 -12.355   2.674
  258   3HE   MET  39          3HE       MET  39   2.226 -12.074   3.937
  259    H    TRP  40           H        TRP  40   0.057  -5.284   0.404
  260    HA   TRP  40           HA       TRP  40   2.525  -4.101  -0.612
  261   1HB   TRP  40          1HB       TRP  40   1.300  -2.868  -2.385
  262   2HB   TRP  40          2HB       TRP  40   1.289  -4.610  -2.657
  263    HD1  TRP  40           HD1      TRP  40  -1.114  -5.847  -1.782
  264    HE1  TRP  40           1HE      TRP  40  -3.513  -4.948  -1.975
  265    HE3  TRP  40           3HE      TRP  40  -0.067  -0.918  -2.524
  266    HZ2  TRP  40           2HZ      TRP  40  -4.785  -2.471  -2.366
  267    HZ3  TRP  40           3HZ      TRP  40  -1.936   0.662  -2.791
  268    HH2  TRP  40           HH2      TRP  40  -4.246  -0.106  -2.720
  269    H    CYS  41           H        CYS  41   1.671  -1.586  -1.119
  270    HA   CYS  41           HA       CYS  41   0.012  -0.564   1.020
  271   1HB   CYS  41          1HB       CYS  41   1.814   0.903   1.920
  272   2HB   CYS  41          2HB       CYS  41   2.132  -0.806   2.204
  273    H    ALA  42           H        ALA  42  -0.676   1.567   0.568
  274    HA   ALA  42           HA       ALA  42  -0.294   2.342  -2.187
  275   1HB   ALA  42          1HB       ALA  42  -2.449   2.588  -0.681
  276   2HB   ALA  42          2HB       ALA  42  -1.698   4.130  -0.266
  277   3HB   ALA  42          3HB       ALA  42  -2.076   3.758  -1.948
  278    H    THR  43           H        THR  43   0.668   4.240  -2.899
  279    HA   THR  43           HA       THR  43   2.594   5.357  -0.998
  280    HB   THR  43           HB       THR  43   3.840   6.079  -2.990
  281    HG1  THR  43           1HG      THR  43   2.819   6.239  -4.806
  282   1HG2  THR  43          1HG2      THR  43   4.093   3.743  -4.072
  283   2HG2  THR  43          2HG2      THR  43   4.559   3.970  -2.388
  284   3HG2  THR  43          3HG2      THR  43   3.013   3.217  -2.781
  285    H    THR  44           H        THR  44  -0.313   5.963  -1.395
  286    HA   THR  44           HA       THR  44  -0.066   8.870  -1.372
  287    HB   THR  44           HB       THR  44  -2.212   9.027  -2.683
  288    HG1  THR  44           1HG      THR  44  -3.199   7.239  -3.100
  289   1HG2  THR  44          1HG2      THR  44  -0.283   7.626  -4.453
  290   2HG2  THR  44          2HG2      THR  44  -1.228   9.090  -4.743
  291   3HG2  THR  44          3HG2      THR  44   0.188   9.144  -3.692
  292    H    ALA  45           H        ALA  45  -1.780   9.889  -0.135
  293    HA   ALA  45           HA       ALA  45  -2.523   8.467   2.178
  294   1HB   ALA  45          1HB       ALA  45  -2.375  11.043   1.658
  295   2HB   ALA  45          2HB       ALA  45  -4.103  10.852   1.363
  296   3HB   ALA  45          3HB       ALA  45  -3.423  10.426   2.934
  297    H    ASN  46           H        ASN  46  -4.169   8.967  -0.842
  298    HA   ASN  46           HA       ASN  46  -6.283   7.141   0.051
  299   1HB   ASN  46          1HB       ASN  46  -7.268   9.400  -0.071
  300   2HB   ASN  46          2HB       ASN  46  -6.688   9.568  -1.727
  301   1HD2  ASN  46          1HD2      ASN  46 -10.141   7.749  -0.906
  302   2HD2  ASN  46          2HD2      ASN  46  -9.162   8.515   0.287
  303    H    TYR  47           H        TYR  47  -6.141   5.358  -1.121
  304    HA   TYR  47           HA       TYR  47  -4.546   5.329  -3.515
  305   1HB   TYR  47          1HB       TYR  47  -4.419   3.533  -1.813
  306   2HB   TYR  47          2HB       TYR  47  -6.056   3.043  -2.249
  307    HD1  TYR  47           1HD      TYR  47  -2.578   3.278  -3.440
  308    HD2  TYR  47           2HD      TYR  47  -6.478   1.785  -4.248
  309    HE1  TYR  47           1HE      TYR  47  -1.669   1.898  -5.249
  310    HE2  TYR  47           2HE      TYR  47  -5.568   0.397  -6.065
  311    HH   TYR  47           HH       TYR  47  -3.446  -0.579  -6.770
  312    H    ASP  48           H        ASP  48  -7.979   5.107  -2.786
  313    HA   ASP  48           HA       ASP  48  -8.960   4.034  -5.129
  314   1HB   ASP  48          1HB       ASP  48 -10.107   6.175  -3.352
  315   2HB   ASP  48          2HB       ASP  48 -10.994   5.490  -4.706
  316    H    ASP  49           H        ASP  49  -7.966   7.358  -4.520
  317    HA   ASP  49           HA       ASP  49  -8.856   8.324  -7.058
  318   1HB   ASP  49          1HB       ASP  49  -7.326   9.469  -4.771
  319   2HB   ASP  49          2HB       ASP  49  -7.293  10.303  -6.320
  320    H    ASP  50           H        ASP  50  -5.573   8.563  -5.771
  321    HA   ASP  50           HA       ASP  50  -4.423   8.786  -8.347
  322   1HB   ASP  50          1HB       ASP  50  -3.220   8.486  -5.605
  323   2HB   ASP  50          2HB       ASP  50  -2.245   8.664  -7.060
  324    H    ARG  51           H        ARG  51  -5.075   6.008  -6.429
  325    HA   ARG  51           HA       ARG  51  -4.353   3.868  -6.483
  326   1HB   ARG  51          1HB       ARG  51  -4.693   4.418  -9.403
  327   2HB   ARG  51          2HB       ARG  51  -4.783   2.844  -8.624
  328   1HG   ARG  51          1HG       ARG  51  -6.544   4.171  -7.130
  329   2HG   ARG  51          2HG       ARG  51  -6.723   5.054  -8.649
  330   1HD   ARG  51          1HD       ARG  51  -6.802   2.067  -8.436
  331   2HD   ARG  51          2HD       ARG  51  -8.240   3.084  -8.317
  332    HE   ARG  51           HE       ARG  51  -6.842   2.362 -10.707
  333   1HH1  ARG  51          1HH1      ARG  51  -8.795   4.840  -9.197
  334   2HH1  ARG  51          2HH1      ARG  51  -9.302   5.547 -10.700
  335   1HH2  ARG  51          1HH2      ARG  51  -7.488   3.326 -12.703
  336   2HH2  ARG  51          2HH2      ARG  51  -8.545   4.704 -12.674
  337    H    LYS  52           H        LYS  52  -2.116   5.012  -5.917
  338    HA   LYS  52           HA       LYS  52  -0.162   3.823  -7.757
  339   1HB   LYS  52          1HB       LYS  52   0.044   6.295  -6.050
  340   2HB   LYS  52          2HB       LYS  52   1.492   5.405  -6.514
  341   1HG   LYS  52          1HG       LYS  52   0.962   5.710  -8.858
  342   2HG   LYS  52          2HG       LYS  52  -0.537   6.535  -8.441
  343   1HD   LYS  52          1HD       LYS  52   2.231   7.496  -7.693
  344   2HD   LYS  52          2HD       LYS  52   1.321   8.059  -9.095
  345   1HE   LYS  52          1HE       LYS  52  -0.459   8.856  -7.601
  346   2HE   LYS  52          2HE       LYS  52   0.490   8.337  -6.209
  347   1HZ   LYS  52          1HZ       LYS  52   2.288   9.864  -7.295
  348   2HZ   LYS  52          2HZ       LYS  52   0.955  10.588  -8.048
  349   3HZ   LYS  52          3HZ       LYS  52   1.050  10.543  -6.347
  350    H    TRP  53           H        TRP  53   0.726   2.055  -6.998
  351    HA   TRP  53           HA       TRP  53   0.829   1.701  -4.083
  352   1HB   TRP  53          1HB       TRP  53  -0.003  -0.525  -4.358
  353   2HB   TRP  53          2HB       TRP  53  -1.096   0.601  -5.078
  354    HD1  TRP  53           HD1      TRP  53  -0.548   0.840  -7.987
  355    HE1  TRP  53           1HE      TRP  53  -0.248  -1.182  -9.564
  356    HE3  TRP  53           3HE      TRP  53   0.575  -2.589  -4.489
  357    HZ2  TRP  53           2HZ      TRP  53   0.388  -3.955  -9.293
  358    HZ3  TRP  53           3HZ      TRP  53   1.011  -4.942  -5.176
  359    HH2  TRP  53           HH2      TRP  53   0.919  -5.599  -7.532
  360    H    GLY  54           H        GLY  54   1.982  -0.221  -3.429
  361   1HA   GLY  54          1HA       GLY  54   4.132  -1.275  -5.022
  362   2HA   GLY  54          2HA       GLY  54   4.680  -0.143  -3.783
  363    H    PHE  55           H        PHE  55   4.875  -3.158  -4.120
  364    HA   PHE  55           HA       PHE  55   3.343  -4.500  -2.229
  365   1HB   PHE  55          1HB       PHE  55   6.047  -4.944  -3.438
  366   2HB   PHE  55          2HB       PHE  55   5.474  -6.006  -2.163
  367    HD1  PHE  55           1HD      PHE  55   2.525  -5.250  -3.582
  368    HD2  PHE  55           2HD      PHE  55   6.147  -7.230  -4.617
  369    HE1  PHE  55           1HE      PHE  55   1.301  -6.641  -5.210
  370    HE2  PHE  55           2HE      PHE  55   4.929  -8.624  -6.241
  371    HZ   PHE  55           HZ       PHE  55   2.508  -8.319  -6.544
  372    H    CYS  56           H        CYS  56   4.082  -5.413  -0.177
  373    HA   CYS  56           HA       CYS  56   4.952  -3.298   1.546
  374   1HB   CYS  56          1HB       CYS  56   3.178  -5.035   2.068
  375   2HB   CYS  56          2HB       CYS  56   4.492  -6.181   2.301
  376    HA   PRO  57           HA       PRO  57   9.264  -4.426   1.565
  377   1HB   PRO  57          1HB       PRO  57  10.135  -2.634   3.294
  378   2HB   PRO  57          2HB       PRO  57   9.496  -2.113   1.727
  379   1HG   PRO  57          1HG       PRO  57   8.083  -2.317   4.343
  380   2HG   PRO  57          2HG       PRO  57   8.190  -0.897   3.285
  381   1HD   PRO  57          1HD       PRO  57   6.057  -2.525   3.250
  382   2HD   PRO  57          2HD       PRO  57   6.687  -1.809   1.748
  383    H    ASP  58           H        ASP  58  10.643  -3.958   4.056
  384    HA   ASP  58           HA       ASP  58  10.564  -6.478   5.228
  385   1HB   ASP  58          1HB       ASP  58  12.373  -4.701   5.471
  386   2HB   ASP  58          2HB       ASP  58  11.348  -3.958   6.692
  387    H    GLN  59           H        GLN  59   8.736  -7.336   6.024
  388    HA   GLN  59           HA       GLN  59   6.895  -5.696   7.567
  389   1HB   GLN  59          1HB       GLN  59   6.645  -8.608   6.801
  390   2HB   GLN  59          2HB       GLN  59   5.373  -7.581   7.445
  391   1HG   GLN  59          1HG       GLN  59   5.582  -6.171   5.420
  392   2HG   GLN  59          2HG       GLN  59   6.724  -7.347   4.773
  393   1HE2  GLN  59          1HE2      GLN  59   4.212  -9.268   3.413
  394   2HE2  GLN  59          2HE2      GLN  59   5.842  -8.696   3.388
  395    H    GLY  60           H        GLY  60   6.001  -6.451   9.592
  396   1HA   GLY  60          1HA       GLY  60   7.765  -8.220  11.128
  397   2HA   GLY  60          2HA       GLY  60   7.445  -6.602  11.740
  Start of MODEL   49
    1    H    SER   1           1H       SER   1  13.638   8.404   8.219
    2    HA   SER   1           HA       SER   1  13.516   6.374   7.360
    3   1HB   SER   1          1HB       SER   1  10.570   7.081   7.423
    4   2HB   SER   1          2HB       SER   1  11.290   5.498   7.722
    5    HG   SER   1           HG       SER   1  10.732   6.623   9.665
    6    H    TRP   2           H        TRP   2  14.211   5.912   5.351
    7    HA   TRP   2           HA       TRP   2  12.482   6.629   3.085
    8   1HB   TRP   2          1HB       TRP   2  14.698   6.190   1.775
    9   2HB   TRP   2          2HB       TRP   2  14.469   7.706   2.639
   10    HD1  TRP   2           HD1      TRP   2  15.854   4.246   3.825
   11    HE1  TRP   2           1HE      TRP   2  18.103   4.668   5.014
   12    HE3  TRP   2           3HE      TRP   2  16.158   9.313   3.200
   13    HZ2  TRP   2           2HZ      TRP   2  19.785   6.858   5.586
   14    HZ3  TRP   2           3HZ      TRP   2  18.125  10.493   4.089
   15    HH2  TRP   2           HH2      TRP   2  19.901   9.291   5.261
   16    H    MET   3           H        MET   3  11.519   4.416   4.163
   17    HA   MET   3           HA       MET   3  12.804   2.093   3.010
   18   1HB   MET   3          1HB       MET   3  10.695   0.925   3.877
   19   2HB   MET   3          2HB       MET   3  11.806   1.571   5.069
   20   1HG   MET   3          1HG       MET   3   9.439   3.156   4.150
   21   2HG   MET   3          2HG       MET   3   9.269   1.904   5.380
   22   1HE   MET   3          1HE       MET   3  11.522   1.716   6.872
   23   2HE   MET   3          2HE       MET   3  12.195   3.097   7.738
   24   3HE   MET   3          3HE       MET   3  10.609   2.465   8.183
   25    H    SER   4           H        SER   4  12.669   1.932   0.862
   26    HA   SER   4           HA       SER   4  10.457   2.971  -0.630
   27   1HB   SER   4          1HB       SER   4  12.636   1.113  -1.595
   28   2HB   SER   4          2HB       SER   4  11.637   2.182  -2.576
   29    HG   SER   4           HG       SER   4  12.750   3.896  -1.902
   30    H    THR   5           H        THR   5   9.064   1.751  -2.014
   31    HA   THR   5           HA       THR   5   8.127  -0.680  -0.757
   32    HB   THR   5           HB       THR   5   6.341  -0.453  -2.591
   33    HG1  THR   5           1HG      THR   5   7.053   2.232  -2.740
   34   1HG2  THR   5          1HG2      THR   5   6.332   1.997  -0.921
   35   2HG2  THR   5          2HG2      THR   5   5.014   0.894  -1.329
   36   3HG2  THR   5          3HG2      THR   5   6.231   0.417  -0.144
   37    H    VAL   6           H        VAL   6   7.360  -2.427  -2.150
   38    HA   VAL   6           HA       VAL   6   9.312  -3.115  -4.259
   39    HB   VAL   6           HB       VAL   6   7.613  -5.297  -3.383
   40   1HG1  VAL   6          1HG1      VAL   6  10.591  -4.907  -3.368
   41   2HG1  VAL   6          2HG1      VAL   6   9.773  -6.436  -3.047
   42   3HG1  VAL   6          3HG1      VAL   6   9.624  -5.671  -4.631
   43   1HG2  VAL   6          1HG2      VAL   6   8.730  -3.633  -1.272
   44   2HG2  VAL   6          2HG2      VAL   6   7.499  -4.892  -1.195
   45   3HG2  VAL   6          3HG2      VAL   6   9.208  -5.327  -1.166
   46    H    GLY   7           H        GLY   7   7.862  -5.058  -5.494
   47   1HA   GLY   7          1HA       GLY   7   6.348  -5.176  -7.271
   48   2HA   GLY   7          2HA       GLY   7   5.227  -4.904  -5.975
   49    H    GLY   8           H        GLY   8   3.771  -3.592  -6.563
   50   1HA   GLY   8          1HA       GLY   8   2.647  -1.879  -7.580
   51   2HA   GLY   8          2HA       GLY   8   3.833  -0.940  -6.701
   52    H    ASN   9           H        ASN   9   3.790   0.706  -8.118
   53    HA   ASN   9           HA       ASN   9   5.475   0.412 -10.435
   54   1HB   ASN   9          1HB       ASN   9   3.902   1.475 -11.998
   55   2HB   ASN   9          2HB       ASN   9   3.321  -0.082 -11.449
   56   1HD2  ASN   9          1HD2      ASN   9   1.217   2.387  -9.241
   57   2HD2  ASN   9          2HD2      ASN   9   2.821   1.829  -8.916
   58    H    SER  10           H        SER  10   4.967   1.930  -7.744
   59    HA   SER  10           HA       SER  10   5.050   4.677  -8.611
   60   1HB   SER  10          1HB       SER  10   5.414   3.495  -5.848
   61   2HB   SER  10          2HB       SER  10   5.073   5.180  -6.232
   62    HG   SER  10           HG       SER  10   3.213   3.838  -5.624
   63    H    GLY  11           H        GLY  11   7.282   2.295  -8.625
   64   1HA   GLY  11          1HA       GLY  11   9.543   2.533  -9.168
   65   2HA   GLY  11          2HA       GLY  11   9.480   4.203  -8.630
   66    H    GLY  12           H        GLY  12  10.004   4.711  -6.539
   67   1HA   GLY  12          1HA       GLY  12  10.559   2.485  -4.700
   68   2HA   GLY  12          2HA       GLY  12  11.850   3.620  -5.069
   69    H    ALA  13           H        ALA  13   8.412   4.299  -4.637
   70    HA   ALA  13           HA       ALA  13   9.103   6.295  -2.629
   71   1HB   ALA  13          1HB       ALA  13   7.569   6.910  -4.445
   72   2HB   ALA  13          2HB       ALA  13   6.438   5.673  -3.900
   73   3HB   ALA  13          3HB       ALA  13   6.802   7.053  -2.863
   74    HA   PRO  14           HA       PRO  14   7.828   3.784   0.782
   75   1HB   PRO  14          1HB       PRO  14   6.991   6.158   2.246
   76   2HB   PRO  14          2HB       PRO  14   8.395   5.123   2.520
   77   1HG   PRO  14          1HG       PRO  14   8.570   7.686   1.598
   78   2HG   PRO  14          2HG       PRO  14   9.767   6.432   1.236
   79   1HD   PRO  14          1HD       PRO  14   7.558   7.492  -0.481
   80   2HD   PRO  14          2HD       PRO  14   9.201   6.994  -0.932
   81    H    CYS  15           H        CYS  15   5.929   3.524   2.324
   82    HA   CYS  15           HA       CYS  15   3.477   3.719   0.777
   83   1HB   CYS  15          1HB       CYS  15   3.579   2.687   3.601
   84   2HB   CYS  15          2HB       CYS  15   2.566   2.153   2.269
   85    H    VAL  16           H        VAL  16   1.566   4.773   1.545
   86    HA   VAL  16           HA       VAL  16   2.098   6.893   3.523
   87    HB   VAL  16           HB       VAL  16   0.105   6.826   1.244
   88   1HG1  VAL  16          1HG1      VAL  16  -0.878   7.870   3.248
   89   2HG1  VAL  16          2HG1      VAL  16   0.489   8.981   3.318
   90   3HG1  VAL  16          3HG1      VAL  16  -0.616   9.030   1.943
   91   1HG2  VAL  16          1HG2      VAL  16   2.702   8.179   1.724
   92   2HG2  VAL  16          2HG2      VAL  16   2.003   7.564   0.224
   93   3HG2  VAL  16          3HG2      VAL  16   1.444   9.094   0.893
   94    H    PHE  17           H        PHE  17   1.323   6.319   5.463
   95    HA   PHE  17           HA       PHE  17  -1.193   4.814   5.553
   96   1HB   PHE  17          1HB       PHE  17   1.121   4.935   7.489
   97   2HB   PHE  17          2HB       PHE  17  -0.405   4.137   7.835
   98    HD1  PHE  17           1HD      PHE  17  -0.526   3.265   4.725
   99    HD2  PHE  17           2HD      PHE  17   2.200   2.784   7.948
  100    HE1  PHE  17           1HE      PHE  17   0.341   1.213   3.690
  101    HE2  PHE  17           2HE      PHE  17   3.077   0.736   6.928
  102    HZ   PHE  17           HZ       PHE  17   2.163  -0.074   4.772
  103    HA   PRO  18           HA       PRO  18  -2.696   4.317   6.692
  104   1HB   PRO  18          1HB       PRO  18  -5.342   5.268   7.023
  105   2HB   PRO  18          2HB       PRO  18  -4.399   4.330   8.180
  106   1HG   PRO  18          1HG       PRO  18  -5.231   6.973   8.521
  107   2HG   PRO  18          2HG       PRO  18  -3.963   6.161   9.454
  108   1HD   PRO  18          1HD       PRO  18  -3.723   8.034   7.141
  109   2HD   PRO  18          2HD       PRO  18  -2.679   7.861   8.569
  110    H    PHE  19           H        PHE  19  -3.155   3.608   4.664
  111    HA   PHE  19           HA       PHE  19  -4.199   5.614   2.789
  112   1HB   PHE  19          1HB       PHE  19  -3.412   4.286   0.978
  113   2HB   PHE  19          2HB       PHE  19  -2.094   4.471   2.126
  114    HD1  PHE  19           1HD      PHE  19  -1.382   2.541   3.492
  115    HD2  PHE  19           2HD      PHE  19  -4.306   2.151   0.428
  116    HE1  PHE  19           1HE      PHE  19  -1.023   0.110   3.465
  117    HE2  PHE  19           2HE      PHE  19  -3.945  -0.283   0.388
  118    HZ   PHE  19           HZ       PHE  19  -2.294  -1.303   1.909
  119    H    THR  20           H        THR  20  -6.191   5.533   2.159
  120    HA   THR  20           HA       THR  20  -7.816   3.342   3.134
  121    HB   THR  20           HB       THR  20  -8.628   5.885   1.683
  122    HG1  THR  20           1HG      THR  20  -7.926   6.713   3.488
  123   1HG2  THR  20          1HG2      THR  20 -10.692   5.322   3.310
  124   2HG2  THR  20          2HG2      THR  20 -10.613   4.859   1.611
  125   3HG2  THR  20          3HG2      THR  20 -10.185   3.692   2.863
  126    H    PHE  21           H        PHE  21  -8.387   1.679   2.035
  127    HA   PHE  21           HA       PHE  21  -8.594   1.858  -0.900
  128   1HB   PHE  21          1HB       PHE  21  -6.598   0.508   0.104
  129   2HB   PHE  21          2HB       PHE  21  -7.822  -0.641   0.572
  130    HD1  PHE  21           1HD      PHE  21  -8.472   1.062  -2.558
  131    HD2  PHE  21           2HD      PHE  21  -6.560  -2.268  -0.740
  132    HE1  PHE  21           1HE      PHE  21  -8.301  -0.049  -4.734
  133    HE2  PHE  21           2HE      PHE  21  -6.386  -3.380  -2.906
  134    HZ   PHE  21           HZ       PHE  21  -7.247  -2.260  -4.931
  135    H    LEU  22           H        LEU  22 -10.353   0.750  -1.739
  136    HA   LEU  22           HA       LEU  22 -12.539   0.277  -1.810
  137   1HB   LEU  22          1HB       LEU  22 -11.230  -1.804  -0.173
  138   2HB   LEU  22          2HB       LEU  22 -12.803  -2.042  -0.920
  139    HG   LEU  22           HG       LEU  22 -11.692  -2.783  -2.717
  140   1HD1  LEU  22          1HD1      LEU  22 -11.509  -0.093  -3.039
  141   2HD1  LEU  22          2HD1      LEU  22  -9.913  -0.732  -3.436
  142   3HD1  LEU  22          3HD1      LEU  22 -11.344  -1.338  -4.275
  143   1HD2  LEU  22          1HD2      LEU  22  -9.702  -2.641  -0.812
  144   2HD2  LEU  22          2HD2      LEU  22  -9.832  -3.728  -2.194
  145   3HD2  LEU  22          3HD2      LEU  22  -9.010  -2.177  -2.368
  146    H    GLY  23           H        GLY  23 -12.024   2.134   0.368
  147   1HA   GLY  23          1HA       GLY  23 -13.698   3.095   1.727
  148   2HA   GLY  23          2HA       GLY  23 -14.417   1.507   1.929
  149    H    ASN  24           H        ASN  24 -11.342   0.725   2.549
  150    HA   ASN  24           HA       ASN  24 -11.671   1.390   5.395
  151   1HB   ASN  24          1HB       ASN  24 -10.216  -0.886   4.057
  152   2HB   ASN  24          2HB       ASN  24 -10.270  -0.605   5.794
  153   1HD2  ASN  24          1HD2      ASN  24 -13.218  -2.529   3.932
  154   2HD2  ASN  24          2HD2      ASN  24 -11.730  -2.085   3.185
  155    H    LYS  25           H        LYS  25 -10.128   2.465   6.478
  156    HA   LYS  25           HA       LYS  25  -7.909   3.569   5.051
  157   1HB   LYS  25          1HB       LYS  25  -8.733   3.737   7.957
  158   2HB   LYS  25          2HB       LYS  25  -7.573   4.754   7.146
  159   1HG   LYS  25          1HG       LYS  25  -9.239   5.772   5.799
  160   2HG   LYS  25          2HG       LYS  25 -10.441   4.589   6.318
  161   1HD   LYS  25          1HD       LYS  25 -10.326   5.472   8.597
  162   2HD   LYS  25          2HD       LYS  25  -9.117   6.648   8.082
  163   1HE   LYS  25          1HE       LYS  25 -11.390   7.608   8.213
  164   2HE   LYS  25          2HE       LYS  25 -10.698   7.702   6.590
  165   1HZ   LYS  25          1HZ       LYS  25 -12.225   5.287   7.060
  166   2HZ   LYS  25          2HZ       LYS  25 -13.146   6.702   7.189
  167   3HZ   LYS  25          3HZ       LYS  25 -12.290   6.379   5.761
  168    H    TYR  26           H        TYR  26  -6.064   2.384   4.801
  169    HA   TYR  26           HA       TYR  26  -5.566   0.254   6.720
  170   1HB   TYR  26          1HB       TYR  26  -4.261   0.820   4.063
  171   2HB   TYR  26          2HB       TYR  26  -3.944  -0.577   5.083
  172    HD1  TYR  26           1HD      TYR  26  -6.938  -0.907   5.900
  173    HD2  TYR  26           2HD      TYR  26  -4.971  -0.451   2.169
  174    HE1  TYR  26           1HE      TYR  26  -8.727  -2.161   4.801
  175    HE2  TYR  26           2HE      TYR  26  -6.751  -1.705   1.065
  176    HH   TYR  26           HH       TYR  26  -9.106  -3.472   2.798
  177    H    GLU  27           H        GLU  27  -4.424   0.686   8.345
  178    HA   GLU  27           HA       GLU  27  -2.459   2.811   8.367
  179   1HB   GLU  27          1HB       GLU  27  -3.583   0.973  10.454
  180   2HB   GLU  27          2HB       GLU  27  -2.273   2.075  10.785
  181   1HG   GLU  27          1HG       GLU  27  -3.652   3.972  10.289
  182   2HG   GLU  27          2HG       GLU  27  -4.963   2.919   9.757
  183    H    SER  28           H        SER  28  -2.586  -0.486   7.782
  184    HA   SER  28           HA       SER  28   0.325  -0.693   7.984
  185   1HB   SER  28          1HB       SER  28  -0.108  -3.141   8.491
  186   2HB   SER  28          2HB       SER  28  -0.505  -2.028   9.793
  187    HG   SER  28           HG       SER  28  -2.311  -3.210   7.937
  188    H    CYS  29           H        CYS  29   0.729  -3.037   6.670
  189    HA   CYS  29           HA       CYS  29   0.003  -2.343   4.000
  190   1HB   CYS  29          1HB       CYS  29   1.355  -4.800   5.111
  191   2HB   CYS  29          2HB       CYS  29   1.110  -4.509   3.401
  192    H    THR  30           H        THR  30  -0.937  -4.031   2.539
  193    HA   THR  30           HA       THR  30  -3.044  -5.626   3.799
  194    HB   THR  30           HB       THR  30  -4.037  -3.355   3.353
  195    HG1  THR  30           1HG      THR  30  -5.539  -4.896   3.227
  196   1HG2  THR  30          1HG2      THR  30  -4.527  -3.230   0.715
  197   2HG2  THR  30          2HG2      THR  30  -3.237  -2.337   1.516
  198   3HG2  THR  30          3HG2      THR  30  -2.879  -3.856   0.694
  199    H    SER  31           H        SER  31  -4.314  -6.724   1.958
  200    HA   SER  31           HA       SER  31  -2.546  -7.402  -0.276
  201   1HB   SER  31          1HB       SER  31  -3.461  -9.789  -0.017
  202   2HB   SER  31          2HB       SER  31  -2.262  -9.260   1.173
  203    HG   SER  31           HG       SER  31  -5.084  -9.450   1.487
  204    H    ALA  32           H        ALA  32  -4.910  -5.695   0.401
  205    HA   ALA  32           HA       ALA  32  -7.267  -6.643  -0.797
  206   1HB   ALA  32          1HB       ALA  32  -6.611  -4.440   0.653
  207   2HB   ALA  32          2HB       ALA  32  -6.722  -3.744  -0.964
  208   3HB   ALA  32          3HB       ALA  32  -8.105  -4.590  -0.275
  209    H    GLY  33           H        GLY  33  -8.151  -6.381  -2.804
  210   1HA   GLY  33          1HA       GLY  33  -8.253  -5.996  -5.071
  211   2HA   GLY  33          2HA       GLY  33  -6.892  -4.900  -4.891
  212    H    ARG  34           H        ARG  34  -5.870  -7.713  -3.526
  213    HA   ARG  34           HA       ARG  34  -4.597  -8.497  -6.048
  214   1HB   ARG  34          1HB       ARG  34  -3.724  -9.197  -3.250
  215   2HB   ARG  34          2HB       ARG  34  -2.826  -9.404  -4.734
  216   1HG   ARG  34          1HG       ARG  34  -3.311  -6.731  -4.774
  217   2HG   ARG  34          2HG       ARG  34  -3.126  -7.056  -3.047
  218   1HD   ARG  34          1HD       ARG  34  -0.995  -6.491  -4.225
  219   2HD   ARG  34          2HD       ARG  34  -0.982  -8.041  -3.372
  220    HE   ARG  34           HE       ARG  34  -0.719  -9.108  -5.376
  221   1HH1  ARG  34          1HH1      ARG  34  -1.775  -5.822  -5.960
  222   2HH1  ARG  34          2HH1      ARG  34  -1.726  -5.969  -7.690
  223   1HH2  ARG  34          1HH2      ARG  34  -0.691  -9.314  -7.664
  224   2HH2  ARG  34          2HH2      ARG  34  -1.090  -7.940  -8.650
  225    H    SER  35           H        SER  35  -5.028 -10.393  -6.945
  226    HA   SER  35           HA       SER  35  -6.728 -12.264  -5.480
  227   1HB   SER  35          1HB       SER  35  -5.961 -12.178  -8.408
  228   2HB   SER  35          2HB       SER  35  -7.119 -13.299  -7.686
  229    HG   SER  35           HG       SER  35  -7.875 -11.194  -8.727
  230    H    ASP  36           H        ASP  36  -3.533 -11.783  -5.783
  231    HA   ASP  36           HA       ASP  36  -2.831 -14.582  -6.130
  232   1HB   ASP  36          1HB       ASP  36  -0.441 -13.515  -5.779
  233   2HB   ASP  36          2HB       ASP  36  -1.253 -13.447  -7.330
  234    H    GLY  37           H        GLY  37  -1.239 -12.307  -4.038
  235   1HA   GLY  37          1HA       GLY  37  -2.217 -13.101  -1.593
  236   2HA   GLY  37          2HA       GLY  37  -0.924 -14.221  -1.964
  237    H    LYS  38           H        LYS  38   0.484 -11.923  -3.452
  238    HA   LYS  38           HA       LYS  38   2.188 -11.178  -1.374
  239   1HB   LYS  38          1HB       LYS  38   1.781  -9.774  -4.017
  240   2HB   LYS  38          2HB       LYS  38   3.225  -9.725  -3.008
  241   1HG   LYS  38          1HG       LYS  38   3.917 -11.321  -4.412
  242   2HG   LYS  38          2HG       LYS  38   3.009 -12.374  -3.345
  243   1HD   LYS  38          1HD       LYS  38   2.256 -13.032  -5.422
  244   2HD   LYS  38          2HD       LYS  38   1.043 -11.833  -4.979
  245   1HE   LYS  38          1HE       LYS  38   2.126 -10.162  -6.341
  246   2HE   LYS  38          2HE       LYS  38   3.471 -11.255  -6.675
  247   1HZ   LYS  38          1HZ       LYS  38   1.613 -12.764  -7.619
  248   2HZ   LYS  38          2HZ       LYS  38   0.713 -11.325  -7.723
  249   3HZ   LYS  38          3HZ       LYS  38   2.192 -11.467  -8.557
  250    H    MET  39           H        MET  39   2.153  -9.570   0.090
  251    HA   MET  39           HA       MET  39  -0.159  -7.817   0.084
  252   1HB   MET  39          1HB       MET  39   2.030  -8.114   2.152
  253   2HB   MET  39          2HB       MET  39   0.515  -7.243   2.347
  254   1HG   MET  39          1HG       MET  39  -0.737  -9.302   2.145
  255   2HG   MET  39          2HG       MET  39   0.755 -10.200   1.868
  256   1HE   MET  39          1HE       MET  39   2.731  -9.776   3.318
  257   2HE   MET  39          2HE       MET  39   2.699  -9.071   4.937
  258   3HE   MET  39          3HE       MET  39   2.471 -10.806   4.726
  259    H    TRP  40           H        TRP  40  -0.049  -5.573   0.221
  260    HA   TRP  40           HA       TRP  40   2.520  -4.340  -0.490
  261   1HB   TRP  40          1HB       TRP  40   1.339  -2.983  -2.204
  262   2HB   TRP  40          2HB       TRP  40   1.356  -4.701  -2.595
  263    HD1  TRP  40           HD1      TRP  40  -1.071  -6.011  -1.800
  264    HE1  TRP  40           1HE      TRP  40  -3.473  -5.127  -2.042
  265    HE3  TRP  40           3HE      TRP  40  -0.050  -1.049  -2.347
  266    HZ2  TRP  40           2HZ      TRP  40  -4.755  -2.652  -2.392
  267    HZ3  TRP  40           3HZ      TRP  40  -1.920   0.516  -2.617
  268    HH2  TRP  40           HH2      TRP  40  -4.229  -0.274  -2.646
  269    H    CYS  41           H        CYS  41   1.733  -1.824  -0.923
  270    HA   CYS  41           HA       CYS  41  -0.015  -0.801   1.131
  271   1HB   CYS  41          1HB       CYS  41   1.753   0.640   2.147
  272   2HB   CYS  41          2HB       CYS  41   1.998  -1.074   2.470
  273    H    ALA  42           H        ALA  42  -0.825   1.194   0.453
  274    HA   ALA  42           HA       ALA  42  -0.133   1.975  -2.213
  275   1HB   ALA  42          1HB       ALA  42  -2.017   3.136  -0.188
  276   2HB   ALA  42          2HB       ALA  42  -1.726   3.896  -1.754
  277   3HB   ALA  42          3HB       ALA  42  -2.397   2.268  -1.677
  278    H    THR  43           H        THR  43   0.698   3.970  -2.883
  279    HA   THR  43           HA       THR  43   2.526   5.127  -0.915
  280    HB   THR  43           HB       THR  43   3.803   5.918  -2.858
  281    HG1  THR  43           1HG      THR  43   2.863   6.032  -4.721
  282   1HG2  THR  43          1HG2      THR  43   4.422   3.724  -3.825
  283   2HG2  THR  43          2HG2      THR  43   4.375   3.734  -2.062
  284   3HG2  THR  43          3HG2      THR  43   3.051   3.009  -2.975
  285    H    THR  44           H        THR  44  -0.433   5.620  -1.685
  286    HA   THR  44           HA       THR  44  -0.265   8.535  -1.494
  287    HB   THR  44           HB       THR  44  -2.295   8.661  -2.991
  288    HG1  THR  44           1HG      THR  44  -3.155   6.830  -3.499
  289   1HG2  THR  44          1HG2      THR  44   0.080   7.472  -4.400
  290   2HG2  THR  44          2HG2      THR  44  -1.135   8.563  -5.067
  291   3HG2  THR  44          3HG2      THR  44  -0.006   9.142  -3.843
  292    H    ALA  45           H        ALA  45  -2.031   9.483  -0.361
  293    HA   ALA  45           HA       ALA  45  -2.955   8.061   1.854
  294   1HB   ALA  45          1HB       ALA  45  -2.775  10.520   1.738
  295   2HB   ALA  45          2HB       ALA  45  -4.181  10.551   0.676
  296   3HB   ALA  45          3HB       ALA  45  -4.346   9.981   2.337
  297    H    ASN  46           H        ASN  46  -4.718   8.940  -1.115
  298    HA   ASN  46           HA       ASN  46  -6.763   6.959  -0.348
  299   1HB   ASN  46          1HB       ASN  46  -7.578   9.334  -0.640
  300   2HB   ASN  46          2HB       ASN  46  -7.107   9.225  -2.335
  301   1HD2  ASN  46          1HD2      ASN  46 -10.601   7.810  -1.073
  302   2HD2  ASN  46          2HD2      ASN  46  -9.511   8.699  -0.078
  303    H    TYR  47           H        TYR  47  -6.152   5.130  -1.254
  304    HA   TYR  47           HA       TYR  47  -4.689   5.053  -3.695
  305   1HB   TYR  47          1HB       TYR  47  -4.332   3.407  -1.908
  306   2HB   TYR  47          2HB       TYR  47  -5.952   2.762  -2.191
  307    HD1  TYR  47           1HD      TYR  47  -2.586   3.162  -3.669
  308    HD2  TYR  47           2HD      TYR  47  -6.387   1.283  -4.019
  309    HE1  TYR  47           1HE      TYR  47  -1.694   1.691  -5.421
  310    HE2  TYR  47           2HE      TYR  47  -5.496  -0.183  -5.770
  311    HH   TYR  47           HH       TYR  47  -2.843  -1.017  -6.288
  312    H    ASP  48           H        ASP  48  -8.093   4.598  -2.927
  313    HA   ASP  48           HA       ASP  48  -8.907   3.251  -5.197
  314   1HB   ASP  48          1HB       ASP  48 -10.285   5.229  -3.426
  315   2HB   ASP  48          2HB       ASP  48 -11.092   4.617  -4.863
  316    H    ASP  49           H        ASP  49  -8.225   6.683  -4.819
  317    HA   ASP  49           HA       ASP  49  -9.127   7.262  -7.511
  318   1HB   ASP  49          1HB       ASP  49  -8.077   8.933  -5.249
  319   2HB   ASP  49          2HB       ASP  49  -8.201   9.594  -6.875
  320    H    ASP  50           H        ASP  50  -6.062   7.857  -5.770
  321    HA   ASP  50           HA       ASP  50  -4.588   8.411  -8.108
  322   1HB   ASP  50          1HB       ASP  50  -3.713   7.690  -5.316
  323   2HB   ASP  50          2HB       ASP  50  -2.583   8.110  -6.598
  324    H    ARG  51           H        ARG  51  -5.092   5.417  -6.341
  325    HA   ARG  51           HA       ARG  51  -4.391   3.312  -6.638
  326   1HB   ARG  51          1HB       ARG  51  -4.731   4.077  -9.513
  327   2HB   ARG  51          2HB       ARG  51  -4.779   2.442  -8.861
  328   1HG   ARG  51          1HG       ARG  51  -6.538   3.748  -7.261
  329   2HG   ARG  51          2HG       ARG  51  -6.813   4.521  -8.830
  330   1HD   ARG  51          1HD       ARG  51  -6.756   1.551  -8.370
  331   2HD   ARG  51          2HD       ARG  51  -8.225   2.527  -8.334
  332    HE   ARG  51           HE       ARG  51  -6.877   1.582 -10.649
  333   1HH1  ARG  51          1HH1      ARG  51  -8.711   4.274  -9.382
  334   2HH1  ARG  51          2HH1      ARG  51  -9.218   4.847 -10.942
  335   1HH2  ARG  51          1HH2      ARG  51  -7.542   2.292 -12.712
  336   2HH2  ARG  51          2HH2      ARG  51  -8.539   3.716 -12.850
  337    H    LYS  52           H        LYS  52  -2.216   4.707  -6.040
  338    HA   LYS  52           HA       LYS  52  -0.186   3.539  -7.804
  339   1HB   LYS  52          1HB       LYS  52   0.010   6.021  -6.077
  340   2HB   LYS  52          2HB       LYS  52   1.383   5.280  -6.896
  341   1HG   LYS  52          1HG       LYS  52   0.629   5.881  -9.001
  342   2HG   LYS  52          2HG       LYS  52  -1.040   6.042  -8.466
  343   1HD   LYS  52          1HD       LYS  52  -0.252   8.232  -8.878
  344   2HD   LYS  52          2HD       LYS  52  -0.281   8.042  -7.122
  345   1HE   LYS  52          1HE       LYS  52   2.084   7.700  -7.055
  346   2HE   LYS  52          2HE       LYS  52   2.170   7.604  -8.816
  347   1HZ   LYS  52          1HZ       LYS  52   1.255  10.038  -7.371
  348   2HZ   LYS  52          2HZ       LYS  52   2.878   9.766  -7.798
  349   3HZ   LYS  52          3HZ       LYS  52   1.690   9.893  -9.006
  350    H    TRP  53           H        TRP  53   0.708   1.826  -6.938
  351    HA   TRP  53           HA       TRP  53   0.812   1.633  -4.001
  352   1HB   TRP  53          1HB       TRP  53   0.095  -0.666  -4.214
  353   2HB   TRP  53          2HB       TRP  53  -1.053   0.404  -4.938
  354    HD1  TRP  53           HD1      TRP  53  -0.697   0.598  -7.820
  355    HE1  TRP  53           1HE      TRP  53  -0.262  -1.395  -9.402
  356    HE3  TRP  53           3HE      TRP  53   0.996  -2.640  -4.383
  357    HZ2  TRP  53           2HZ      TRP  53   0.739  -4.056  -9.166
  358    HZ3  TRP  53           3HZ      TRP  53   1.718  -4.921  -5.096
  359    HH2  TRP  53           HH2      TRP  53   1.588  -5.593  -7.442
  360    H    GLY  54           H        GLY  54   1.998  -0.344  -3.311
  361   1HA   GLY  54          1HA       GLY  54   4.216  -1.297  -4.849
  362   2HA   GLY  54          2HA       GLY  54   4.698  -0.155  -3.594
  363    H    PHE  55           H        PHE  55   5.045  -3.191  -3.890
  364    HA   PHE  55           HA       PHE  55   3.439  -4.482  -2.010
  365   1HB   PHE  55          1HB       PHE  55   6.189  -5.047  -3.065
  366   2HB   PHE  55          2HB       PHE  55   5.453  -6.061  -1.838
  367    HD1  PHE  55           1HD      PHE  55   2.608  -5.788  -2.919
  368    HD2  PHE  55           2HD      PHE  55   6.314  -6.705  -4.798
  369    HE1  PHE  55           1HE      PHE  55   1.401  -7.109  -4.613
  370    HE2  PHE  55           2HE      PHE  55   5.107  -8.012  -6.510
  371    HZ   PHE  55           HZ       PHE  55   2.653  -8.210  -6.420
  372    H    CYS  56           H        CYS  56   4.029  -5.283   0.113
  373    HA   CYS  56           HA       CYS  56   4.773  -3.191   1.848
  374   1HB   CYS  56          1HB       CYS  56   3.306  -5.279   2.300
  375   2HB   CYS  56          2HB       CYS  56   4.833  -6.083   2.648
  376    HA   PRO  57           HA       PRO  57   9.177  -3.753   1.591
  377   1HB   PRO  57          1HB       PRO  57   9.945  -1.633   2.933
  378   2HB   PRO  57          2HB       PRO  57   9.089  -1.450   1.390
  379   1HG   PRO  57          1HG       PRO  57   7.985  -1.414   4.161
  380   2HG   PRO  57          2HG       PRO  57   7.764  -0.181   2.906
  381   1HD   PRO  57          1HD       PRO  57   5.921  -2.096   3.381
  382   2HD   PRO  57          2HD       PRO  57   6.244  -1.496   1.736
  383    H    ASP  58           H        ASP  58   7.372  -4.461   4.054
  384    HA   ASP  58           HA       ASP  58   9.638  -5.297   5.729
  385   1HB   ASP  58          1HB       ASP  58   8.454  -3.325   6.749
  386   2HB   ASP  58          2HB       ASP  58   7.008  -4.322   6.865
  387    H    GLN  59           H        GLN  59   9.588  -7.401   5.034
  388    HA   GLN  59           HA       GLN  59   7.252  -8.937   5.914
  389   1HB   GLN  59          1HB       GLN  59   8.641  -9.411   3.269
  390   2HB   GLN  59          2HB       GLN  59   7.268 -10.305   3.905
  391   1HG   GLN  59          1HG       GLN  59   6.021  -8.093   3.872
  392   2HG   GLN  59          2HG       GLN  59   7.358  -7.486   2.894
  393   1HE2  GLN  59          1HE2      GLN  59   4.394  -9.365   1.123
  394   2HE2  GLN  59          2HE2      GLN  59   4.356  -8.615   2.683
  395    H    GLY  60           H        GLY  60  10.008 -10.102   4.066
  396   1HA   GLY  60          1HA       GLY  60  12.012 -11.014   5.066
  397   2HA   GLY  60          2HA       GLY  60  11.074 -11.325   6.526
  Start of MODEL   50
    1    H    SER   1           1H       SER   1  16.646   2.066   7.162
    2    HA   SER   1           HA       SER   1  14.996   3.783   8.828
    3   1HB   SER   1          1HB       SER   1  16.720   4.208   6.373
    4   2HB   SER   1          2HB       SER   1  16.017   5.471   7.384
    5    HG   SER   1           HG       SER   1  18.176   5.112   7.984
    6    H    TRP   2           H        TRP   2  14.580   5.300   6.181
    7    HA   TRP   2           HA       TRP   2  11.966   4.259   5.675
    8   1HB   TRP   2          1HB       TRP   2  13.559   6.559   4.601
    9   2HB   TRP   2          2HB       TRP   2  12.099   6.052   3.761
   10    HD1  TRP   2           HD1      TRP   2  12.907   6.695   7.522
   11    HE1  TRP   2           1HE      TRP   2  10.999   8.126   8.491
   12    HE3  TRP   2           3HE      TRP   2  10.044   7.198   3.307
   13    HZ2  TRP   2           2HZ      TRP   2   8.609   9.326   7.584
   14    HZ3  TRP   2           3HZ      TRP   2   7.966   8.513   3.441
   15    HH2  TRP   2           HH2      TRP   2   7.266   9.552   5.539
   16    H    MET   3           H        MET   3  11.493   2.606   4.441
   17    HA   MET   3           HA       MET   3  13.332   1.847   2.273
   18   1HB   MET   3          1HB       MET   3  11.127   0.252   3.602
   19   2HB   MET   3          2HB       MET   3  12.245  -0.348   2.392
   20   1HG   MET   3          1HG       MET   3  13.342   0.788   4.912
   21   2HG   MET   3          2HG       MET   3  12.617  -0.821   4.942
   22   1HE   MET   3          1HE       MET   3  15.570   1.403   3.783
   23   2HE   MET   3          2HE       MET   3  16.433   0.378   2.630
   24   3HE   MET   3          3HE       MET   3  14.872   1.070   2.201
   25    H    SER   4           H        SER   4  12.499   1.357   0.196
   26    HA   SER   4           HA       SER   4  10.059   2.822  -0.442
   27   1HB   SER   4          1HB       SER   4  12.069   3.174  -1.846
   28   2HB   SER   4          2HB       SER   4  12.045   1.474  -2.301
   29    HG   SER   4           HG       SER   4   9.961   3.348  -2.812
   30    H    THR   5           H        THR   5   8.649   1.748  -2.155
   31    HA   THR   5           HA       THR   5   7.713  -0.727  -1.040
   32    HB   THR   5           HB       THR   5   5.953  -0.489  -2.827
   33    HG1  THR   5           1HG      THR   5   7.686   1.187  -3.840
   34   1HG2  THR   5          1HG2      THR   5   5.612   2.106  -1.777
   35   2HG2  THR   5          2HG2      THR   5   4.794   0.611  -1.326
   36   3HG2  THR   5          3HG2      THR   5   6.284   1.083  -0.507
   37    H    VAL   6           H        VAL   6   7.065  -2.515  -2.397
   38    HA   VAL   6           HA       VAL   6   9.041  -3.166  -4.501
   39    HB   VAL   6           HB       VAL   6   7.375  -5.381  -3.618
   40   1HG1  VAL   6          1HG1      VAL   6  10.254  -4.860  -4.072
   41   2HG1  VAL   6          2HG1      VAL   6   9.805  -6.261  -3.103
   42   3HG1  VAL   6          3HG1      VAL   6   9.200  -6.097  -4.755
   43   1HG2  VAL   6          1HG2      VAL   6   8.500  -3.717  -1.516
   44   2HG2  VAL   6          2HG2      VAL   6   7.300  -5.006  -1.431
   45   3HG2  VAL   6          3HG2      VAL   6   9.016  -5.404  -1.432
   46    H    GLY   7           H        GLY   7   7.597  -5.179  -5.692
   47   1HA   GLY   7          1HA       GLY   7   6.104  -5.322  -7.479
   48   2HA   GLY   7          2HA       GLY   7   4.973  -5.044  -6.191
   49    H    GLY   8           H        GLY   8   3.519  -3.712  -6.797
   50   1HA   GLY   8          1HA       GLY   8   2.452  -2.018  -7.960
   51   2HA   GLY   8          2HA       GLY   8   3.492  -1.106  -6.900
   52    H    ASN   9           H        ASN   9   3.888   0.619  -8.045
   53    HA   ASN   9           HA       ASN   9   5.809   0.538 -10.129
   54   1HB   ASN   9          1HB       ASN   9   4.449   1.618 -11.906
   55   2HB   ASN   9          2HB       ASN   9   3.975  -0.035 -11.582
   56   1HD2  ASN   9          1HD2      ASN   9   1.256   2.122  -9.683
   57   2HD2  ASN   9          2HD2      ASN   9   2.858   1.815  -9.113
   58    H    SER  10           H        SER  10   5.539   1.675  -7.603
   59    HA   SER  10           HA       SER  10   4.774   4.365  -7.556
   60   1HB   SER  10          1HB       SER  10   7.016   3.342  -5.860
   61   2HB   SER  10          2HB       SER  10   5.665   4.391  -5.416
   62    HG   SER  10           HG       SER  10   5.658   2.064  -4.714
   63    H    GLY  11           H        GLY  11   8.119   3.118  -7.509
   64   1HA   GLY  11          1HA       GLY  11   9.795   3.875  -9.060
   65   2HA   GLY  11          2HA       GLY  11   8.897   5.378  -9.229
   66    H    GLY  12           H        GLY  12  10.012   3.554  -6.389
   67   1HA   GLY  12          1HA       GLY  12  11.654   4.140  -4.843
   68   2HA   GLY  12          2HA       GLY  12  11.921   5.637  -5.728
   69    H    ALA  13           H        ALA  13   8.823   4.447  -4.545
   70    HA   ALA  13           HA       ALA  13   8.735   6.742  -2.691
   71   1HB   ALA  13          1HB       ALA  13   7.037   6.132  -4.882
   72   2HB   ALA  13          2HB       ALA  13   6.101   5.938  -3.399
   73   3HB   ALA  13          3HB       ALA  13   6.914   7.469  -3.738
   74    HA   PRO  14           HA       PRO  14   7.572   3.675   0.333
   75   1HB   PRO  14          1HB       PRO  14   7.164   5.330   2.406
   76   2HB   PRO  14          2HB       PRO  14   8.775   5.110   1.714
   77   1HG   PRO  14          1HG       PRO  14   6.938   7.413   1.503
   78   2HG   PRO  14          2HG       PRO  14   8.700   7.368   1.365
   79   1HD   PRO  14          1HD       PRO  14   6.768   7.418  -0.756
   80   2HD   PRO  14          2HD       PRO  14   8.535   7.345  -0.891
   81    H    CYS  15           H        CYS  15   5.748   3.349   2.018
   82    HA   CYS  15           HA       CYS  15   3.221   3.805   0.653
   83   1HB   CYS  15          1HB       CYS  15   3.342   2.586   3.382
   84   2HB   CYS  15          2HB       CYS  15   2.331   2.153   2.008
   85    H    VAL  16           H        VAL  16   1.520   5.071   1.451
   86    HA   VAL  16           HA       VAL  16   2.243   6.894   3.652
   87    HB   VAL  16           HB       VAL  16   0.217   7.324   1.444
   88   1HG1  VAL  16          1HG1      VAL  16  -0.373   8.426   3.581
   89   2HG1  VAL  16          2HG1      VAL  16   1.183   9.260   3.543
   90   3HG1  VAL  16          3HG1      VAL  16  -0.013   9.569   2.285
   91   1HG2  VAL  16          1HG2      VAL  16   3.013   7.651   1.420
   92   2HG2  VAL  16          2HG2      VAL  16   1.842   8.178   0.208
   93   3HG2  VAL  16          3HG2      VAL  16   2.308   9.264   1.520
   94    H    PHE  17           H        PHE  17   1.197   6.607   5.525
   95    HA   PHE  17           HA       PHE  17  -1.432   5.306   5.447
   96   1HB   PHE  17          1HB       PHE  17   0.772   5.073   7.496
   97   2HB   PHE  17          2HB       PHE  17  -0.843   4.411   7.686
   98    HD1  PHE  17           1HD      PHE  17  -1.613   2.936   5.564
   99    HD2  PHE  17           2HD      PHE  17   2.382   3.652   6.825
  100    HE1  PHE  17           1HE      PHE  17  -0.884   0.888   4.428
  101    HE2  PHE  17           2HE      PHE  17   3.129   1.610   5.693
  102    HZ   PHE  17           HZ       PHE  17   1.499   0.191   4.477
  103    HA   PRO  18           HA       PRO  18  -2.893   4.839   6.689
  104   1HB   PRO  18          1HB       PRO  18  -5.471   5.724   7.171
  105   2HB   PRO  18          2HB       PRO  18  -4.417   4.967   8.363
  106   1HG   PRO  18          1HG       PRO  18  -5.338   7.687   8.266
  107   2HG   PRO  18          2HG       PRO  18  -4.336   6.911   9.500
  108   1HD   PRO  18          1HD       PRO  18  -3.539   8.687   7.305
  109   2HD   PRO  18          2HD       PRO  18  -2.633   8.217   8.753
  110    H    PHE  19           H        PHE  19  -3.620   4.182   4.726
  111    HA   PHE  19           HA       PHE  19  -4.540   6.327   2.931
  112   1HB   PHE  19          1HB       PHE  19  -3.787   5.058   1.051
  113   2HB   PHE  19          2HB       PHE  19  -2.480   5.093   2.217
  114    HD1  PHE  19           1HD      PHE  19  -5.153   2.972   0.788
  115    HD2  PHE  19           2HD      PHE  19  -1.549   3.117   3.043
  116    HE1  PHE  19           1HE      PHE  19  -4.921   0.527   0.577
  117    HE2  PHE  19           2HE      PHE  19  -1.315   0.682   2.846
  118    HZ   PHE  19           HZ       PHE  19  -3.004  -0.618   1.597
  119    H    THR  20           H        THR  20  -6.051   5.292   1.117
  120    HA   THR  20           HA       THR  20  -7.973   3.552   2.509
  121    HB   THR  20           HB       THR  20  -8.609   6.044   0.894
  122    HG1  THR  20           1HG      THR  20  -7.900   6.368   3.094
  123   1HG2  THR  20          1HG2      THR  20 -10.551   4.250   2.314
  124   2HG2  THR  20          2HG2      THR  20 -10.918   5.723   1.413
  125   3HG2  THR  20          3HG2      THR  20 -10.313   4.298   0.567
  126    H    PHE  21           H        PHE  21  -8.478   1.833   1.412
  127    HA   PHE  21           HA       PHE  21  -8.284   1.881  -1.535
  128   1HB   PHE  21          1HB       PHE  21  -6.453   0.521  -0.345
  129   2HB   PHE  21          2HB       PHE  21  -7.738  -0.530   0.206
  130    HD1  PHE  21           1HD      PHE  21  -6.519   0.938  -2.993
  131    HD2  PHE  21           2HD      PHE  21  -8.184  -2.422  -1.002
  132    HE1  PHE  21           1HE      PHE  21  -6.271  -0.383  -5.034
  133    HE2  PHE  21           2HE      PHE  21  -7.942  -3.749  -3.043
  134    HZ   PHE  21           HZ       PHE  21  -6.990  -2.736  -5.078
  135    H    LEU  22           H        LEU  22  -9.940   0.936  -2.558
  136    HA   LEU  22           HA       LEU  22 -12.129   0.465  -2.856
  137   1HB   LEU  22          1HB       LEU  22 -10.554  -1.689  -1.629
  138   2HB   LEU  22          2HB       LEU  22 -12.223  -2.014  -2.060
  139    HG   LEU  22           HG       LEU  22 -10.510  -2.630  -3.792
  140   1HD1  LEU  22          1HD1      LEU  22 -12.988  -1.834  -4.024
  141   2HD1  LEU  22          2HD1      LEU  22 -12.202  -0.530  -4.917
  142   3HD1  LEU  22          3HD1      LEU  22 -11.982  -2.205  -5.429
  143   1HD2  LEU  22          1HD2      LEU  22  -9.335  -0.311  -3.371
  144   2HD2  LEU  22          2HD2      LEU  22  -9.295  -1.123  -4.937
  145   3HD2  LEU  22          3HD2      LEU  22 -10.450   0.178  -4.649
  146    H    GLY  23           H        GLY  23 -12.180   2.133  -0.769
  147   1HA   GLY  23          1HA       GLY  23 -13.913   2.843   0.614
  148   2HA   GLY  23          2HA       GLY  23 -14.551   1.214   0.613
  149    H    ASN  24           H        ASN  24 -11.430   0.679   1.568
  150    HA   ASN  24           HA       ASN  24 -12.233   0.990   4.396
  151   1HB   ASN  24          1HB       ASN  24 -10.205  -0.893   3.177
  152   2HB   ASN  24          2HB       ASN  24 -10.670  -0.826   4.866
  153   1HD2  ASN  24          1HD2      ASN  24 -12.765  -2.968   2.236
  154   2HD2  ASN  24          2HD2      ASN  24 -11.272  -2.175   1.874
  155    H    LYS  25           H        LYS  25 -10.609   1.545   5.955
  156    HA   LYS  25           HA       LYS  25  -8.614   3.384   4.933
  157   1HB   LYS  25          1HB       LYS  25  -9.543   2.839   7.759
  158   2HB   LYS  25          2HB       LYS  25  -8.603   4.193   7.201
  159   1HG   LYS  25          1HG       LYS  25 -11.454   3.623   6.468
  160   2HG   LYS  25          2HG       LYS  25 -10.898   4.865   7.594
  161   1HD   LYS  25          1HD       LYS  25  -9.865   6.109   5.850
  162   2HD   LYS  25          2HD       LYS  25 -10.047   4.780   4.705
  163   1HE   LYS  25          1HE       LYS  25 -11.675   6.621   4.363
  164   2HE   LYS  25          2HE       LYS  25 -12.430   5.057   4.662
  165   1HZ   LYS  25          1HZ       LYS  25 -11.971   7.023   6.837
  166   2HZ   LYS  25          2HZ       LYS  25 -13.374   7.061   5.880
  167   3HZ   LYS  25          3HZ       LYS  25 -13.025   5.686   6.826
  168    H    TYR  26           H        TYR  26  -6.471   2.717   4.884
  169    HA   TYR  26           HA       TYR  26  -5.831   0.287   6.405
  170   1HB   TYR  26          1HB       TYR  26  -4.635   1.344   3.843
  171   2HB   TYR  26          2HB       TYR  26  -4.106  -0.106   4.688
  172    HD1  TYR  26           1HD      TYR  26  -7.124   1.415   3.101
  173    HD2  TYR  26           2HD      TYR  26  -5.091  -2.147   4.186
  174    HE1  TYR  26           1HE      TYR  26  -8.796   0.097   1.900
  175    HE2  TYR  26           2HE      TYR  26  -6.742  -3.473   2.978
  176    HH   TYR  26           HH       TYR  26  -8.850  -3.416   2.073
  177    H    GLU  27           H        GLU  27  -4.578   0.504   8.006
  178    HA   GLU  27           HA       GLU  27  -2.862   2.841   8.301
  179   1HB   GLU  27          1HB       GLU  27  -3.657   0.687  10.251
  180   2HB   GLU  27          2HB       GLU  27  -2.728   2.111  10.632
  181   1HG   GLU  27          1HG       GLU  27  -4.618   3.528  10.068
  182   2HG   GLU  27          2HG       GLU  27  -5.560   2.100   9.648
  183    H    SER  28           H        SER  28  -2.775  -0.500   7.616
  184    HA   SER  28           HA       SER  28   0.150  -0.467   7.715
  185   1HB   SER  28          1HB       SER  28  -0.054  -2.935   8.253
  186   2HB   SER  28          2HB       SER  28  -0.493  -1.852   9.556
  187    HG   SER  28           HG       SER  28  -2.008  -3.674   8.191
  188    H    CYS  29           H        CYS  29   0.730  -2.782   6.409
  189    HA   CYS  29           HA       CYS  29  -0.074  -2.182   3.750
  190   1HB   CYS  29          1HB       CYS  29   1.332  -4.623   4.821
  191   2HB   CYS  29          2HB       CYS  29   1.149  -4.228   3.128
  192    H    THR  30           H        THR  30  -1.054  -3.812   2.314
  193    HA   THR  30           HA       THR  30  -3.048  -5.507   3.645
  194    HB   THR  30           HB       THR  30  -4.118  -3.283   3.230
  195    HG1  THR  30           1HG      THR  30  -5.599  -4.811   3.101
  196   1HG2  THR  30          1HG2      THR  30  -4.641  -2.728   0.859
  197   2HG2  THR  30          2HG2      THR  30  -2.957  -2.479   1.310
  198   3HG2  THR  30          3HG2      THR  30  -3.414  -3.895   0.365
  199    H    SER  31           H        SER  31  -4.152  -6.924   2.093
  200    HA   SER  31           HA       SER  31  -2.497  -7.470  -0.272
  201   1HB   SER  31          1HB       SER  31  -3.274  -9.869  -0.006
  202   2HB   SER  31          2HB       SER  31  -2.195  -9.294   1.273
  203    HG   SER  31           HG       SER  31  -3.725  -9.940   2.560
  204    H    ALA  32           H        ALA  32  -4.816  -5.758   0.373
  205    HA   ALA  32           HA       ALA  32  -7.229  -6.679  -0.654
  206   1HB   ALA  32          1HB       ALA  32  -6.286  -4.325   0.453
  207   2HB   ALA  32          2HB       ALA  32  -6.705  -3.856  -1.194
  208   3HB   ALA  32          3HB       ALA  32  -7.924  -4.592  -0.156
  209    H    GLY  33           H        GLY  33  -8.196  -6.646  -2.606
  210   1HA   GLY  33          1HA       GLY  33  -8.433  -6.497  -4.886
  211   2HA   GLY  33          2HA       GLY  33  -7.050  -5.414  -4.908
  212    H    ARG  34           H        ARG  34  -5.824  -7.963  -3.353
  213    HA   ARG  34           HA       ARG  34  -4.834  -9.084  -5.866
  214   1HB   ARG  34          1HB       ARG  34  -3.680  -9.449  -3.105
  215   2HB   ARG  34          2HB       ARG  34  -2.919  -9.813  -4.635
  216   1HG   ARG  34          1HG       ARG  34  -3.275  -7.243  -5.063
  217   2HG   ARG  34          2HG       ARG  34  -3.308  -7.199  -3.301
  218   1HD   ARG  34          1HD       ARG  34  -1.049  -6.819  -4.241
  219   2HD   ARG  34          2HD       ARG  34  -1.130  -8.233  -3.182
  220    HE   ARG  34           HE       ARG  34  -0.589  -9.554  -4.970
  221   1HH1  ARG  34          1HH1      ARG  34  -1.643  -6.420  -6.165
  222   2HH1  ARG  34          2HH1      ARG  34  -1.280  -6.785  -7.825
  223   1HH2  ARG  34          1HH2      ARG  34  -0.113 -10.036  -7.156
  224   2HH2  ARG  34          2HH2      ARG  34  -0.370  -8.829  -8.380
  225    H    SER  35           H        SER  35  -4.731 -11.286  -6.233
  226    HA   SER  35           HA       SER  35  -6.546 -12.892  -4.565
  227   1HB   SER  35          1HB       SER  35  -7.236 -12.512  -6.941
  228   2HB   SER  35          2HB       SER  35  -5.769 -13.344  -7.462
  229    HG   SER  35           HG       SER  35  -6.527 -15.230  -6.608
  230    H    ASP  36           H        ASP  36  -3.334 -12.392  -5.190
  231    HA   ASP  36           HA       ASP  36  -2.513 -15.167  -5.058
  232   1HB   ASP  36          1HB       ASP  36  -0.176 -13.925  -4.877
  233   2HB   ASP  36          2HB       ASP  36  -1.000 -14.122  -6.411
  234    H    GLY  37           H        GLY  37  -1.128 -12.501  -3.305
  235   1HA   GLY  37          1HA       GLY  37  -2.016 -13.014  -0.765
  236   2HA   GLY  37          2HA       GLY  37  -0.657 -14.099  -0.992
  237    H    LYS  38           H        LYS  38   0.638 -12.071  -2.810
  238    HA   LYS  38           HA       LYS  38   2.379 -10.891  -1.041
  239   1HB   LYS  38          1HB       LYS  38   1.541  -9.997  -3.803
  240   2HB   LYS  38          2HB       LYS  38   2.968  -9.417  -2.960
  241   1HG   LYS  38          1HG       LYS  38   3.651 -11.058  -4.514
  242   2HG   LYS  38          2HG       LYS  38   3.802 -11.762  -2.915
  243   1HD   LYS  38          1HD       LYS  38   1.745 -13.005  -3.262
  244   2HD   LYS  38          2HD       LYS  38   1.526 -12.240  -4.841
  245   1HE   LYS  38          1HE       LYS  38   2.516 -14.573  -4.848
  246   2HE   LYS  38          2HE       LYS  38   3.417 -13.342  -5.735
  247   1HZ   LYS  38          1HZ       LYS  38   4.060 -13.971  -2.917
  248   2HZ   LYS  38          2HZ       LYS  38   4.717 -14.890  -4.188
  249   3HZ   LYS  38          3HZ       LYS  38   5.040 -13.225  -4.087
  250    H    MET  39           H        MET  39   2.037  -9.350   0.457
  251    HA   MET  39           HA       MET  39  -0.280  -7.637   0.214
  252   1HB   MET  39          1HB       MET  39   1.862  -7.591   2.359
  253   2HB   MET  39          2HB       MET  39   0.265  -6.869   2.429
  254   1HG   MET  39          1HG       MET  39  -0.694  -9.168   2.247
  255   2HG   MET  39          2HG       MET  39   0.948  -9.780   2.441
  256   1HE   MET  39          1HE       MET  39   2.213  -7.723   4.265
  257   2HE   MET  39          2HE       MET  39   1.814  -8.076   5.950
  258   3HE   MET  39          3HE       MET  39   2.389  -9.362   4.889
  259    H    TRP  40           H        TRP  40  -0.260  -5.451  -0.037
  260    HA   TRP  40           HA       TRP  40   2.301  -4.196  -0.758
  261   1HB   TRP  40          1HB       TRP  40   1.087  -2.951  -2.530
  262   2HB   TRP  40          2HB       TRP  40   1.104  -4.687  -2.828
  263    HD1  TRP  40           HD1      TRP  40  -1.318  -5.972  -1.979
  264    HE1  TRP  40           1HE      TRP  40  -3.725  -5.095  -2.231
  265    HE3  TRP  40           3HE      TRP  40  -0.302  -1.029  -2.713
  266    HZ2  TRP  40           2HZ      TRP  40  -5.015  -2.633  -2.647
  267    HZ3  TRP  40           3HZ      TRP  40  -2.182   0.530  -3.000
  268    HH2  TRP  40           HH2      TRP  40  -4.482  -0.257  -2.974
  269    H    CYS  41           H        CYS  41   1.374  -1.671  -1.268
  270    HA   CYS  41           HA       CYS  41  -0.328  -0.707   0.838
  271   1HB   CYS  41          1HB       CYS  41   1.483   0.759   1.817
  272   2HB   CYS  41          2HB       CYS  41   1.666  -0.957   2.177
  273    H    ALA  42           H        ALA  42  -0.979   1.463   0.425
  274    HA   ALA  42           HA       ALA  42  -0.509   2.330  -2.282
  275   1HB   ALA  42          1HB       ALA  42  -2.504   2.790  -0.329
  276   2HB   ALA  42          2HB       ALA  42  -1.806   4.354  -0.752
  277   3HB   ALA  42          3HB       ALA  42  -2.480   3.320  -2.012
  278    H    THR  43           H        THR  43   0.651   4.120  -2.929
  279    HA   THR  43           HA       THR  43   2.576   5.068  -0.954
  280    HB   THR  43           HB       THR  43   3.867   5.829  -2.901
  281    HG1  THR  43           1HG      THR  43   2.669   6.253  -4.598
  282   1HG2  THR  43          1HG2      THR  43   3.176   3.158  -3.860
  283   2HG2  THR  43          2HG2      THR  43   4.707   3.794  -3.255
  284   3HG2  THR  43          3HG2      THR  43   3.473   3.244  -2.123
  285    H    THR  44           H        THR  44  -0.303   5.930  -1.425
  286    HA   THR  44           HA       THR  44   0.227   8.790  -1.209
  287    HB   THR  44           HB       THR  44  -1.813   9.243  -2.589
  288    HG1  THR  44           1HG      THR  44  -2.968   7.647  -3.277
  289   1HG2  THR  44          1HG2      THR  44   0.230   7.701  -4.163
  290   2HG2  THR  44          2HG2      THR  44  -0.824   8.994  -4.736
  291   3HG2  THR  44          3HG2      THR  44   0.467   9.351  -3.588
  292    H    ALA  45           H        ALA  45  -1.597   9.944  -0.177
  293    HA   ALA  45           HA       ALA  45  -2.489   8.580   2.129
  294   1HB   ALA  45          1HB       ALA  45  -3.332  11.226   0.956
  295   2HB   ALA  45          2HB       ALA  45  -3.870  10.628   2.525
  296   3HB   ALA  45          3HB       ALA  45  -2.157  10.942   2.242
  297    H    ASN  46           H        ASN  46  -3.950   9.112  -0.991
  298    HA   ASN  46           HA       ASN  46  -6.192   7.426  -0.139
  299   1HB   ASN  46          1HB       ASN  46  -6.943   9.812  -0.264
  300   2HB   ASN  46          2HB       ASN  46  -6.481   9.834  -1.961
  301   1HD2  ASN  46          1HD2      ASN  46 -10.026   8.443  -0.831
  302   2HD2  ASN  46          2HD2      ASN  46  -8.924   9.232   0.230
  303    H    TYR  47           H        TYR  47  -6.072   5.625  -1.278
  304    HA   TYR  47           HA       TYR  47  -4.569   5.513  -3.731
  305   1HB   TYR  47          1HB       TYR  47  -4.562   3.697  -1.989
  306   2HB   TYR  47          2HB       TYR  47  -6.210   3.311  -2.480
  307    HD1  TYR  47           1HD      TYR  47  -2.684   3.218  -3.454
  308    HD2  TYR  47           2HD      TYR  47  -6.656   2.259  -4.616
  309    HE1  TYR  47           1HE      TYR  47  -1.810   1.769  -5.231
  310    HE2  TYR  47           2HE      TYR  47  -5.794   0.804  -6.390
  311    HH   TYR  47           HH       TYR  47  -3.970   0.265  -7.594
  312    H    ASP  48           H        ASP  48  -7.963   5.291  -2.784
  313    HA   ASP  48           HA       ASP  48  -9.177   4.361  -5.040
  314   1HB   ASP  48          1HB       ASP  48 -10.033   6.480  -3.087
  315   2HB   ASP  48          2HB       ASP  48 -11.069   6.001  -4.427
  316    H    ASP  49           H        ASP  49  -7.891   7.589  -4.535
  317    HA   ASP  49           HA       ASP  49  -8.813   8.454  -7.161
  318   1HB   ASP  49          1HB       ASP  49  -7.600   9.861  -4.806
  319   2HB   ASP  49          2HB       ASP  49  -7.675  10.636  -6.382
  320    H    ASP  50           H        ASP  50  -5.720   8.452  -5.377
  321    HA   ASP  50           HA       ASP  50  -4.164   9.135  -7.627
  322   1HB   ASP  50          1HB       ASP  50  -3.439   7.950  -4.957
  323   2HB   ASP  50          2HB       ASP  50  -2.232   8.323  -6.183
  324    H    ARG  51           H        ARG  51  -4.828   5.976  -6.155
  325    HA   ARG  51           HA       ARG  51  -4.492   3.877  -6.824
  326   1HB   ARG  51          1HB       ARG  51  -4.746   5.189  -9.501
  327   2HB   ARG  51          2HB       ARG  51  -4.765   3.449  -9.245
  328   1HG   ARG  51          1HG       ARG  51  -6.526   4.640  -7.406
  329   2HG   ARG  51          2HG       ARG  51  -6.909   5.267  -9.016
  330   1HD   ARG  51          1HD       ARG  51  -6.640   2.383  -8.218
  331   2HD   ARG  51          2HD       ARG  51  -8.159   3.244  -8.477
  332    HE   ARG  51           HE       ARG  51  -6.666   3.530 -10.801
  333   1HH1  ARG  51          1HH1      ARG  51  -8.119   0.918  -8.987
  334   2HH1  ARG  51          2HH1      ARG  51  -8.398  -0.063 -10.388
  335   1HH2  ARG  51          1HH2      ARG  51  -6.903   2.225 -12.611
  336   2HH2  ARG  51          2HH2      ARG  51  -7.658   0.667 -12.473
  337    H    LYS  52           H        LYS  52  -2.127   5.108  -6.118
  338    HA   LYS  52           HA       LYS  52  -0.240   3.796  -7.933
  339   1HB   LYS  52          1HB       LYS  52   0.185   6.212  -6.159
  340   2HB   LYS  52          2HB       LYS  52   1.512   5.307  -6.881
  341   1HG   LYS  52          1HG       LYS  52   1.319   6.627  -8.659
  342   2HG   LYS  52          2HG       LYS  52  -0.205   5.807  -8.996
  343   1HD   LYS  52          1HD       LYS  52  -0.717   8.089  -9.031
  344   2HD   LYS  52          2HD       LYS  52  -1.288   7.510  -7.465
  345   1HE   LYS  52          1HE       LYS  52   0.642   8.433  -6.369
  346   2HE   LYS  52          2HE       LYS  52   1.372   8.859  -7.917
  347   1HZ   LYS  52          1HZ       LYS  52  -0.803  10.216  -8.224
  348   2HZ   LYS  52          2HZ       LYS  52  -0.899  10.132  -6.530
  349   3HZ   LYS  52          3HZ       LYS  52   0.450  10.851  -7.265
  350    H    TRP  53           H        TRP  53   0.621   2.025  -7.140
  351    HA   TRP  53           HA       TRP  53   0.648   1.672  -4.224
  352   1HB   TRP  53          1HB       TRP  53  -0.233  -0.541  -4.505
  353   2HB   TRP  53          2HB       TRP  53  -1.276   0.584  -5.282
  354    HD1  TRP  53           HD1      TRP  53  -0.745   0.778  -8.153
  355    HE1  TRP  53           1HE      TRP  53  -0.299  -1.225  -9.724
  356    HE3  TRP  53           3HE      TRP  53   0.514  -2.599  -4.652
  357    HZ2  TRP  53           2HZ      TRP  53   0.477  -3.955  -9.450
  358    HZ3  TRP  53           3HZ      TRP  53   1.111  -4.915  -5.329
  359    HH2  TRP  53           HH2      TRP  53   1.091  -5.567  -7.695
  360    H    GLY  54           H        GLY  54   1.784  -0.282  -3.559
  361   1HA   GLY  54          1HA       GLY  54   3.928  -1.344  -5.135
  362   2HA   GLY  54          2HA       GLY  54   4.484  -0.183  -3.931
  363    H    PHE  55           H        PHE  55   4.748  -3.222  -4.151
  364    HA   PHE  55           HA       PHE  55   3.177  -4.442  -2.177
  365   1HB   PHE  55          1HB       PHE  55   5.914  -5.084  -3.252
  366   2HB   PHE  55          2HB       PHE  55   5.133  -6.065  -2.043
  367    HD1  PHE  55           1HD      PHE  55   2.318  -5.587  -3.351
  368    HD2  PHE  55           2HD      PHE  55   6.089  -6.916  -4.792
  369    HE1  PHE  55           1HE      PHE  55   1.176  -6.929  -5.073
  370    HE2  PHE  55           2HE      PHE  55   4.956  -8.249  -6.529
  371    HZ   PHE  55           HZ       PHE  55   2.494  -8.251  -6.668
  372    H    CYS  56           H        CYS  56   3.793  -5.161  -0.053
  373    HA   CYS  56           HA       CYS  56   4.913  -3.099   1.570
  374   1HB   CYS  56          1HB       CYS  56   3.168  -5.004   2.151
  375   2HB   CYS  56          2HB       CYS  56   4.612  -5.948   2.497
  376    HA   PRO  57           HA       PRO  57   9.080  -4.490   0.820
  377   1HB   PRO  57          1HB       PRO  57  10.438  -2.643   2.091
  378   2HB   PRO  57          2HB       PRO  57   9.416  -2.184   0.715
  379   1HG   PRO  57          1HG       PRO  57   8.744  -2.189   3.614
  380   2HG   PRO  57          2HG       PRO  57   8.653  -0.804   2.504
  381   1HD   PRO  57          1HD       PRO  57   6.474  -2.281   3.063
  382   2HD   PRO  57          2HD       PRO  57   6.761  -1.682   1.410
  383    H    ASP  58           H        ASP  58  11.144  -4.192   2.522
  384    HA   ASP  58           HA       ASP  58  12.320  -5.579   3.904
  385   1HB   ASP  58          1HB       ASP  58  11.716  -3.576   5.205
  386   2HB   ASP  58          2HB       ASP  58  10.305  -4.428   5.821
  387    H    GLN  59           H        GLN  59  11.194  -7.453   2.690
  388    HA   GLN  59           HA       GLN  59   9.691  -9.072   4.629
  389   1HB   GLN  59          1HB       GLN  59   9.818  -9.278   1.616
  390   2HB   GLN  59          2HB       GLN  59   9.027 -10.461   2.645
  391   1HG   GLN  59          1HG       GLN  59   7.596  -8.553   3.495
  392   2HG   GLN  59          2HG       GLN  59   8.255  -7.602   2.163
  393   1HE2  GLN  59          1HE2      GLN  59   5.845  -8.791  -0.002
  394   2HE2  GLN  59          2HE2      GLN  59   6.853  -7.499   0.548
  395    H    GLY  60           H        GLY  60  10.825 -10.565   5.637
  396   1HA   GLY  60          1HA       GLY  60  12.468 -12.439   4.304
  397   2HA   GLY  60          2HA       GLY  60  13.470 -11.222   5.079