*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   18-MAR-02   1L7Y              
*TITLE     SOLUTION NMR STRUCTURE OF C. ELEGANS PROTEIN ZK652.3.                 
*TITLE    2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET WR41.                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HYPOTHETICAL PROTEIN ZK652.3;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CAENORHABDITIS ELEGANS;                         
*SOURCE   3 GENE: ZK652.3;                                                       
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET15B                                    
*KEYWDS    C.ELEGANS, UNKNOWN FUNCTION, NORTHEAST STRUCTURAL GENOMICS            
*KEYWDS   2 CONSORTIUM, ZK652.3, UBIQUITIN FOLD, BETA-GRASP FOLD, NESG,          
*KEYWDS   3 STRUCTURAL GENOMICS, STRUCTURAL PROTEOMICS, HYPOTHETICAL             
*EXPDTA    NMR, 24 STRUCTURES                                                    
*AUTHOR    J.R.CORT, Y.CHIANG, D.ZHENG, G.T.MONTELIONE, M.A.KENNEDY              
*REVDAT   1   14-AUG-02 1L7Y    0                                                
remarks  a-helix H-bond constraints (slow exchangers only)
assign (resid   38 and  name O    )(resid   42 and  name HN   ) 1.8 0.0 0.5
assign (resid   38 and  name O    )(resid   42 and  name N    ) 2.8 0.0 0.5
assign (resid   39 and  name O    )(resid   43 and  name HN   ) 1.8 0.0 0.5
assign (resid   39 and  name O    )(resid   43 and  name N    ) 2.8 0.0 0.5
assign (resid   40 and  name O    )(resid   44 and  name HN   ) 1.8 0.0 0.5
assign (resid   40 and  name O    )(resid   44 and  name N    ) 2.8 0.0 0.5
assign (resid   41 and  name O    )(resid   45 and  name HN   ) 1.8 0.0 0.5
assign (resid   41 and  name O    )(resid   45 and  name N    ) 2.8 0.0 0.5
assign (resid   42 and  name O    )(resid   46 and  name HN   ) 1.8 0.0 0.5
assign (resid   42 and  name O    )(resid   46 and  name N    ) 2.8 0.0 0.5
assign (resid   43 and  name O    )(resid   47 and  name HN   ) 1.8 0.0 0.5
assign (resid   43 and  name O    )(resid   47 and  name N    ) 2.8 0.0 0.5
assign (resid   44 and  name O    )(resid   48 and  name HN   ) 1.8 0.0 0.5
assign (resid   44 and  name O    )(resid   48 and  name N    ) 2.8 0.0 0.5
assign (resid   46 and  name O    )(resid   50 and  name HN   ) 1.8 0.0 0.5
assign (resid   46 and  name O    )(resid   50 and  name N    ) 2.8 0.0 0.5
assign (resid   72 and  name O    )(resid   76 and  name HN   ) 1.8 0.0 0.5
assign (resid   72 and  name O    )(resid   76 and  name N    ) 2.8 0.0 0.5
assign (resid   73 and  name O    )(resid   77 and  name HN   ) 1.8 0.0 0.5
assign (resid   73 and  name O    )(resid   77 and  name N    ) 2.8 0.0 0.5
assign (resid   74 and  name O    )(resid   78 and  name HN   ) 1.8 0.0 0.5
assign (resid   74 and  name O    )(resid   78 and  name N    ) 2.8 0.0 0.5

remarks  B-sheet H-bond constraints (slow exchangers only)
assign (resid   14 and  name O    )(resid   33 and  name HN   ) 1.8 0.0 0.5
assign (resid   14 and  name O    )(resid   33 and  name N    ) 2.8 0.0 0.5
assign (resid   16 and  name O    )(resid   31 and  name HN   ) 1.8 0.0 0.5
assign (resid   16 and  name O    )(resid   31 and  name N    ) 2.8 0.0 0.5
assign (resid   17 and  name O    )(resid   84 and  name HN   ) 1.8 0.0 0.5
assign (resid   17 and  name O    )(resid   84 and  name N    ) 2.8 0.0 0.5
assign (resid   18 and  name O    )(resid   29 and  name HN   ) 1.8 0.0 0.5
assign (resid   18 and  name O    )(resid   29 and  name N    ) 2.8 0.0 0.5
assign (resid   29 and  name O    )(resid   18 and  name HN   ) 1.8 0.0 0.5
assign (resid   29 and  name O    )(resid   18 and  name N    ) 2.8 0.0 0.5
assign (resid   33 and  name O    )(resid   14 and  name HN   ) 1.8 0.0 0.5
assign (resid   33 and  name O    )(resid   14 and  name N    ) 2.8 0.0 0.5
assign (resid   58 and  name O    )(resid   87 and  name HN   ) 1.8 0.0 0.5
assign (resid   58 and  name O    )(resid   87 and  name N    ) 2.8 0.0 0.5
assign (resid   85 and  name O    )(resid   60 and  name HN   ) 1.8 0.0 0.5
assign (resid   85 and  name O    )(resid   60 and  name N    ) 2.8 0.0 0.5
assign (resid   65 and  name O    )(resid   61 and  name HN   ) 1.8 0.0 0.5
assign (resid   65 and  name O    )(resid   61 and  name N    ) 2.8 0.0 0.5
assign (resid   67 and  name O    )(resid   59 and  name HN   ) 1.8 0.0 0.5
assign (resid   67 and  name O    )(resid   59 and  name N    ) 2.8 0.0 0.5
assign (resid   87 and  name O    )(resid   58 and  name HN   ) 1.8 0.0 0.5
assign (resid   87 and  name O    )(resid   58 and  name N    ) 2.8 0.0 0.5

remarks other H-bonds (slow exchangers only)
assign (resid   37 and  name O    )(resid   73 and  name HN   ) 1.8 0.0 0.5
assign (resid   37 and  name O    )(resid   73 and  name N    ) 2.8 0.0 0.5
assign (resid   34 and  name O    )(resid   37 and  name HN   ) 1.8 0.0 0.5
assign (resid   34 and  name O    )(resid   37 and  name N    ) 2.8 0.0 0.5
assign (resid   47 and  name O    )(resid   52 and  name HN   ) 1.8 0.0 0.5
assign (resid   47 and  name O    )(resid   52 and  name N    ) 2.8 0.0 0.5

remarks  Ni-Ni+1
assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 1.8 0.0 1.7
assign (resid   35 and  name HN   )(resid   36 and  name HN   ) 1.8 0.0 2.2
assign (resid   39 and  name HN   )(resid   40 and  name HN   ) 1.8 0.0 1.2
assign (resid   40 and  name HN   )(resid   41 and  name HN   ) 1.8 0.0 1.2
assign (resid   41 and  name HN   )(resid   42 and  name HN   ) 1.8 0.0 1.2
assign (resid   42 and  name HN   )(resid   43 and  name HN   ) 1.8 0.0 1.2
assign (resid   43 and  name HN   )(resid   44 and  name HN   ) 1.8 0.0 1.2
assign (resid   44 and  name HN   )(resid   45 and  name HN   ) 1.8 0.0 1.2
assign (resid   45 and  name HN   )(resid   46 and  name HN   ) 1.8 0.0 1.2
assign (resid   46 and  name HN   )(resid   47 and  name HN   ) 1.8 0.0 1.2
assign (resid   47 and  name HN   )(resid   48 and  name HN   ) 1.8 0.0 1.2
assign (resid   48 and  name HN   )(resid   49 and  name HN   ) 1.8 0.0 1.2
assign (resid   50 and  name HN   )(resid   51 and  name HN   ) 1.8 0.0 1.2
assign (resid   51 and  name HN   )(resid   52 and  name HN   ) 1.8 0.0 1.2
assign (resid   55 and  name HN   )(resid   56 and  name HN   ) 1.8 0.0 2.2
assign (resid   56 and  name HN   )(resid   57 and  name HN   ) 1.8 0.0 1.2
assign (resid   64 and  name HN   )(resid   65 and  name HN   ) 1.8 0.0 1.2
assign (resid   66 and  name HN   )(resid   67 and  name HN   ) 1.8 0.0 2.2
assign (resid   70 and  name HN   )(resid   71 and  name HN   ) 1.8 0.0 1.2
assign (resid   73 and  name HN   )(resid   74 and  name HN   ) 1.8 0.0 1.7
assign (resid   74 and  name HN   )(resid   75 and  name HN   ) 1.8 0.0 1.2
assign (resid   75 and  name HN   )(resid   76 and  name HN   ) 1.8 0.0 1.2
assign (resid   76 and  name HN   )(resid   77 and  name HN   ) 1.8 0.0 1.2
assign (resid   77 and  name HN   )(resid   78 and  name HN   ) 1.8 0.0 1.2
assign (resid   78 and  name HN   )(resid   79 and  name HN   ) 1.8 0.0 1.2
assign (resid   79 and  name HN   )(resid   80 and  name HN   ) 1.8 0.0 1.2
assign (resid   80 and  name HN   )(resid   81 and  name HN   ) 1.8 0.0 1.2
assign (resid   82 and  name HN   )(resid   83 and  name HN   ) 1.8 0.0 1.2

remarks Ni-Ni+n
assign (resid   14 and  name HN   )(resid   33 and  name HN   ) 1.8 0.0 2.7
assign (resid   17 and  name HN   )(resid   84 and  name HN   ) 1.8 0.0 2.7
assign (resid   18 and  name HN   )(resid   29 and  name HN   ) 1.8 0.0 2.7
assign (resid   19 and  name HN   )(resid   86 and  name HN   ) 1.8 0.0 2.7
assign (resid   19 and  name HN   )(resid   84 and  name HN   ) 1.8 0.0 3.2
assign (resid   21 and  name HN   )(resid   86 and  name HN   ) 1.8 0.0 3.2
assign (resid   39 and  name HN   )(resid   71 and  name HN   ) 1.8 0.0 2.7
assign (resid   39 and  name HN   )(resid   73 and  name HN   ) 1.8 0.0 3.2
assign (resid   58 and  name HN   )(resid   87 and  name HN   ) 1.8 0.0 2.2
assign (resid   58 and  name HN   )(resid   89 and  name HN   ) 1.8 0.0 3.2
assign (resid   60 and  name HN   )(resid   85 and  name HN   ) 1.8 0.0 3.2
assign (resid   61 and  name HN   )(resid   64 and  name HN   ) 1.8 0.0 3.2
assign (resid   61 and  name HN   )(resid   65 and  name HN   ) 1.8 0.0 2.2

remarks ai-Ni+1
assign (resid   13 and  name HA   )(resid   14 and  name HN   ) 1.8 0.0 0.7
assign (resid   14 and  name HA   )(resid   15 and  name HN   ) 1.8 0.0 0.7
assign (resid   15 and  name HA   )(resid   16 and  name HN   ) 1.8 0.0 0.7
assign (resid   16 and  name HA   )(resid   17 and  name HN   ) 1.8 0.0 0.7
assign (resid   17 and  name HA   )(resid   18 and  name HN   ) 1.8 0.0 0.7
assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 1.8 0.0 0.7
assign (resid   19 and  name HA   )(resid   20 and  name HN   ) 1.8 0.0 0.7
assign (resid   20 and  name HA   )(resid   21 and  name HN   ) 1.8 0.0 1.2
assign (resid   29 and  name HA   )(resid   30 and  name HN   ) 1.8 0.0 0.7
assign (resid   30 and  name HA   )(resid   31 and  name HN   ) 1.8 0.0 0.7
assign (resid   31 and  name HA   )(resid   32 and  name HN   ) 1.8 0.0 0.7
assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 1.8 0.0 1.2
assign (resid   51 and  name HA   )(resid   52 and  name HN   ) 1.8 0.0 1.2
assign (resid   53 and  name HA   )(resid   54 and  name HN   ) 1.8 0.0 1.7
assign (resid   57 and  name HA   )(resid   58 and  name HN   ) 1.8 0.0 1.2
assign (resid   58 and  name HA   )(resid   59 and  name HN   ) 1.8 0.0 0.7
assign (resid   59 and  name HA   )(resid   60 and  name HN   ) 1.8 0.0 0.7
assign (resid   60 and  name HA   )(resid   61 and  name HN   ) 1.8 0.0 1.2
assign (resid   61 and  name HA   )(resid   62 and  name HN   ) 1.8 0.0 1.7
assign (resid   64 and  name HA1  )(resid   65 and  name HN   ) 1.8 0.0 2.2
assign (resid   64 and  name HA2  )(resid   65 and  name HN   ) 1.8 0.0 2.2
assign (resid   65 and  name HA   )(resid   66 and  name HN   ) 1.8 0.0 1.2
assign (resid   66 and  name HA1  )(resid   67 and  name HN   ) 1.8 0.0 1.7
assign (resid   66 and  name HA2  )(resid   67 and  name HN   ) 1.8 0.0 1.7
assign (resid   67 and  name HA   )(resid   68 and  name HN   ) 1.8 0.0 1.2
assign (resid   83 and  name HA   )(resid   84 and  name HN   ) 1.8 0.0 0.7
assign (resid   84 and  name HA   )(resid   85 and  name HN   ) 1.8 0.0 0.7
assign (resid   85 and  name HA   )(resid   86 and  name HN   ) 1.8 0.0 0.7
assign (resid   86 and  name HA   )(resid   87 and  name HN   ) 1.8 0.0 0.7
assign (resid   88 and  name HA   )(resid   89 and  name HN   ) 1.8 0.0 2.2

remarks ai-di+1, Ni-di+1, etc.  (proline)
assign (resid   33 and  name HA   )(resid   34 and  name HD1  ) 1.8 0.0 1.2
assign (resid   33 and  name HA   )(resid   34 and  name HD2  ) 1.8 0.0 1.2
assign (resid   37 and  name HA   )(resid   38 and  name HD1  ) 1.8 0.0 1.2
assign (resid   37 and  name HA   )(resid   38 and  name HD2  ) 1.8 0.0 1.2
assign (resid   52 and  name HA   )(resid   53 and  name HD1  ) 1.8 0.0 1.2
assign (resid   52 and  name HA   )(resid   53 and  name HD2  ) 1.8 0.0 1.2
assign (resid   68 and  name HA   )(resid   69 and  name HD1  ) 1.8 0.0 1.2
assign (resid   68 and  name HA   )(resid   69 and  name HD2  ) 1.8 0.0 1.2
assign (resid   71 and  name HA   )(resid   72 and  name HD1  ) 1.8 0.0 1.2
assign (resid   71 and  name HA   )(resid   72 and  name HD2  ) 1.8 0.0 1.2
assign (resid   71 and  name HN   )(resid   72 and  name HD*  ) 1.8 0.0 3.2
assign (resid   87 and  name HA   )(resid   88 and  name HD1  ) 1.8 0.0 1.2
assign (resid   87 and  name HA   )(resid   88 and  name HD2  ) 1.8 0.0 1.2

remarks ai-Ni+2
assign (resid   68 and  name HA   )(resid   70 and  name HN   ) 1.8 0.0 3.2

remarks ai-Ni+3
assign (resid   40 and  name HA   )(resid   43 and  name HN   ) 1.8 0.0 2.2
assign (resid   41 and  name HA   )(resid   44 and  name HN   ) 1.8 0.0 2.2
assign (resid   42 and  name HA   )(resid   45 and  name HN   ) 1.8 0.0 2.2
assign (resid   43 and  name HA   )(resid   46 and  name HN   ) 1.8 0.0 2.2
assign (resid   44 and  name HA   )(resid   47 and  name HN   ) 1.8 0.0 2.2
assign (resid   45 and  name HA   )(resid   48 and  name HN   ) 1.8 0.0 2.2
assign (resid   46 and  name HA   )(resid   49 and  name HN   ) 1.8 0.0 2.2
assign (resid   74 and  name HA*  )(resid   77 and  name HN   ) 1.8 0.0 3.2
assign (resid   75 and  name HA   )(resid   78 and  name HN   ) 1.8 0.0 2.2
assign (resid   76 and  name HA   )(resid   79 and  name HN   ) 1.8 0.0 2.2
assign (resid   77 and  name HA   )(resid   80 and  name HN   ) 1.8 0.0 3.2

remarks ai-Ni+4
assign (resid   47 and  name HA   )(resid   51 and  name HN   ) 1.8 0.0 3.2
assign (resid   75 and  name HA   )(resid   79 and  name HN   ) 1.8 0.0 3.2
assign (resid   76 and  name HA   )(resid   80 and  name HN   ) 1.8 0.0 3.2
assign (resid   77 and  name HA   )(resid   81 and  name HN   ) 1.8 0.0 3.2

remarks Bi-Ni+1
assign (resid   13 and  name HB1  )(resid   14 and  name HN   ) 1.8 0.0 2.2
assign (resid   13 and  name HB2  )(resid   14 and  name HN   ) 1.8 0.0 2.2
assign (resid   14 and  name HB   )(resid   15 and  name HN   ) 1.8 0.0 2.2
assign (resid   16 and  name HB1  )(resid   17 and  name HN   ) 1.8 0.0 2.2
assign (resid   16 and  name HB2  )(resid   17 and  name HN   ) 1.8 0.0 2.2
assign (resid   17 and  name HB*  )(resid   18 and  name HN   ) 1.8 0.0 3.2
assign (resid   28 and  name HB1  )(resid   29 and  name HN   ) 1.8 0.0 2.2
assign (resid   28 and  name HB2  )(resid   29 and  name HN   ) 1.8 0.0 2.2
assign (resid   34 and  name HB*  )(resid   35 and  name HN   ) 1.8 0.0 3.2
assign (resid   38 and  name HB*  )(resid   39 and  name HN   ) 1.8 0.0 3.2
assign (resid   45 and  name HB1  )(resid   46 and  name HN   ) 1.8 0.0 2.2
assign (resid   45 and  name HB2  )(resid   46 and  name HN   ) 1.8 0.0 2.2
assign (resid   50 and  name HB1  )(resid   51 and  name HN   ) 1.8 0.0 2.2
assign (resid   50 and  name HB2  )(resid   51 and  name HN   ) 1.8 0.0 2.2
assign (resid   53 and  name HB1  )(resid   54 and  name HN   ) 1.8 0.0 2.2
assign (resid   53 and  name HB2  )(resid   54 and  name HN   ) 1.8 0.0 2.2
assign (resid   55 and  name HB*  )(resid   56 and  name HN   ) 1.8 0.0 3.2
assign (resid   57 and  name HB1  )(resid   58 and  name HN   ) 1.8 0.0 2.2
assign (resid   57 and  name HB2  )(resid   58 and  name HN   ) 1.8 0.0 2.2
assign (resid   60 and  name HB   )(resid   61 and  name HN   ) 1.8 0.0 0.7
assign (resid   62 and  name HB*  )(resid   63 and  name HN   ) 1.8 0.0 3.2
assign (resid   69 and  name HB*  )(resid   70 and  name HN   ) 1.8 0.0 3.2
assign (resid   70 and  name HB*  )(resid   71 and  name HN   ) 1.8 0.0 2.7
assign (resid   73 and  name HB*  )(resid   74 and  name HN   ) 1.8 0.0 2.7
assign (resid   76 and  name HB   )(resid   77 and  name HN   ) 1.8 0.0 1.2
assign (resid   77 and  name HB1  )(resid   78 and  name HN   ) 1.8 0.0 2.2
assign (resid   77 and  name HB2  )(resid   78 and  name HN   ) 1.8 0.0 2.2
assign (resid   79 and  name HB1  )(resid   80 and  name HN   ) 1.8 0.0 2.2
assign (resid   79 and  name HB2  )(resid   80 and  name HN   ) 1.8 0.0 2.2
assign (resid   80 and  name HB1  )(resid   81 and  name HN   ) 1.8 0.0 2.2
assign (resid   80 and  name HB2  )(resid   81 and  name HN   ) 1.8 0.0 2.2
assign (resid   82 and  name HB*  )(resid   83 and  name HN   ) 1.8 0.0 3.2
assign (resid   83 and  name HB*  )(resid   84 and  name HN   ) 1.8 0.0 3.2

remarks gi-Ni+1, di-Ni+1, ei-Ni+1
assign (resid   15 and  name HG2* )(resid   16 and  name HN   ) 1.8 0.0 3.2
assign (resid   17 and  name HG*  )(resid   18 and  name HN   ) 1.8 0.0 3.2
assign (resid   19 and  name HG2* )(resid   20 and  name HN   ) 1.8 0.0 3.2
assign (resid   44 and  name HG*  )(resid   45 and  name HN   ) 1.8 0.0 3.2
assign (resid   59 and  name HG2* )(resid   60 and  name HN   ) 1.8 0.0 3.2
assign (resid   65 and  name HG1* )(resid   66 and  name HN   ) 1.8 0.0 2.2
assign (resid   67 and  name HG1* )(resid   68 and  name HN   ) 1.8 0.0 3.2
assign (resid   67 and  name HG2* )(resid   68 and  name HN   ) 1.8 0.0 3.2
assign (resid   69 and  name HD*  )(resid   70 and  name HN   ) 1.8 0.0 2.7
assign (resid   76 and  name HG2* )(resid   77 and  name HN   ) 1.8 0.0 3.2

remarks bi-Ni+2, gi-Ni+2, di-Ni+2
assign (resid   20 and  name HG   )(resid   22 and  name HN   ) 1.8 0.0 3.2
assign (resid   20 and  name HD1* )(resid   22 and  name HN   ) 1.8 0.0 4.2
assign (resid   20 and  name HD2* )(resid   22 and  name HN   ) 1.8 0.0 4.2
assign (resid   34 and  name HG2  )(resid   36 and  name HN   ) 1.8 0.0 3.2
assign (resid   38 and  name HB2  )(resid   40 and  name HN   ) 1.8 0.0 1.2
assign (resid   50 and  name HB1  )(resid   52 and  name HN   ) 1.8 0.0 2.2
assign (resid   50 and  name HB2  )(resid   52 and  name HN   ) 1.8 0.0 2.2
assign (resid   53 and  name HB1  )(resid   54 and  name HN   ) 1.8 0.0 3.2
assign (resid   53 and  name HB2  )(resid   54 and  name HN   ) 1.8 0.0 3.2
assign (resid   61 and  name HG2* )(resid   63 and  name HN   ) 1.8 0.0 3.2

remarks bi-Ni+3, gi-Ni+3, di-Ni+3
assign (resid   20 and  name HG   )(resid   23 and  name HN   ) 1.8 0.0 3.2
assign (resid   20 and  name HD2* )(resid   23 and  name HN   ) 1.8 0.0 4.2
assign (resid   34 and  name HG2  )(resid   37 and  name HN   ) 1.8 0.0 3.2
assign (resid   38 and  name HG*  )(resid   41 and  name HN   ) 1.8 0.0 3.2
assign (resid   53 and  name HB1  )(resid   56 and  name HN   ) 1.8 0.0 3.2
assign (resid   53 and  name HB2  )(resid   56 and  name HN   ) 1.8 0.0 2.2
assign (resid   72 and  name HB2  )(resid   75 and  name HN   ) 1.8 0.0 2.2
assign (resid   72 and  name HG2  )(resid   75 and  name HN   ) 1.8 0.0 2.2

remarks bi-Ni+4, gi-Ni+4, di-Ni+4
assign (resid   33 and  name HG2* )(resid   37 and  name HN   ) 1.8 0.0 4.2

remarks ai-bi+3
assign (resid   39 and  name HA   )(resid   42 and  name HB   ) 1.8 0.0 2.2
assign (resid   41 and  name HA   )(resid   44 and  name HB*  ) 1.8 0.0 3.2
assign (resid   42 and  name HA   )(resid   45 and  name HB*  ) 1.8 0.0 3.2
assign (resid   43 and  name HA   )(resid   46 and  name HB*  ) 1.8 0.0 3.2
assign (resid   44 and  name HA   )(resid   47 and  name HB*  ) 1.8 0.0 3.2
assign (resid   45 and  name HA   )(resid   48 and  name HB1  ) 1.8 0.0 2.2
assign (resid   45 and  name HA   )(resid   48 and  name HB2  ) 1.8 0.0 2.2
assign (resid   46 and  name HA   )(resid   49 and  name HB*  ) 1.8 0.0 3.2
assign (resid   73 and  name HA   )(resid   76 and  name HB   ) 1.8 0.0 1.7
assign (resid   75 and  name HA   )(resid   78 and  name HB1  ) 1.8 0.0 2.2
assign (resid   75 and  name HA   )(resid   78 and  name HB2  ) 1.8 0.0 2.2
assign (resid   76 and  name HA   )(resid   79 and  name HB*  ) 1.8 0.0 3.2

remarks ai-gi+3, ai-di+3
assign (resid   39 and  name HA   )(resid   42 and  name HG2* ) 1.8 0.0 4.2
assign (resid   41 and  name HA   )(resid   44 and  name HG*  ) 1.8 0.0 4.2
assign (resid   75 and  name HA   )(resid   78 and  name HG   ) 1.8 0.0 2.2

remarks long range a-N
assign (resid   17 and  name HA   )(resid   31 and  name HN   ) 1.8 0.0 3.2
assign (resid   18 and  name HA   )(resid   84 and  name HN   ) 1.8 0.0 3.2
assign (resid   19 and  name HA   )(resid   29 and  name HN   ) 1.8 0.0 2.2
assign (resid   20 and  name HA   )(resid   86 and  name HN   ) 1.8 0.0 2.2
assign (resid   30 and  name HA   )(resid   18 and  name HN   ) 1.8 0.0 3.2
assign (resid   32 and  name HA   )(resid   16 and  name HN   ) 1.8 0.0 2.2
assign (resid   34 and  name HA   )(resid   14 and  name HN   ) 1.8 0.0 3.2
assign (resid   35 and  name HA   )(resid   74 and  name HN   ) 1.8 0.0 2.2
assign (resid   47 and  name HA   )(resid   52 and  name HN   ) 1.8 0.0 3.2
assign (resid   57 and  name HA   )(resid   89 and  name HN   ) 1.8 0.0 2.2
assign (resid   59 and  name HA   )(resid   87 and  name HN   ) 1.8 0.0 2.2
assign (resid   60 and  name HA   )(resid   67 and  name HN   ) 1.8 0.0 1.2
assign (resid   61 and  name HA   )(resid   85 and  name HN   ) 1.8 0.0 3.2
assign (resid   82 and  name HA   )(resid   17 and  name HN   ) 1.8 0.0 2.2
assign (resid   85 and  name HA   )(resid   19 and  name HN   ) 1.8 0.0 2.2
assign (resid   86 and  name HA   )(resid   60 and  name HN   ) 1.8 0.0 3.2
assign (resid   88 and  name HA   )(resid   58 and  name HN   ) 1.8 0.0 3.2

remarks long range a-a
assign (resid   15 and  name HA   )(resid   32 and  name HA   ) 1.8 0.0 0.7
assign (resid   16 and  name HA   )(resid   82 and  name HA   ) 1.8 0.0 1.2
assign (resid   17 and  name HA   )(resid   30 and  name HA   ) 1.8 0.0 1.2
assign (resid   57 and  name HA   )(resid   88 and  name HA   ) 1.8 0.0 1.2
assign (resid   59 and  name HA   )(resid   86 and  name HA   ) 1.8 0.0 1.2
assign (resid   60 and  name HA   )(resid   66 and  name HA1  ) 1.8 0.0 2.2
assign (resid   60 and  name HA   )(resid   66 and  name HA2  ) 1.8 0.0 2.2
assign (resid   61 and  name HA   )(resid   84 and  name HA   ) 1.8 0.0 2.2

remarks long range side chain to NH
assign (resid   16 and  name HN   )(resid   30 and  name HG1* ) 1.8 0.0 4.2
assign (resid   16 and  name HN   )(resid   31 and  name HB*  ) 1.8 0.0 3.2
assign (resid   17 and  name HN   )(resid   82 and  name HB1  ) 1.8 0.0 3.2
assign (resid   17 and  name HN   )(resid   82 and  name HB2  ) 1.8 0.0 3.2
assign (resid   29 and  name HN   )(resid   18 and  name HB   ) 1.8 0.0 3.2
assign (resid   29 and  name HN   )(resid   18 and  name HD1* ) 1.8 0.0 4.2
assign (resid   29 and  name HN   )(resid   18 and  name HG2* ) 1.8 0.0 4.2
assign (resid   33 and  name HN   )(resid   13 and  name HB1  ) 1.8 0.0 3.2
assign (resid   33 and  name HN   )(resid   13 and  name HB2  ) 1.8 0.0 3.2
assign (resid   33 and  name HN   )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   35 and  name HN   )(resid   14 and  name HG1* ) 1.8 0.0 4.2
assign (resid   35 and  name HN   )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   37 and  name HN   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   39 and  name HN   )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   45 and  name HN   )(resid   31 and  name HD1* ) 1.8 0.0 4.2
assign (resid   45 and  name HN   )(resid   31 and  name HD2* ) 1.8 0.0 4.2
assign (resid   47 and  name HN   )(resid   59 and  name HD1* ) 1.8 0.0 4.2
assign (resid   47 and  name HN   )(resid   86 and  name HD1* ) 1.8 0.0 4.2
assign (resid   50 and  name HN   )(resid   52 and  name HG2* ) 1.8 0.0 4.2
assign (resid   61 and  name HN   )(resid   67 and  name HG2* ) 1.8 0.0 4.2
assign (resid   62 and  name HN   )(resid   84 and  name HD2* ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   60 and  name HD1*  ) 1.8 0.0 4.2
assign (resid   64 and  name HN   )(resid   65 and  name HG2*  ) 1.8 0.0 4.2
assign (resid   65 and  name HN   )(resid   60 and  name HB   ) 1.8 0.0 2.7
assign (resid   67 and  name HN   )(resid   59 and  name HG2* ) 1.8 0.0 3.2
assign (resid   67 and  name HN   )(resid   60 and  name HG2* ) 1.8 0.0 3.2
assign (resid   71 and  name HN   )(resid   39 and  name HB*  ) 1.8 0.0 4.2
assign (resid   71 and  name HN   )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   74 and  name HN   )(resid   14 and  name HG1* ) 1.8 0.0 4.2
assign (resid   74 and  name HN   )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   74 and  name HN   )(resid   35 and  name HB*  ) 1.8 0.0 4.2
assign (resid   77 and  name HN   )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   78 and  name HN   )(resid   14 and  name HG1* ) 1.8 0.0 4.2
assign (resid   80 and  name HN   )(resid   76 and  name HD1* ) 1.8 0.0 4.2

remarks short range irregular side chain to NH
assign (resid   51 and  name HN   )(resid   52 and  name HG2* ) 1.8 0.0 4.2
assign (resid   56 and  name HN   )(resid   57 and  name HB*  ) 1.8 0.0 3.2
assign (resid   82 and  name HN   )(resid   83 and  name HB*  ) 1.8 0.0 3.2

remarks long range side chain to alpha
assign (resid   15 and  name HA   )(resid   32 and  name HB*  ) 1.8 0.0 4.2
assign (resid   16 and  name HA   )(resid   82 and  name HB1  ) 1.8 0.0 3.2
assign (resid   16 and  name HA   )(resid   82 and  name HB2  ) 1.8 0.0 3.2
assign (resid   17 and  name HA   )(resid   30 and  name HG2* ) 1.8 0.0 3.2
assign (resid   20 and  name HA   )(resid   86 and  name HB1  ) 1.8 0.0 3.2
assign (resid   20 and  name HA   )(resid   86 and  name HB2  ) 1.8 0.0 3.2
assign (resid   32 and  name HA   )(resid   15 and  name HG2* ) 1.8 0.0 4.2
assign (resid   35 and  name HA   )(resid   14 and  name HG2* ) 1.8 0.0 3.2
assign (resid   35 and  name HA   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   39 and  name HA   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   43 and  name HA   )(resid   59 and  name HD1* ) 1.8 0.0 3.2
assign (resid   43 and  name HA   )(resid   86 and  name HD1* ) 1.8 0.0 4.2
assign (resid   44 and  name HA   )(resid   54 and  name HB*  ) 1.8 0.0 4.2
assign (resid   46 and  name HA   )(resid   31 and  name HD1* ) 1.8 0.0 4.2
assign (resid   47 and  name HA   )(resid   52 and  name HG2* ) 1.8 0.0 2.2
assign (resid   47 and  name HA   )(resid   86 and  name HD2* ) 1.8 0.0 3.2
assign (resid   53 and  name HA   )(resid   47 and  name HB*  ) 1.8 0.0 4.2
assign (resid   54 and  name HA   )(resid   47 and  name HB*  ) 1.8 0.0 3.2
assign (resid   58 and  name HA   )(resid   43 and  name HD1* ) 1.8 0.0 4.2
assign (resid   59 and  name HA   )(resid   86 and  name HD1* ) 1.8 0.0 4.2
assign (resid   60 and  name HA   )(resid   67 and  name HG2* ) 1.8 0.0 3.2
assign (resid   61 and  name HA   )(resid   84 and  name HD2* ) 1.8 0.0 3.2
assign (resid   64 and  name HA1  )(resid   60 and  name HD1* ) 1.8 0.0 4.2
assign (resid   64 and  name HA2  )(resid   60 and  name HD1* ) 1.8 0.0 4.2
assign (resid   66 and  name HA1  )(resid   60 and  name HG2* ) 1.8 0.0 2.2
assign (resid   66 and  name HA2  )(resid   60 and  name HG2* ) 1.8 0.0 2.2
assign (resid   69 and  name HA   )(resid   39 and  name HB1  ) 1.8 0.0 3.2
assign (resid   69 and  name HA   )(resid   39 and  name HB2  ) 1.8 0.0 3.2
assign (resid   69 and  name HA   )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   74 and  name HA1  )(resid   14 and  name HG1* ) 1.8 0.0 4.2
assign (resid   74 and  name HA2  )(resid   14 and  name HG1* ) 1.8 0.0 4.2
assign (resid   74 and  name HA1  )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   74 and  name HA2  )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   74 and  name HA1  )(resid   35 and  name HB*  ) 1.8 0.0 4.2
assign (resid   74 and  name HA2  )(resid   35 and  name HB*  ) 1.8 0.0 4.2
assign (resid   84 and  name HA   )(resid   59 and  name HG2* ) 1.8 0.0 4.2
assign (resid   86 and  name HA   )(resid   59 and  name HG2* ) 1.8 0.0 4.2
assign (resid   86 and  name HA   )(resid   59 and  name HD1* ) 1.8 0.0 4.2
assign (resid   89 and  name HA   )(resid   58 and  name HB*  ) 1.8 0.0 4.2

remarks short range side chain to side chain
assign (resid   33 and  name HB   )(resid   34 and  name HD1  ) 1.8 0.0 1.7
assign (resid   33 and  name HB   )(resid   34 and  name HD2  ) 1.8 0.0 1.7
assign (resid   52 and  name HB   )(resid   53 and  name HD1  ) 1.8 0.0 1.7
assign (resid   52 and  name HB   )(resid   53 and  name HD2  ) 1.8 0.0 1.7
assign (resid   52 and  name HG1* )(resid   53 and  name HD*  ) 1.8 0.0 4.2
assign (resid   52 and  name HG2* )(resid   53 and  name HD*  ) 1.8 0.0 4.2
assign (resid   55 and  name HB*  )(resid   56 and  name HG2* ) 1.8 0.0 5.2
assign (resid   87 and  name HB   )(resid   88 and  name HD*  ) 1.8 0.0 2.2
assign (resid   87 and  name HG2* )(resid   88 and  name HD1  ) 1.8 0.0 4.2
assign (resid   87 and  name HG2* )(resid   88 and  name HD2  ) 1.8 0.0 4.2

remarks long range side chain to side chain
assign (resid   13 and  name HB1  )(resid   32 and  name HB*  ) 1.8 0.0 4.2
assign (resid   13 and  name HB2  )(resid   32 and  name HB*  ) 1.8 0.0 4.2
assign (resid   13 and  name HD*  )(resid   32 and  name HB*  ) 1.8 0.0 5.2
assign (resid   14 and  name HG1* )(resid   35 and  name HB1  ) 1.8 0.0 4.2
assign (resid   14 and  name HG1* )(resid   35 and  name HB2  ) 1.8 0.0 4.2
assign (resid   14 and  name HG1* )(resid   35 and  name HG*  ) 1.8 0.0 5.2
assign (resid   14 and  name HG1* )(resid   77 and  name HB*  ) 1.8 0.0 5.2
assign (resid   14 and  name HG2* )(resid   33 and  name HG2* ) 1.8 0.0 5.2
assign (resid   14 and  name HG2* )(resid   73 and  name HB*  ) 1.8 0.0 5.2
assign (resid   16 and  name HB1  )(resid   18 and  name HD1* ) 1.8 0.0 4.2
assign (resid   16 and  name HB2  )(resid   18 and  name HD1* ) 1.8 0.0 4.2
assign (resid   18 and  name HD1* )(resid   31 and  name HD1* ) 1.8 0.0 5.2
assign (resid   18 and  name HD1* )(resid   42 and  name HG1* ) 1.8 0.0 3.2
assign (resid   18 and  name HD1* )(resid   46 and  name HB*  ) 1.8 0.0 3.2
assign (resid   18 and  name HD1* )(resid   84 and  name HD1* ) 1.8 0.0 5.2
assign (resid   21 and  name HG2* )(resid   85 and  name HB*  ) 1.8 0.0 5.2
assign (resid   21 and  name HG2* )(resid   85 and  name HG1  ) 1.8 0.0 4.2
assign (resid   21 and  name HG2* )(resid   85 and  name HG2  ) 1.8 0.0 4.2
assign (resid   21 and  name HG2* )(resid   87 and  name HG2* ) 1.8 0.0 5.2
assign (resid   21 and  name HG2* )(resid   87 and  name HD1* ) 1.8 0.0 5.2
assign (resid   31 and  name HD1* )(resid   42 and  name HG1* ) 1.8 0.0 5.2
assign (resid   31 and  name HD1* )(resid   45 and  name HB*  ) 1.8 0.0 4.2
assign (resid   31 and  name HD1* )(resid   46 and  name HB*  ) 1.8 0.0 5.2
assign (resid   31 and  name HD2* )(resid   45 and  name HB*  ) 1.8 0.0 5.2
assign (resid   33 and  name HB   )(resid   37 and  name HB   ) 1.8 0.0 3.2
assign (resid   33 and  name HB   )(resid   37 and  name HG2* ) 1.8 0.0 3.2
assign (resid   33 and  name HG2* )(resid   37 and  name HB   ) 1.8 0.0 4.2
assign (resid   33 and  name HG2* )(resid   37 and  name HG2* ) 1.8 0.0 5.2
assign (resid   33 and  name HG2* )(resid   73 and  name HB*  ) 1.8 0.0 5.2
assign (resid   34 and  name HD*  )(resid   37 and  name HG2* ) 1.8 0.0 5.2
assign (resid   37 and  name HB   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   37 and  name HG2* )(resid   42 and  name HG2* ) 1.8 0.0 5.2
assign (resid   38 and  name HD*  )(resid   41 and  name HB*  ) 1.8 0.0 5.2
assign (resid   39 and  name HB1  )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   39 and  name HB2  )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   40 and  name HG2* )(resid   70 and  name HB*  ) 1.8 0.0 5.2
assign (resid   42 and  name HG1* )(resid   46 and  name HB*  ) 1.8 0.0 5.2
assign (resid   42 and  name HG1* )(resid   59 and  name HD1* ) 1.8 0.0 5.2
assign (resid   42 and  name HG2* )(resid   33 and  name HG1* ) 1.8 0.0 5.2
assign (resid   42 and  name HG2* )(resid   33 and  name HG2* ) 1.8 0.0 5.2
assign (resid   42 and  name HG2* )(resid   73 and  name HB*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD1* )(resid   47 and  name HB*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD1* )(resid   59 and  name HD1* ) 1.8 0.0 4.2
assign (resid   43 and  name HD1* )(resid   59 and  name HG1* ) 1.8 0.0 3.2
assign (resid   43 and  name HD1* )(resid   69 and  name HB*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD1* )(resid   69 and  name HG*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD2* )(resid   58 and  name HB*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD2* )(resid   69 and  name HB*  ) 1.8 0.0 5.2
assign (resid   43 and  name HD2* )(resid   69 and  name HG*  ) 1.8 0.0 5.2
assign (resid   46 and  name HB*  )(resid   59 and  name HD1* ) 1.8 0.0 5.2
assign (resid   46 and  name HB*  )(resid   86 and  name HD1* ) 1.8 0.0 5.2
assign (resid   47 and  name HB*  )(resid   52 and  name HG2* ) 1.8 0.0 4.2
assign (resid   47 and  name HB*  )(resid   86 and  name HD1* ) 1.8 0.0 5.2
assign (resid   47 and  name HB*  )(resid   86 and  name HD2* ) 1.8 0.0 5.2
assign (resid   50 and  name HB1  )(resid   86 and  name HD2* ) 1.8 0.0 4.2
assign (resid   50 and  name HB2  )(resid   86 and  name HD2* ) 1.8 0.0 4.2
assign (resid   58 and  name HB*  )(resid   60 and  name HG2* ) 1.8 0.0 5.2
assign (resid   58 and  name HB*  )(resid   89 and  name HB*  ) 1.8 0.0 5.2
assign (resid   58 and  name HB*  )(resid   89 and  name HG*  ) 1.8 0.0 5.2
assign (resid   40 and  name HG2* )(resid   69 and  name HB*  ) 1.8 0.0 4.2
assign (resid   40 and  name HG2* )(resid   69 and  name HG*  ) 1.8 0.0 5.2
assign (resid   58 and  name HB*  )(resid   87 and  name HG2* ) 1.8 0.0 5.2
assign (resid   58 and  name HB*  )(resid   87 and  name HD1* ) 1.8 0.0 5.2
assign (resid   59 and  name HG1* )(resid   86 and  name HD1* ) 1.8 0.0 5.2
assign (resid   59 and  name HG2* )(resid   67 and  name HB   ) 1.8 0.0 4.2
assign (resid   59 and  name HG2* )(resid   84 and  name HB*  ) 1.8 0.0 5.2
assign (resid   59 and  name HG2* )(resid   84 and  name HD1* ) 1.8 0.0 4.2
assign (resid   59 and  name HG2* )(resid   84 and  name HD2* ) 1.8 0.0 5.2
assign (resid   61 and  name HG2* )(resid   67 and  name HG2* ) 1.8 0.0 5.2
assign (resid   61 and  name HG2* )(resid   80 and  name HB1  ) 1.8 0.0 4.2
assign (resid   61 and  name HG2* )(resid   80 and  name HB2  ) 1.8 0.0 4.2
assign (resid   67 and  name HG2* )(resid   59 and  name HB   ) 1.8 0.0 4.2
assign (resid   67 and  name HG2* )(resid   59 and  name HG2* ) 1.8 0.0 5.2
assign (resid   67 and  name HG1* )(resid   76 and  name HD1* ) 1.8 0.0 4.2
assign (resid   67 and  name HG1* )(resid   76 and  name HG2* ) 1.8 0.0 5.2
assign (resid   67 and  name HG2* )(resid   76 and  name HD1* ) 1.8 0.0 5.2
assign (resid   67 and  name HG2* )(resid   76 and  name HG2* ) 1.8 0.0 5.2
assign (resid   67 and  name HG2* )(resid   84 and  name HD2* ) 1.8 0.0 5.2
assign (resid   76 and  name HG2* )(resid   80 and  name HB*  ) 1.8 0.0 5.2
assign (resid   76 and  name HG2* )(resid   84 and  name HD1* ) 1.8 0.0 5.2
assign (resid   80 and  name HB*  )(resid   84 and  name HD2* ) 1.8 0.0 5.2

remarks long range aromatic sidechain to anything
assign (resid   16 and  name HD*  )(resid   33 and  name HG2* ) 1.8 0.0 6.2
assign (resid   16 and  name HD*  )(resid   42 and  name HG1* ) 1.8 0.0 6.2
assign (resid   16 and  name HD*  )(resid   82 and  name HA   ) 1.8 0.0 5.2
assign (resid   16 and  name HD*  )(resid   84 and  name HD1* ) 1.8 0.0 6.2
assign (resid   16 and  name HE*  )(resid   33 and  name HG2* ) 1.8 0.0 6.2
assign (resid   16 and  name HE*  )(resid   14 and  name HG2* ) 1.8 0.0 6.2
assign (resid   16 and  name HE*  )(resid   42 and  name HG2* ) 1.8 0.0 6.2
assign (resid   16 and  name HE*  )(resid   73 and  name HB*  ) 1.8 0.0 5.2
assign (resid   16 and  name HE*  )(resid   76 and  name HG2* ) 1.8 0.0 6.2
assign (resid   16 and  name HE*  )(resid   77 and  name HA   ) 1.8 0.0 5.2
assign (resid   16 and  name HZ   )(resid   14 and  name HG2* ) 1.8 0.0 4.2
assign (resid   16 and  name HZ   )(resid   73 and  name HB*  ) 1.8 0.0 4.2
assign (resid   16 and  name HZ   )(resid   76 and  name HG2* ) 1.8 0.0 4.2
assign (resid   16 and  name HZ   )(resid   76 and  name HB   ) 1.8 0.0 3.2
assign (resid   16 and  name HZ   )(resid   77 and  name HN   ) 1.8 0.0 3.2
assign (resid   16 and  name HZ   )(resid   77 and  name HB*  ) 1.8 0.0 3.2
assign (resid   28 and  name HD*  )(resid   29 and  name HN   ) 1.8 0.0 5.2
assign (resid   28 and  name HD*  )(resid   17 and  name HG*  ) 1.8 0.0 5.2
assign (resid   28 and  name HD*  )(resid   30 and  name HN   ) 1.8 0.0 5.2
assign (resid   28 and  name HD*  )(resid   30 and  name HG2* ) 1.8 0.0 5.2
assign (resid   39 and  name HD*  )(resid   69 and  name HA   ) 1.8 0.0 4.2
assign (resid   39 and  name HD*  )(resid   69 and  name HB*  ) 1.8 0.0 6.2
assign (resid   39 and  name HD*  )(resid   73 and  name HA   ) 1.8 0.0 5.2
assign (resid   39 and  name HD*  )(resid   73 and  name HN   ) 1.8 0.0 5.2
assign (resid   39 and  name HD*  )(resid   73 and  name HB*  ) 1.8 0.0 6.2
assign (resid   39 and  name HD*  )(resid   76 and  name HG2* ) 1.8 0.0 6.2
assign (resid   39 and  name HD*  )(resid   76 and  name HD1* ) 1.8 0.0 6.2
assign (resid   39 and  name HE*  )(resid   42 and  name HG1* ) 1.8 0.0 5.2
assign (resid   39 and  name HE*  )(resid   59 and  name HB   ) 1.8 0.0 4.2
assign (resid   39 and  name HE*  )(resid   59 and  name HG2* ) 1.8 0.0 5.2
assign (resid   39 and  name HE*  )(resid   59 and  name HD1* ) 1.8 0.0 5.2
assign (resid   39 and  name HE*  )(resid   84 and  name HD1* ) 1.8 0.0 5.2
assign (resid   39 and  name HZ   )(resid   18 and  name HD1* ) 1.8 0.0 4.2
assign (resid   39 and  name HZ   )(resid   42 and  name HG1* ) 1.8 0.0 4.2
assign (resid   39 and  name HZ   )(resid   59 and  name HG2* ) 1.8 0.0 4.2
assign (resid   39 and  name HZ   )(resid   59 and  name HD1* ) 1.8 0.0 4.2
assign (resid   39 and  name HZ   )(resid   84 and  name HD1* ) 1.8 0.0 4.2
assign (resid   45 and  name HD*  )(resid   45 and  name HN   ) 1.8 0.0 4.2
assign (resid   45 and  name HD*  )(resid   46 and  name HN   ) 1.8 0.0 5.2
assign (resid   50 and  name HD*  )(resid   18 and  name HG2* ) 1.8 0.0 6.2
assign (resid   50 and  name HD*  )(resid   29 and  name HE*  ) 1.8 0.0 6.2
assign (resid   50 and  name HD*  )(resid   46 and  name HA   ) 1.8 0.0 5.2
assign (resid   50 and  name HD*  )(resid   46 and  name HB*  ) 1.8 0.0 6.2
assign (resid   50 and  name HD*  )(resid   47 and  name HA   ) 1.8 0.0 5.2
assign (resid   50 and  name HD*  )(resid   51 and  name HN   ) 1.8 0.0 5.2
assign (resid   50 and  name HD*  )(resid   52 and  name HG2* ) 1.8 0.0 6.2
assign (resid   50 and  name HD*  )(resid   86 and  name HD1* ) 1.8 0.0 6.2
assign (resid   50 and  name HE*  )(resid   18 and  name HG2* ) 1.8 0.0 6.2
assign (resid   50 and  name HE*  )(resid   20 and  name HD2* ) 1.8 0.0 6.2
assign (resid   50 and  name HE*  )(resid   29 and  name HN   ) 1.8 0.0 5.2
assign (resid   50 and  name HE*  )(resid   46 and  name HB*  ) 1.8 0.0 6.2
assign (resid   50 and  name HZ   )(resid   20 and  name HN   ) 1.8 0.0 3.2
assign (resid   50 and  name HZ   )(resid   29 and  name HN   ) 1.8 0.0 3.2
assign (resid   50 and  name HD*  )(resid   20 and  name HD2* ) 1.8 0.0 6.2
assign (resid   50 and  name HD*  )(resid   86 and  name HD2* ) 1.8 0.0 6.2
assign (resid   77 and  name HD*  )(resid   14 and  name HG1* ) 1.8 0.0 6.2
assign (resid   77 and  name HD*  )(resid   82 and  name HA   ) 1.8 0.0 5.2
assign (resid   77 and  name HD*  )(resid   82 and  name HN   ) 1.8 0.0 5.2
assign (resid   77 and  name HD*  )(resid   78 and  name HN   ) 1.8 0.0 5.2
assign (resid   77 and  name HE*  )(resid   82 and  name HN   ) 1.8 0.0 5.2
assign (resid   80 and  name HD2  )(resid   67 and  name HG1* ) 1.8 0.0 4.2
assign (resid   80 and  name HD2  )(resid   67 and  name HG2* ) 1.8 0.0 4.2
assign (resid   80 and  name HD2  )(resid   76 and  name HA   ) 1.8 0.0 3.2
assign (resid   80 and  name HD2  )(resid   76 and  name HG2* ) 1.8 0.0 4.2

remarks side chain amide to ...
assign (resid   62 and  name HD*  )(resid   83 and  name HB*  ) 1.8 0.0 5.2
assign (resid   68 and  name HD*  )(resid   70 and  name HB*  ) 1.8 0.0 5.2
assign (resid   71 and  name HE*  )(resid   67 and  name HG1* ) 1.8 0.0 5.2
assign (resid   71 and  name HE*  )(resid   68 and  name HB*  ) 1.8 0.0 5.2
assign (resid   71 and  name HE*  )(resid   76 and  name HD1* ) 1.8 0.0 5.2
assign (resid   75 and  name HD*  )(resid   71 and  name HB*  ) 1.8 0.0 5.2
assign (resid   75 and  name HD*  )(resid   72 and  name HD*  ) 1.8 0.0 5.2

remarks select intraresidue
assign (resid   14 and  name HA   )(resid   14 and  name HG1*  ) 1.8 0.0 1.7
assign (resid   14 and  name HA   )(resid   14 and  name HB    ) 1.8 0.0 0.9
assign (resid   14 and  name HN   )(resid   14 and  name HG2*  ) 1.8 0.0 1.7
assign (resid   18 and  name HA   )(resid   18 and  name HG11  ) 1.8 0.0 1.7
assign (resid   18 and  name HA   )(resid   18 and  name HG12  ) 1.8 0.0 1.7
assign (resid   18 and  name HA   )(resid   18 and  name HG2*  ) 1.8 0.0 1.7
assign (resid   18 and  name HN   )(resid   18 and  name HB    ) 1.8 0.0 1.2
assign (resid   29 and  name HA   )(resid   29 and  name HD*   ) 1.8 0.0 3.2
assign (resid   33 and  name HA   )(resid   33 and  name HG1*  ) 1.8 0.0 1.7
assign (resid   33 and  name HA   )(resid   33 and  name HB    ) 1.8 0.0 0.9
assign (resid   33 and  name HN   )(resid   33 and  name HG1*  ) 1.8 0.0 2.7
assign (resid   33 and  name HN   )(resid   33 and  name HG2*  ) 1.8 0.0 2.7
assign (resid   39 and  name HN   )(resid   39 and  name HB1   ) 1.8 0.0 1.2
assign (resid   39 and  name HN   )(resid   39 and  name HB2   ) 1.8 0.0 1.2
assign (resid   40 and  name HN   )(resid   40 and  name HG2*  ) 1.8 0.0 2.2
assign (resid   43 and  name HA   )(resid   43 and  name HD1*  ) 1.8 0.0 2.2
assign (resid   52 and  name HA   )(resid   52 and  name HB    ) 1.8 0.0 0.9
assign (resid   59 and  name HN   )(resid   59 and  name HB    ) 1.8 0.0 1.2
assign (resid   59 and  name HN   )(resid   59 and  name HG1*  ) 1.8 0.0 2.2
assign (resid   60 and  name HN   )(resid   60 and  name HG1*  ) 1.8 0.0 2.2
assign (resid   60 and  name HA   )(resid   60 and  name HG1*  ) 1.8 0.0 2.2
assign (resid   60 and  name HA   )(resid   60 and  name HB    ) 1.8 0.0 1.2
assign (resid   65 and  name HA   )(resid   65 and  name HG1*  ) 1.8 0.0 1.7
assign (resid   65 and  name HA   )(resid   65 and  name HG2*  ) 1.8 0.0 1.7
assign (resid   65 and  name HN   )(resid   65 and  name HB    ) 1.8 0.0 1.2
assign (resid   65 and  name HN   )(resid   65 and  name HG2*  ) 1.8 0.0 2.2
assign (resid   67 and  name HA   )(resid   67 and  name HN    ) 1.8 0.0 1.2
assign (resid   67 and  name HN   )(resid   67 and  name HG2*  ) 1.8 0.0 1.7
assign (resid   71 and  name HN   )(resid   71 and  name HB*   ) 1.8 0.0 2.2
assign (resid   71 and  name HN   )(resid   71 and  name HG*   ) 1.8 0.0 2.2
assign (resid   76 and  name HN   )(resid   76 and  name HB    ) 1.8 0.0 1.2
assign (resid   76 and  name HN   )(resid   76 and  name HG1*  ) 1.8 0.0 1.2
assign (resid   76 and  name HA   )(resid   76 and  name HG2*  ) 1.8 0.0 1.7
assign (resid   76 and  name HA   )(resid   76 and  name HD1*  ) 1.8 0.0 1.7
assign (resid   80 and  name HN   )(resid   80 and  name HD2   ) 1.8 0.0 2.2
assign (resid   84 and  name HA   )(resid   84 and  name HD2*  ) 1.8 0.0 2.2



remarks : PHI CONSTRAINTS


remarks:  HELIX

assign (resid   38 and  name C    ) (resid   39 and  name N    ) 
       (resid   39 and  name CA   ) (resid   39 and  name C    ) 1.0 -57.0 25 2

assign (resid   39 and  name C    ) (resid   40 and  name N    ) 
       (resid   40 and  name CA   ) (resid   40 and  name C    ) 1.0 -57.0 25 2

assign (resid   40 and  name C    ) (resid   41 and  name N    ) 
       (resid   41 and  name CA   ) (resid   41 and  name C    ) 1.0 -57.0 25 2

assign (resid   41 and  name C    ) (resid   42 and  name N    ) 
       (resid   42 and  name CA   ) (resid   42 and  name C    ) 1.0 -57.0 25 2

assign (resid   42 and  name C    ) (resid   43 and  name N    ) 
       (resid   43 and  name CA   ) (resid   43 and  name C    ) 1.0 -57.0 25 2

assign (resid   43 and  name C    ) (resid   44 and  name N    ) 
       (resid   44 and  name CA   ) (resid   44 and  name C    ) 1.0 -57.0 25 2

assign (resid   44 and  name C    ) (resid   45 and  name N    ) 
       (resid   45 and  name CA   ) (resid   45 and  name C    ) 1.0 -57.0 25 2

assign (resid   45 and  name C    ) (resid   46 and  name N    ) 
       (resid   46 and  name CA   ) (resid   46 and  name C    ) 1.0 -57.0 25 2

assign (resid   46 and  name C    ) (resid   47 and  name N    ) 
       (resid   47 and  name CA   ) (resid   47 and  name C    ) 1.0 -57.0 25 2

assign (resid   47 and  name C    ) (resid   48 and  name N    ) 
       (resid   48 and  name CA   ) (resid   48 and  name C    ) 1.0 -57.0 25 2

assign (resid   48 and  name C    ) (resid   49 and  name N    ) 
       (resid   49 and  name CA   ) (resid   49 and  name C    ) 1.0 -57.0 25 2

assign (resid   72 and  name C    ) (resid   73 and  name N    ) 
       (resid   73 and  name CA   ) (resid   73 and  name C    ) 1.0 -57.0 25 2

assign (resid   73 and  name C    ) (resid   74 and  name N    ) 
       (resid   74 and  name CA   ) (resid   74 and  name C    ) 1.0 -57.0 25 2

assign (resid   74 and  name C    ) (resid   75 and  name N    ) 
       (resid   75 and  name CA   ) (resid   75 and  name C    ) 1.0 -57.0 25 2

assign (resid   75 and  name C    ) (resid   76 and  name N    ) 
       (resid   76 and  name CA   ) (resid   76 and  name C    ) 1.0 -57.0 25 2

assign (resid   76 and  name C    ) (resid   77 and  name N    ) 
       (resid   77 and  name CA   ) (resid   77 and  name C    ) 1.0 -57.0 25 2

assign (resid   77 and  name C    ) (resid   78 and  name N    ) 
       (resid   78 and  name CA   ) (resid   78 and  name C    ) 1.0 -57.0 25 2


remarks: SHEET

assign (resid   12 and  name C    ) (resid   13 and  name N    ) 
       (resid   13 and  name CA   ) (resid   13 and  name C    ) 1.0 -139.0 40 2

assign (resid   13 and  name C    ) (resid   14 and  name N    ) 
       (resid   14 and  name CA   ) (resid   14 and  name C    ) 1.0 -139.0 40 2

assign (resid   14 and  name C    ) (resid   15 and  name N    ) 
       (resid   15 and  name CA   ) (resid   15 and  name C    ) 1.0 -139.0 40 2

assign (resid   15 and  name C    ) (resid   16 and  name N    ) 
       (resid   16 and  name CA   ) (resid   16 and  name C    ) 1.0 -139.0 40 2

assign (resid   16 and  name C    ) (resid   17 and  name N    ) 
       (resid   17 and  name CA   ) (resid   17 and  name C    ) 1.0 -139.0 40 2

assign (resid   29 and  name C    ) (resid   30 and  name N    ) 
       (resid   30 and  name CA   ) (resid   30 and  name C    ) 1.0 -139.0 40 2

assign (resid   30 and  name C    ) (resid   31 and  name N    ) 
       (resid   31 and  name CA   ) (resid   31 and  name C    ) 1.0 -139.0 40 2

assign (resid   31 and  name C    ) (resid   32 and  name N    ) 
       (resid   32 and  name CA   ) (resid   32 and  name C    ) 1.0 -139.0 40 2

assign (resid   32 and  name C    ) (resid   33 and  name N    ) 
       (resid   33 and  name CA   ) (resid   33 and  name C    ) 1.0 -139.0 40 2

assign (resid   57 and  name C    ) (resid   58 and  name N    ) 
       (resid   58 and  name CA   ) (resid   58 and  name C    ) 1.0 -139.0 40 2

assign (resid   58 and  name C    ) (resid   59 and  name N    ) 
       (resid   59 and  name CA   ) (resid   59 and  name C    ) 1.0 -139.0 40 2

assign (resid   59 and  name C    ) (resid   60 and  name N    ) 
       (resid   60 and  name CA   ) (resid   60 and  name C    ) 1.0 -139.0 40 2

assign (resid   83 and  name C    ) (resid   84 and  name N    ) 
       (resid   84 and  name CA   ) (resid   84 and  name C    ) 1.0 -139.0 40 2

assign (resid   84 and  name C    ) (resid   85 and  name N    ) 
       (resid   85 and  name CA   ) (resid   85 and  name C    ) 1.0 -139.0 40 2

assign (resid   85 and  name C    ) (resid   86 and  name N    ) 
       (resid   86 and  name CA   ) (resid   86 and  name C    ) 1.0 -139.0 40 2

assign (resid   86 and  name C    ) (resid   87 and  name N    ) 
       (resid   87 and  name CA   ) (resid   87 and  name C    ) 1.0 -139.0 40 2

remarks: OTHER
assign (resid   34 and  name C    ) (resid   35 and  name N    ) 
       (resid   35 and  name CA   ) (resid   35 and  name C    ) 1.0 -57.0 30 2

assign (resid   36 and  name C    ) (resid   37 and  name N    ) 
       (resid   37 and  name CA   ) (resid   37 and  name C    ) 1.0 -57.0 30 2

assign (resid   51 and  name C    ) (resid   52 and  name N    ) 
       (resid   52 and  name CA   ) (resid   52 and  name C    ) 1.0 -130.0 50 2

assign (resid   53 and  name C    ) (resid   54 and  name N    ) 
       (resid   54 and  name CA   ) (resid   54 and  name C    ) 1.0 -57.0 30 2

assign (resid   54 and  name C    ) (resid   55 and  name N    ) 
       (resid   55 and  name CA   ) (resid   55 and  name C    ) 1.0 -57.0 30 2

assign (resid   55 and  name C    ) (resid   56 and  name N    ) 
       (resid   56 and  name CA   ) (resid   56 and  name C    ) 1.0 -130.0 50 2

assign (resid   61 and  name C    ) (resid   62 and  name N    ) 
       (resid   62 and  name CA   ) (resid   62 and  name C    ) 1.0 -57.0 30 2

assign (resid   62 and  name C    ) (resid   63 and  name N    ) 
       (resid   63 and  name CA   ) (resid   63 and  name C    ) 1.0 -130.0 50 2

assign (resid   79 and  name C    ) (resid   80 and  name N    ) 
       (resid   80 and  name CA   ) (resid   80 and  name C    ) 1.0 -130.0 50 2


remarks: PSI CONSTRAINTS

remarks:  HELIX

assign (resid   39 and  name N    ) (resid   39 and  name CA   ) 
       (resid   39 and  name C    ) (resid   40 and  name N    ) 1.0 -47.0 30 2

assign (resid   40 and  name N    ) (resid   40 and  name CA   ) 
       (resid   40 and  name C    ) (resid   41 and  name N    ) 1.0 -47.0 30 2

assign (resid   41 and  name N    ) (resid   41 and  name CA   ) 
       (resid   41 and  name C    ) (resid   42 and  name N    ) 1.0 -47.0 30 2

assign (resid   42 and  name N    ) (resid   42 and  name CA   ) 
       (resid   42 and  name C    ) (resid   43 and  name N    ) 1.0 -47.0 30 2

assign (resid   43 and  name N    ) (resid   43 and  name CA   ) 
       (resid   43 and  name C    ) (resid   44 and  name N    ) 1.0 -47.0 30 2

assign (resid   44 and  name N    ) (resid   44 and  name CA   ) 
       (resid   44 and  name C    ) (resid   45 and  name N    ) 1.0 -47.0 30 2

assign (resid   45 and  name N    ) (resid   45 and  name CA   ) 
       (resid   45 and  name C    ) (resid   46 and  name N    ) 1.0 -47.0 30 2

assign (resid   46 and  name N    ) (resid   46 and  name CA   ) 
       (resid   46 and  name C    ) (resid   47 and  name N    ) 1.0 -47.0 30 2

assign (resid   47 and  name N    ) (resid   47 and  name CA   ) 
       (resid   47 and  name C    ) (resid   48 and  name N    ) 1.0 -47.0 30 2

assign (resid   48 and  name N    ) (resid   48 and  name CA   ) 
       (resid   48 and  name C    ) (resid   49 and  name N    ) 1.0 -47.0 30 2

assign (resid   49 and  name N    ) (resid   49 and  name CA   ) 
       (resid   49 and  name C    ) (resid   50 and  name N    ) 1.0 -47.0 30 2

assign (resid   75 and  name N    ) (resid   75 and  name CA   ) 
       (resid   75 and  name C    ) (resid   76 and  name N    ) 1.0 -47.0 30 2

assign (resid   76 and  name N    ) (resid   76 and  name CA   ) 
       (resid   76 and  name C    ) (resid   77 and  name N    ) 1.0 -47.0 30 2

assign (resid   77 and  name N    ) (resid   77 and  name CA   ) 
       (resid   77 and  name C    ) (resid   78 and  name N    ) 1.0 -47.0 30 2

remarks: SHEET

assign (resid   13 and  name N    ) (resid   13 and  name CA   ) 
       (resid   13 and  name C    ) (resid   14 and  name N    ) 1.0  140.0 40 2

assign (resid   14 and  name N    ) (resid   14 and  name CA   ) 
       (resid   14 and  name C    ) (resid   15 and  name N    ) 1.0  140.0 40 2

assign (resid   15 and  name N    ) (resid   15 and  name CA   ) 
       (resid   15 and  name C    ) (resid   16 and  name N    ) 1.0  140.0 40 2

assign (resid   16 and  name N    ) (resid   16 and  name CA   ) 
       (resid   16 and  name C    ) (resid   17 and  name N    ) 1.0  140.0 40 2

assign (resid   17 and  name N    ) (resid   17 and  name CA   ) 
       (resid   17 and  name C    ) (resid   18 and  name N    ) 1.0  140.0 40 2

assign (resid   30 and  name N    ) (resid   30 and  name CA   ) 
       (resid   30 and  name C    ) (resid   31 and  name N    ) 1.0  140.0 40 2

assign (resid   31 and  name N    ) (resid   31 and  name CA   ) 
       (resid   31 and  name C    ) (resid   32 and  name N    ) 1.0  140.0 40 2

assign (resid   32 and  name N    ) (resid   32 and  name CA   ) 
       (resid   32 and  name C    ) (resid   33 and  name N    ) 1.0  140.0 40 2

assign (resid   33 and  name N    ) (resid   33 and  name CA   ) 
       (resid   33 and  name C    ) (resid   34 and  name N    ) 1.0  140.0 40 2

assign (resid   58 and  name N    ) (resid   58 and  name CA   ) 
       (resid   58 and  name C    ) (resid   59 and  name N    ) 1.0  140.0 40 2

assign (resid   59 and  name N    ) (resid   59 and  name CA   ) 
       (resid   59 and  name C    ) (resid   60 and  name N    ) 1.0  140.0 40 2

assign (resid   60 and  name N    ) (resid   60 and  name CA   ) 
       (resid   60 and  name C    ) (resid   61 and  name N    ) 1.0  140.0 40 2

assign (resid   84 and  name N    ) (resid   84 and  name CA   ) 
       (resid   84 and  name C    ) (resid   85 and  name N    ) 1.0  140.0 40 2

assign (resid   85 and  name N    ) (resid   85 and  name CA   ) 
       (resid   85 and  name C    ) (resid   86 and  name N    ) 1.0  140.0 40 2

assign (resid   86 and  name N    ) (resid   86 and  name CA   ) 
       (resid   86 and  name C    ) (resid   87 and  name N    ) 1.0  140.0 40 2

end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1H        MET   1 -26.540 -19.978   8.806
    2   2H    MET   1          2H        MET   1 -25.765 -20.768  10.094
    3   3H    MET   1          3H        MET   1 -24.866 -20.260   8.744
    4    HA   MET   1           HA       MET   1 -26.211 -18.524  10.740
    5   1HB   MET   1          2HB       MET   1 -23.963 -19.722  11.234
    6   2HB   MET   1          1HB       MET   1 -23.277 -18.590  10.066
    7   1HG   MET   1          2HG       MET   1 -24.703 -16.849  11.528
    8   2HG   MET   1          1HG       MET   1 -24.415 -18.072  12.770
    9   1HE   MET   1          1HE       MET   1 -22.579 -18.446  13.977
   10   2HE   MET   1          2HE       MET   1 -20.898 -18.033  13.664
   11   3HE   MET   1          3HE       MET   1 -21.692 -19.263  12.686
   12    H    SER   2           H        SER   2 -26.454 -16.390  10.176
   13    HA   SER   2           HA       SER   2 -25.833 -15.664   7.352
   14   1HB   SER   2          2HB       SER   2 -27.662 -14.249   9.314
   15   2HB   SER   2          1HB       SER   2 -27.552 -13.962   7.579
   16    HG   SER   2           HG       SER   2 -28.690 -16.095   9.003
   17    H    GLY   3           H        GLY   3 -24.125 -14.308   7.024
   18   1HA   GLY   3          2HA       GLY   3 -22.798 -12.352   7.383
   19   2HA   GLY   3          1HA       GLY   3 -23.543 -12.159   8.970
   20    H    GLY   4           H        GLY   4 -22.261 -15.276   8.026
   21   1HA   GLY   4          2HA       GLY   4 -19.946 -14.858   9.882
   22   2HA   GLY   4          1HA       GLY   4 -20.844 -16.377   9.796
   23    H    THR   5           H        THR   5 -19.261 -14.138   7.484
   24    HA   THR   5           HA       THR   5 -18.360 -16.495   5.914
   25    HB   THR   5           HB       THR   5 -17.625 -14.672   4.265
   26    HG1  THR   5           HG1      THR   5 -18.665 -12.655   4.625
   27   1HG2  THR   5          1HG2      THR   5 -19.572 -15.147   3.254
   28   2HG2  THR   5          2HG2      THR   5 -20.460 -14.145   4.402
   29   3HG2  THR   5          3HG2      THR   5 -20.146 -15.841   4.770
   30    H    ALA   6           H        ALA   6 -16.304 -17.221   6.146
   31    HA   ALA   6           HA       ALA   6 -14.413 -15.906   7.890
   32   1HB   ALA   6          1HB       ALA   6 -14.161 -18.216   5.946
   33   2HB   ALA   6          2HB       ALA   6 -14.208 -18.281   7.708
   34   3HB   ALA   6          3HB       ALA   6 -12.791 -17.625   6.888
   35    H    ALA   7           H        ALA   7 -14.849 -16.094   4.380
   36    HA   ALA   7           HA       ALA   7 -12.510 -14.351   3.897
   37   1HB   ALA   7          1HB       ALA   7 -13.129 -14.612   1.511
   38   2HB   ALA   7          2HB       ALA   7 -14.577 -15.498   1.989
   39   3HB   ALA   7          3HB       ALA   7 -12.981 -16.178   2.304
   40    H    THR   8           H        THR   8 -12.736 -12.189   3.095
   41    HA   THR   8           HA       THR   8 -15.210 -10.857   3.950
   42    HB   THR   8           HB       THR   8 -12.701  -9.708   2.679
   43    HG1  THR   8           HG1      THR   8 -12.028 -10.287   4.606
   44   1HG2  THR   8          1HG2      THR   8 -14.368  -8.081   2.351
   45   2HG2  THR   8          2HG2      THR   8 -13.655  -7.612   3.895
   46   3HG2  THR   8          3HG2      THR   8 -15.189  -8.483   3.859
   47    H    THR   9           H        THR   9 -16.922 -10.891   2.598
   48    HA   THR   9           HA       THR   9 -16.453 -10.383  -0.318
   49    HB   THR   9           HB       THR   9 -18.630 -12.130   0.889
   50    HG1  THR   9           HG1      THR   9 -16.911 -13.387   0.987
   51   1HG2  THR   9          1HG2      THR   9 -19.446 -11.198  -1.144
   52   2HG2  THR   9          2HG2      THR   9 -18.849 -12.800  -1.576
   53   3HG2  THR   9          3HG2      THR   9 -17.882 -11.370  -1.940
   54    H    ALA  10           H        ALA  10 -17.169  -8.338  -0.676
   55    HA   ALA  10           HA       ALA  10 -19.462  -7.300   0.916
   56   1HB   ALA  10          1HB       ALA  10 -18.760  -5.083  -0.032
   57   2HB   ALA  10          2HB       ALA  10 -17.428  -5.903  -0.846
   58   3HB   ALA  10          3HB       ALA  10 -17.501  -5.875   0.916
   59    H    GLY  11           H        GLY  11 -18.669  -8.398  -2.286
   60   1HA   GLY  11          2HA       GLY  11 -20.969  -8.889  -3.464
   61   2HA   GLY  11          1HA       GLY  11 -21.105  -7.131  -3.434
   62    H    SER  12           H        SER  12 -19.683  -5.881  -4.745
   63    HA   SER  12           HA       SER  12 -18.514  -7.401  -7.016
   64   1HB   SER  12          2HB       SER  12 -19.847  -4.848  -6.730
   65   2HB   SER  12          1HB       SER  12 -18.260  -4.614  -7.460
   66    HG   SER  12           HG       SER  12 -19.348  -5.206  -9.186
   67    H    LYS  13           H        LYS  13 -16.542  -8.118  -6.133
   68    HA   LYS  13           HA       LYS  13 -14.512  -5.985  -5.714
   69   1HB   LYS  13          2HB       LYS  13 -13.605  -7.400  -3.763
   70   2HB   LYS  13          1HB       LYS  13 -15.056  -6.449  -3.451
   71   1HG   LYS  13          2HG       LYS  13 -16.312  -8.298  -3.093
   72   2HG   LYS  13          1HG       LYS  13 -15.672  -9.103  -4.525
   73   1HD   LYS  13          2HD       LYS  13 -13.651  -8.890  -2.442
   74   2HD   LYS  13          1HD       LYS  13 -15.085  -9.738  -1.865
   75   1HE   LYS  13          2HE       LYS  13 -14.216 -10.515  -4.578
   76   2HE   LYS  13          1HE       LYS  13 -13.074 -10.922  -3.298
   77   1HZ   LYS  13          1HZ       LYS  13 -14.963 -11.939  -2.084
   78   2HZ   LYS  13          2HZ       LYS  13 -14.591 -12.717  -3.548
   79   3HZ   LYS  13          3HZ       LYS  13 -15.937 -11.685  -3.450
   80    H    VAL  14           H        VAL  14 -12.308  -6.750  -5.983
   81    HA   VAL  14           HA       VAL  14 -12.148  -9.204  -7.684
   82    HB   VAL  14           HB       VAL  14 -10.027  -8.161  -8.557
   83   1HG1  VAL  14          1HG1      VAL  14 -11.515  -6.041  -9.463
   84   2HG1  VAL  14          2HG1      VAL  14 -12.773  -7.146  -8.910
   85   3HG1  VAL  14          3HG1      VAL  14 -11.604  -7.676 -10.118
   86   1HG2  VAL  14          1HG2      VAL  14  -9.164  -6.295  -7.624
   87   2HG2  VAL  14          2HG2      VAL  14 -10.343  -6.480  -6.329
   88   3HG2  VAL  14          3HG2      VAL  14 -10.712  -5.460  -7.717
   89    H    THR  15           H        THR  15 -10.675 -10.819  -7.150
   90    HA   THR  15           HA       THR  15  -9.392 -10.567  -4.474
   91    HB   THR  15           HB       THR  15  -9.784 -13.054  -6.170
   92    HG1  THR  15           HG1      THR  15 -11.762 -12.892  -5.524
   93   1HG2  THR  15          1HG2      THR  15  -8.056 -13.462  -4.588
   94   2HG2  THR  15          2HG2      THR  15  -9.517 -14.112  -3.844
   95   3HG2  THR  15          3HG2      THR  15  -8.887 -12.548  -3.330
   96    H    PHE  16           H        PHE  16  -7.191 -10.616  -4.223
   97    HA   PHE  16           HA       PHE  16  -5.530 -10.900  -6.701
   98   1HB   PHE  16          2HB       PHE  16  -5.121  -9.193  -4.233
   99   2HB   PHE  16          1HB       PHE  16  -3.892  -9.418  -5.475
  100    HD1  PHE  16           HD1      PHE  16  -4.953  -9.142  -7.992
  101    HD2  PHE  16           HD2      PHE  16  -6.375  -7.243  -4.410
  102    HE1  PHE  16           HE1      PHE  16  -5.995  -7.351  -9.354
  103    HE2  PHE  16           HE2      PHE  16  -7.416  -5.454  -5.774
  104    HZ   PHE  16           HZ       PHE  16  -7.223  -5.508  -8.243
  105    H    LYS  17           H        LYS  17  -3.620 -12.118  -6.553
  106    HA   LYS  17           HA       LYS  17  -3.152 -13.591  -3.990
  107   1HB   LYS  17          2HB       LYS  17  -4.289 -14.892  -5.962
  108   2HB   LYS  17          1HB       LYS  17  -2.676 -14.872  -6.675
  109   1HG   LYS  17          2HG       LYS  17  -2.369 -15.621  -3.944
  110   2HG   LYS  17          1HG       LYS  17  -3.684 -16.593  -4.608
  111   1HD   LYS  17          2HD       LYS  17  -2.208 -17.164  -6.551
  112   2HD   LYS  17          1HD       LYS  17  -0.889 -16.310  -5.746
  113   1HE   LYS  17          2HE       LYS  17  -1.342 -17.833  -3.728
  114   2HE   LYS  17          1HE       LYS  17  -2.316 -18.810  -4.825
  115   1HZ   LYS  17          1HZ       LYS  17  -0.476 -19.281  -6.151
  116   2HZ   LYS  17          2HZ       LYS  17   0.105 -19.440  -4.564
  117   3HZ   LYS  17          3HZ       LYS  17   0.466 -18.049  -5.471
  118    H    ILE  18           H        ILE  18  -1.239 -12.702  -3.292
  119    HA   ILE  18           HA       ILE  18   0.932 -12.299  -5.314
  120    HB   ILE  18           HB       ILE  18   0.638 -10.955  -2.609
  121   1HG1  ILE  18          2HG1      ILE  18   0.346  -9.025  -4.578
  122   2HG1  ILE  18          1HG1      ILE  18  -0.566 -10.387  -5.230
  123   1HG2  ILE  18          1HG2      ILE  18   2.277  -9.349  -3.865
  124   2HG2  ILE  18          2HG2      ILE  18   2.571 -10.743  -4.905
  125   3HG2  ILE  18          3HG2      ILE  18   2.910 -10.844  -3.178
  126   1HD1  ILE  18          1HD1      ILE  18  -1.500 -10.509  -2.745
  127   2HD1  ILE  18          2HD1      ILE  18  -2.201  -9.399  -3.921
  128   3HD1  ILE  18          3HD1      ILE  18  -1.040  -8.808  -2.733
  129    H    THR  19           H        THR  19   2.793 -13.426  -5.066
  130    HA   THR  19           HA       THR  19   3.292 -14.829  -2.467
  131    HB   THR  19           HB       THR  19   4.441 -16.600  -3.950
  132    HG1  THR  19           HG1      THR  19   4.332 -16.282  -6.003
  133   1HG2  THR  19          1HG2      THR  19   2.492 -17.333  -2.899
  134   2HG2  THR  19          2HG2      THR  19   2.093 -17.551  -4.602
  135   3HG2  THR  19          3HG2      THR  19   1.481 -16.148  -3.726
  136    H    LEU  20           H        LEU  20   5.598 -15.130  -1.978
  137    HA   LEU  20           HA       LEU  20   7.201 -12.859  -2.876
  138   1HB   LEU  20          2HB       LEU  20   7.238 -14.687  -0.664
  139   2HB   LEU  20          1HB       LEU  20   8.821 -14.713  -1.439
  140    HG   LEU  20           HG       LEU  20   7.377 -12.153  -0.705
  141   1HD1  LEU  20          1HD1      LEU  20   8.653 -12.051   1.301
  142   2HD1  LEU  20          2HD1      LEU  20   9.676 -13.401   0.809
  143   3HD1  LEU  20          3HD1      LEU  20   7.995 -13.686   1.260
  144   1HD2  LEU  20          1HD2      LEU  20   9.305 -11.055  -1.377
  145   2HD2  LEU  20          2HD2      LEU  20   9.343 -12.424  -2.488
  146   3HD2  LEU  20          3HD2      LEU  20  10.339 -12.440  -1.034
  147    H    THR  21           H        THR  21   8.316 -12.889  -4.742
  148    HA   THR  21           HA       THR  21   9.117 -15.493  -5.928
  149    HB   THR  21           HB       THR  21   7.867 -13.837  -7.327
  150    HG1  THR  21           HG1      THR  21   8.991 -14.450  -9.008
  151   1HG2  THR  21          1HG2      THR  21   9.129 -11.861  -6.199
  152   2HG2  THR  21          2HG2      THR  21   8.768 -11.747  -7.922
  153   3HG2  THR  21          3HG2      THR  21  10.389 -12.190  -7.388
  154    H    SER  22           H        SER  22  10.510 -12.558  -4.552
  155    HA   SER  22           HA       SER  22  13.219 -13.100  -5.478
  156   1HB   SER  22          2HB       SER  22  13.834 -11.324  -3.801
  157   2HB   SER  22          1HB       SER  22  12.621 -10.812  -4.969
  158    HG   SER  22           HG       SER  22  12.349 -10.531  -2.494
  159    H    ASP  23           H        ASP  23  11.419 -13.679  -2.461
  160    HA   ASP  23           HA       ASP  23  13.756 -14.872  -1.140
  161   1HB   ASP  23          2HB       ASP  23  10.900 -14.325  -0.403
  162   2HB   ASP  23          1HB       ASP  23  11.798 -15.520   0.531
  163    HA   PRO  24           HA       PRO  24  13.017 -19.072  -2.213
  164   1HB   PRO  24          2HB       PRO  24  13.589 -20.351   0.159
  165   2HB   PRO  24          1HB       PRO  24  14.823 -19.659  -0.908
  166   1HG   PRO  24          2HG       PRO  24  13.777 -18.612   1.685
  167   2HG   PRO  24          1HG       PRO  24  15.370 -18.383   0.942
  168   1HD   PRO  24          2HD       PRO  24  13.285 -16.489   0.949
  169   2HD   PRO  24          1HD       PRO  24  14.711 -16.450  -0.110
  170    H    LYS  25           H        LYS  25  11.373 -17.885   0.693
  171    HA   LYS  25           HA       LYS  25   9.436 -20.073   0.787
  172   1HB   LYS  25          2HB       LYS  25  10.184 -17.852   2.447
  173   2HB   LYS  25          1HB       LYS  25   8.451 -17.760   2.137
  174   1HG   LYS  25          2HG       LYS  25   8.174 -19.330   3.723
  175   2HG   LYS  25          1HG       LYS  25   8.943 -20.477   2.623
  176   1HD   LYS  25          2HD       LYS  25  11.142 -19.247   3.618
  177   2HD   LYS  25          1HD       LYS  25  10.060 -19.096   5.003
  178   1HE   LYS  25          2HE       LYS  25   9.559 -21.639   4.499
  179   2HE   LYS  25          1HE       LYS  25  11.126 -21.574   3.692
  180   1HZ   LYS  25          1HZ       LYS  25  10.591 -20.771   6.501
  181   2HZ   LYS  25          2HZ       LYS  25  12.100 -20.711   5.720
  182   3HZ   LYS  25          3HZ       LYS  25  11.349 -22.206   6.012
  183    H    LEU  26           H        LEU  26   7.138 -19.801   0.319
  184    HA   LEU  26           HA       LEU  26   6.487 -17.515  -1.482
  185   1HB   LEU  26          2HB       LEU  26   6.686 -20.333  -2.203
  186   2HB   LEU  26          1HB       LEU  26   5.073 -19.698  -2.526
  187    HG   LEU  26           HG       LEU  26   6.759 -17.663  -3.402
  188   1HD1  LEU  26          1HD1      LEU  26   8.486 -19.706  -3.146
  189   2HD1  LEU  26          2HD1      LEU  26   8.605 -18.537  -4.461
  190   3HD1  LEU  26          3HD1      LEU  26   7.838 -20.101  -4.738
  191   1HD2  LEU  26          1HD2      LEU  26   4.687 -18.480  -4.481
  192   2HD2  LEU  26          2HD2      LEU  26   5.532 -19.943  -4.989
  193   3HD2  LEU  26          3HD2      LEU  26   6.010 -18.375  -5.642
  194    HA   PRO  27           HA       PRO  27   3.218 -18.301   1.722
  195   1HB   PRO  27          2HB       PRO  27   3.352 -15.791   2.851
  196   2HB   PRO  27          1HB       PRO  27   4.315 -17.169   3.411
  197   1HG   PRO  27          2HG       PRO  27   5.176 -14.803   1.817
  198   2HG   PRO  27          1HG       PRO  27   6.128 -15.834   2.896
  199   1HD   PRO  27          2HD       PRO  27   6.124 -15.956   0.068
  200   2HD   PRO  27          1HD       PRO  27   6.800 -17.176   1.168
  201    H    PHE  28           H        PHE  28   1.650 -18.298   0.036
  202    HA   PHE  28           HA       PHE  28   1.039 -16.150  -1.693
  203   1HB   PHE  28          2HB       PHE  28  -1.090 -17.248  -2.113
  204   2HB   PHE  28          1HB       PHE  28   0.175 -18.464  -1.984
  205    HD1  PHE  28           HD1      PHE  28   0.315 -19.934  -0.004
  206    HD2  PHE  28           HD2      PHE  28  -2.815 -17.021  -0.415
  207    HE1  PHE  28           HE1      PHE  28  -0.959 -21.047   1.809
  208    HE2  PHE  28           HE2      PHE  28  -4.087 -18.133   1.399
  209    HZ   PHE  28           HZ       PHE  28  -3.160 -20.145   2.511
  210    H    LYS  29           H        LYS  29  -0.494 -14.500  -1.632
  211    HA   LYS  29           HA       LYS  29  -1.661 -13.865   1.049
  212   1HB   LYS  29          2HB       LYS  29   0.423 -12.481  -0.083
  213   2HB   LYS  29          1HB       LYS  29  -0.963 -11.573  -0.685
  214   1HG   LYS  29          2HG       LYS  29  -0.849 -12.334   2.219
  215   2HG   LYS  29          1HG       LYS  29   0.084 -10.951   1.646
  216   1HD   LYS  29          2HD       LYS  29  -1.933  -9.912   0.745
  217   2HD   LYS  29          1HD       LYS  29  -2.892 -11.322   1.193
  218   1HE   LYS  29          2HE       LYS  29  -2.050 -10.885   3.600
  219   2HE   LYS  29          1HE       LYS  29  -1.588  -9.293   3.002
  220   1HZ   LYS  29          1HZ       LYS  29  -4.299 -10.491   3.004
  221   2HZ   LYS  29          2HZ       LYS  29  -3.907  -9.050   2.195
  222   3HZ   LYS  29          3HZ       LYS  29  -3.771  -9.142   3.885
  223    H    VAL  30           H        VAL  30  -3.848 -13.827   0.863
  224    HA   VAL  30           HA       VAL  30  -5.052 -13.331  -1.812
  225    HB   VAL  30           HB       VAL  30  -6.349 -14.337   0.744
  226   1HG1  VAL  30          1HG1      VAL  30  -7.507 -13.276  -1.575
  227   2HG1  VAL  30          2HG1      VAL  30  -8.316 -14.270  -0.363
  228   3HG1  VAL  30          3HG1      VAL  30  -7.609 -15.022  -1.793
  229   1HG2  VAL  30          1HG2      VAL  30  -5.263 -15.785  -1.690
  230   2HG2  VAL  30          2HG2      VAL  30  -6.322 -16.538  -0.497
  231   3HG2  VAL  30          3HG2      VAL  30  -4.725 -15.962  -0.019
  232    H    LEU  31           H        LEU  31  -5.687 -11.289  -2.229
  233    HA   LEU  31           HA       LEU  31  -6.577  -9.575   0.057
  234   1HB   LEU  31          2HB       LEU  31  -4.657  -9.120  -2.076
  235   2HB   LEU  31          1HB       LEU  31  -5.929  -7.900  -2.104
  236    HG   LEU  31           HG       LEU  31  -4.921  -8.556   0.593
  237   1HD1  LEU  31          1HD1      LEU  31  -2.808  -8.697  -0.619
  238   2HD1  LEU  31          2HD1      LEU  31  -2.862  -7.178   0.275
  239   3HD1  LEU  31          3HD1      LEU  31  -3.158  -7.190  -1.463
  240   1HD2  LEU  31          1HD2      LEU  31  -4.976  -5.836  -0.678
  241   2HD2  LEU  31          2HD2      LEU  31  -5.380  -6.305   0.974
  242   3HD2  LEU  31          3HD2      LEU  31  -6.504  -6.648  -0.340
  243    H    SER  32           H        SER  32  -8.787  -9.685  -0.015
  244    HA   SER  32           HA       SER  32 -10.149  -9.507  -2.659
  245   1HB   SER  32          2HB       SER  32 -10.910 -10.545   0.036
  246   2HB   SER  32          1HB       SER  32 -12.194  -9.875  -0.967
  247    HG   SER  32           HG       SER  32 -11.006 -12.246  -1.151
  248    H    VAL  33           H        VAL  33 -10.188  -7.353  -3.195
  249    HA   VAL  33           HA       VAL  33 -11.629  -5.529  -1.322
  250    HB   VAL  33           HB       VAL  33 -10.077  -3.679  -2.108
  251   1HG1  VAL  33          1HG1      VAL  33  -8.405  -4.172  -0.466
  252   2HG1  VAL  33          2HG1      VAL  33  -8.634  -5.910  -0.659
  253   3HG1  VAL  33          3HG1      VAL  33  -9.892  -4.932   0.099
  254   1HG2  VAL  33          1HG2      VAL  33  -8.311  -5.992  -2.963
  255   2HG2  VAL  33          2HG2      VAL  33  -7.966  -4.269  -3.117
  256   3HG2  VAL  33          3HG2      VAL  33  -9.235  -5.006  -4.096
  257    HA   PRO  34           HA       PRO  34 -13.948  -4.440  -4.889
  258   1HB   PRO  34          2HB       PRO  34 -14.612  -1.841  -4.268
  259   2HB   PRO  34          1HB       PRO  34 -15.362  -3.258  -3.513
  260   1HG   PRO  34          2HG       PRO  34 -13.317  -1.390  -2.391
  261   2HG   PRO  34          1HG       PRO  34 -14.557  -2.336  -1.548
  262   1HD   PRO  34          2HD       PRO  34 -11.829  -3.005  -1.694
  263   2HD   PRO  34          1HD       PRO  34 -13.139  -4.118  -1.244
  264    H    GLU  35           H        GLU  35 -13.937  -3.033  -6.808
  265    HA   GLU  35           HA       GLU  35 -11.359  -2.445  -7.826
  266   1HB   GLU  35          2HB       GLU  35 -12.565  -1.214  -9.639
  267   2HB   GLU  35          1HB       GLU  35 -13.229  -2.817  -9.331
  268   1HG   GLU  35          2HG       GLU  35 -14.476  -0.761  -7.661
  269   2HG   GLU  35          1HG       GLU  35 -14.674  -0.438  -9.382
  270    H    SER  36           H        SER  36 -13.507  -0.460  -5.890
  271    HA   SER  36           HA       SER  36 -12.459   2.121  -6.500
  272   1HB   SER  36          2HB       SER  36 -14.291   1.024  -4.637
  273   2HB   SER  36          1HB       SER  36 -13.092   1.900  -3.691
  274    HG   SER  36           HG       SER  36 -14.894   3.177  -4.492
  275    H    THR  37           H        THR  37 -11.385  -0.354  -4.163
  276    HA   THR  37           HA       THR  37  -9.312   1.213  -2.947
  277    HB   THR  37           HB       THR  37  -9.531  -1.797  -3.300
  278    HG1  THR  37           HG1      THR  37 -11.187  -1.156  -2.058
  279   1HG2  THR  37          1HG2      THR  37  -7.221  -0.735  -2.736
  280   2HG2  THR  37          2HG2      THR  37  -7.810  -2.052  -1.721
  281   3HG2  THR  37          3HG2      THR  37  -7.944  -0.383  -1.167
  282    HA   PRO  38           HA       PRO  38  -6.570   1.242  -6.454
  283   1HB   PRO  38          2HB       PRO  38  -4.593   2.698  -5.217
  284   2HB   PRO  38          1HB       PRO  38  -6.071   3.415  -5.880
  285   1HG   PRO  38          2HG       PRO  38  -5.339   2.921  -3.032
  286   2HG   PRO  38          1HG       PRO  38  -6.426   4.140  -3.715
  287   1HD   PRO  38          2HD       PRO  38  -7.218   1.736  -2.452
  288   2HD   PRO  38          1HD       PRO  38  -8.259   2.794  -3.429
  289    H    PHE  39           H        PHE  39  -4.313   0.510  -6.922
  290    HA   PHE  39           HA       PHE  39  -3.673  -1.955  -5.591
  291   1HB   PHE  39          2HB       PHE  39  -3.082  -1.052  -8.019
  292   2HB   PHE  39          1HB       PHE  39  -1.606  -0.523  -7.214
  293    HD1  PHE  39           HD1      PHE  39  -3.788  -3.554  -6.780
  294    HD2  PHE  39           HD2      PHE  39   0.118  -2.021  -7.707
  295    HE1  PHE  39           HE1      PHE  39  -2.902  -5.867  -6.883
  296    HE2  PHE  39           HE2      PHE  39   0.998  -4.332  -7.810
  297    HZ   PHE  39           HZ       PHE  39  -0.509  -6.257  -7.396
  298    H    THR  40           H        THR  40  -2.852   1.335  -4.873
  299    HA   THR  40           HA       THR  40  -0.350   0.969  -3.530
  300    HB   THR  40           HB       THR  40  -1.512   2.954  -2.061
  301    HG1  THR  40           HG1      THR  40  -3.224   3.696  -2.994
  302   1HG2  THR  40          1HG2      THR  40  -0.461   4.506  -3.603
  303   2HG2  THR  40          2HG2      THR  40  -0.479   3.296  -4.883
  304   3HG2  THR  40          3HG2      THR  40   0.545   3.064  -3.467
  305    H    ALA  41           H        ALA  41  -3.717   0.842  -2.350
  306    HA   ALA  41           HA       ALA  41  -2.995   0.094   0.353
  307   1HB   ALA  41          1HB       ALA  41  -5.610  -0.245  -1.153
  308   2HB   ALA  41          2HB       ALA  41  -5.167   1.137  -0.152
  309   3HB   ALA  41          3HB       ALA  41  -5.406  -0.446   0.587
  310    H    VAL  42           H        VAL  42  -3.927  -1.711  -2.580
  311    HA   VAL  42           HA       VAL  42  -4.121  -4.303  -1.400
  312    HB   VAL  42           HB       VAL  42  -3.227  -3.509  -4.195
  313   1HG1  VAL  42          1HG1      VAL  42  -2.548  -5.719  -4.118
  314   2HG1  VAL  42          2HG1      VAL  42  -4.242  -5.946  -4.550
  315   3HG1  VAL  42          3HG1      VAL  42  -3.723  -6.150  -2.877
  316   1HG2  VAL  42          1HG2      VAL  42  -5.714  -4.517  -4.476
  317   2HG2  VAL  42          2HG2      VAL  42  -5.421  -2.807  -4.167
  318   3HG2  VAL  42          3HG2      VAL  42  -5.858  -3.881  -2.838
  319    H    LEU  43           H        LEU  43  -1.312  -2.687  -2.937
  320    HA   LEU  43           HA       LEU  43   0.582  -4.770  -2.431
  321   1HB   LEU  43          2HB       LEU  43   1.270  -3.135  -3.991
  322   2HB   LEU  43          1HB       LEU  43   0.810  -1.802  -2.935
  323    HG   LEU  43           HG       LEU  43   2.650  -2.479  -1.368
  324   1HD1  LEU  43          1HD1      LEU  43   4.341  -4.057  -2.130
  325   2HD1  LEU  43          2HD1      LEU  43   3.484  -4.289  -3.651
  326   3HD1  LEU  43          3HD1      LEU  43   2.770  -4.858  -2.144
  327   1HD2  LEU  43          1HD2      LEU  43   4.523  -1.867  -3.107
  328   2HD2  LEU  43          2HD2      LEU  43   3.266  -0.687  -2.738
  329   3HD2  LEU  43          3HD2      LEU  43   3.166  -1.651  -4.211
  330    H    LYS  44           H        LYS  44  -0.581  -2.084  -0.439
  331    HA   LYS  44           HA       LYS  44   1.373  -2.234   1.643
  332   1HB   LYS  44          2HB       LYS  44  -1.238  -0.986   1.219
  333   2HB   LYS  44          1HB       LYS  44  -1.025  -1.517   2.885
  334   1HG   LYS  44          2HG       LYS  44   1.369  -0.388   2.563
  335   2HG   LYS  44          1HG       LYS  44   0.499   0.536   1.338
  336   1HD   LYS  44          2HD       LYS  44  -0.418   1.817   2.944
  337   2HD   LYS  44          1HD       LYS  44  -1.153   0.387   3.665
  338   1HE   LYS  44          2HE       LYS  44   0.177   0.811   5.446
  339   2HE   LYS  44          1HE       LYS  44   1.485   0.165   4.454
  340   1HZ   LYS  44          1HZ       LYS  44   1.118   2.808   3.681
  341   2HZ   LYS  44          2HZ       LYS  44   2.430   2.157   4.538
  342   3HZ   LYS  44          3HZ       LYS  44   1.101   2.809   5.375
  343    H    PHE  45           H        PHE  45  -1.906  -3.695   1.481
  344    HA   PHE  45           HA       PHE  45  -1.722  -5.200   3.883
  345   1HB   PHE  45          2HB       PHE  45  -3.337  -5.495   1.360
  346   2HB   PHE  45          1HB       PHE  45  -3.416  -6.739   2.606
  347    HD1  PHE  45           HD1      PHE  45  -4.609  -3.519   1.571
  348    HD2  PHE  45           HD2      PHE  45  -3.912  -5.969   5.031
  349    HE1  PHE  45           HE1      PHE  45  -6.161  -2.103   2.888
  350    HE2  PHE  45           HE2      PHE  45  -5.467  -4.552   6.344
  351    HZ   PHE  45           HZ       PHE  45  -6.590  -2.620   5.273
  352    H    ALA  46           H        ALA  46  -0.773  -6.064   0.550
  353    HA   ALA  46           HA       ALA  46  -0.027  -8.778   1.123
  354   1HB   ALA  46          1HB       ALA  46   0.416  -6.843  -1.083
  355   2HB   ALA  46          2HB       ALA  46  -0.075  -8.536  -1.152
  356   3HB   ALA  46          3HB       ALA  46   1.625  -8.117  -0.938
  357    H    ALA  47           H        ALA  47   1.918  -5.774   0.952
  358    HA   ALA  47           HA       ALA  47   4.422  -6.926   1.673
  359   1HB   ALA  47          1HB       ALA  47   5.121  -4.798   1.425
  360   2HB   ALA  47          2HB       ALA  47   4.117  -4.261   2.773
  361   3HB   ALA  47          3HB       ALA  47   3.443  -4.338   1.144
  362    H    GLU  48           H        GLU  48   1.685  -5.861   3.649
  363    HA   GLU  48           HA       GLU  48   2.960  -5.850   6.201
  364   1HB   GLU  48          2HB       GLU  48   0.233  -5.826   5.173
  365   2HB   GLU  48          1HB       GLU  48   0.359  -6.813   6.628
  366   1HG   GLU  48          2HG       GLU  48   0.338  -4.914   7.838
  367   2HG   GLU  48          1HG       GLU  48   1.911  -4.519   7.148
  368    H    GLU  49           H        GLU  49   1.353  -8.485   4.399
  369    HA   GLU  49           HA       GLU  49   1.817 -10.503   6.424
  370   1HB   GLU  49          2HB       GLU  49   0.071 -10.742   4.682
  371   2HB   GLU  49          1HB       GLU  49   1.321 -10.809   3.441
  372   1HG   GLU  49          2HG       GLU  49   1.861 -12.724   5.565
  373   2HG   GLU  49          1HG       GLU  49   0.262 -12.983   4.870
  374    H    PHE  50           H        PHE  50   3.562  -9.469   3.499
  375    HA   PHE  50           HA       PHE  50   5.598 -11.528   3.672
  376   1HB   PHE  50          2HB       PHE  50   5.384  -8.922   2.162
  377   2HB   PHE  50          1HB       PHE  50   6.818  -9.940   2.069
  378    HD1  PHE  50           HD1      PHE  50   3.770  -9.245   0.522
  379    HD2  PHE  50           HD2      PHE  50   6.207 -12.571   1.725
  380    HE1  PHE  50           HE1      PHE  50   2.628 -10.683  -1.142
  381    HE2  PHE  50           HE2      PHE  50   5.065 -14.008   0.057
  382    HZ   PHE  50           HZ       PHE  50   3.277 -13.064  -1.374
  383    H    LYS  51           H        LYS  51   5.074  -8.685   5.490
  384    HA   LYS  51           HA       LYS  51   6.344  -7.649   7.152
  385   1HB   LYS  51          2HB       LYS  51   7.398 -10.313   6.952
  386   2HB   LYS  51          1HB       LYS  51   8.741  -9.197   7.195
  387   1HG   LYS  51          2HG       LYS  51   8.181  -8.937   9.356
  388   2HG   LYS  51          1HG       LYS  51   6.556  -8.423   8.902
  389   1HD   LYS  51          2HD       LYS  51   5.765 -10.701   8.858
  390   2HD   LYS  51          1HD       LYS  51   7.404 -11.332   9.031
  391   1HE   LYS  51          2HE       LYS  51   7.530 -10.121  11.254
  392   2HE   LYS  51          1HE       LYS  51   5.809  -9.779  11.085
  393   1HZ   LYS  51          1HZ       LYS  51   6.635 -11.899  12.335
  394   2HZ   LYS  51          2HZ       LYS  51   6.734 -12.543  10.765
  395   3HZ   LYS  51          3HZ       LYS  51   5.251 -11.960  11.357
  396    H    VAL  52           H        VAL  52   6.537  -6.720   4.483
  397    HA   VAL  52           HA       VAL  52   9.305  -5.590   4.506
  398    HB   VAL  52           HB       VAL  52   9.253  -5.642   1.991
  399   1HG1  VAL  52          1HG1      VAL  52  10.004  -7.606   3.751
  400   2HG1  VAL  52          2HG1      VAL  52  10.324  -7.642   2.017
  401   3HG1  VAL  52          3HG1      VAL  52   8.925  -8.490   2.672
  402   1HG2  VAL  52          1HG2      VAL  52   6.680  -7.089   2.580
  403   2HG2  VAL  52          2HG2      VAL  52   7.602  -7.492   1.133
  404   3HG2  VAL  52          3HG2      VAL  52   7.005  -5.850   1.369
  405    HA   PRO  53           HA       PRO  53   7.265  -1.724   4.015
  406   1HB   PRO  53          2HB       PRO  53   9.172  -0.325   2.610
  407   2HB   PRO  53          1HB       PRO  53   9.288  -0.697   4.337
  408   1HG   PRO  53          2HG       PRO  53  10.740  -1.941   2.046
  409   2HG   PRO  53          1HG       PRO  53  11.239  -1.790   3.739
  410   1HD   PRO  53          2HD       PRO  53  10.218  -4.126   2.528
  411   2HD   PRO  53          1HD       PRO  53  10.372  -3.845   4.275
  412    H    ALA  54           H        ALA  54   5.614  -1.258   2.667
  413    HA   ALA  54           HA       ALA  54   5.512  -2.202  -0.081
  414   1HB   ALA  54          1HB       ALA  54   3.310  -1.994   0.328
  415   2HB   ALA  54          2HB       ALA  54   3.490  -0.241   0.394
  416   3HB   ALA  54          3HB       ALA  54   3.664  -1.201   1.862
  417    H    ALA  55           H        ALA  55   6.264   0.878   1.469
  418    HA   ALA  55           HA       ALA  55   5.996   2.602  -0.783
  419   1HB   ALA  55          1HB       ALA  55   8.196   2.986   1.230
  420   2HB   ALA  55          2HB       ALA  55   6.514   3.126   1.739
  421   3HB   ALA  55          3HB       ALA  55   7.147   4.192   0.486
  422    H    THR  56           H        THR  56   8.731   0.571   0.280
  423    HA   THR  56           HA       THR  56  10.171   1.315  -2.232
  424    HB   THR  56           HB       THR  56  12.171   0.290  -1.063
  425    HG1  THR  56           HG1      THR  56  11.832  -0.680   0.748
  426   1HG2  THR  56          1HG2      THR  56  11.780   2.261   0.880
  427   2HG2  THR  56          2HG2      THR  56  10.787   2.781  -0.480
  428   3HG2  THR  56          3HG2      THR  56  12.510   2.487  -0.708
  429    H    SER  57           H        SER  57   7.951  -0.585  -2.207
  430    HA   SER  57           HA       SER  57   9.433  -2.990  -3.164
  431   1HB   SER  57          2HB       SER  57   8.487  -3.511  -0.945
  432   2HB   SER  57          1HB       SER  57   6.890  -3.029  -1.507
  433    HG   SER  57           HG       SER  57   8.077  -5.387  -1.736
  434    H    ALA  58           H        ALA  58   8.497  -4.013  -4.951
  435    HA   ALA  58           HA       ALA  58   6.217  -2.549  -6.231
  436   1HB   ALA  58          1HB       ALA  58   8.624  -2.510  -7.280
  437   2HB   ALA  58          2HB       ALA  58   7.232  -2.789  -8.324
  438   3HB   ALA  58          3HB       ALA  58   8.226  -4.147  -7.798
  439    H    ILE  59           H        ILE  59   5.016  -4.015  -7.843
  440    HA   ILE  59           HA       ILE  59   4.818  -6.791  -6.735
  441    HB   ILE  59           HB       ILE  59   2.642  -4.896  -7.649
  442   1HG1  ILE  59          2HG1      ILE  59   3.437  -4.721  -5.296
  443   2HG1  ILE  59          1HG1      ILE  59   1.760  -5.251  -5.400
  444   1HG2  ILE  59          1HG2      ILE  59   1.641  -6.754  -8.490
  445   2HG2  ILE  59          2HG2      ILE  59   1.333  -7.147  -6.798
  446   3HG2  ILE  59          3HG2      ILE  59   2.724  -7.846  -7.627
  447   1HD1  ILE  59          1HD1      ILE  59   3.045  -7.656  -5.449
  448   2HD1  ILE  59          2HD1      ILE  59   2.456  -6.892  -3.974
  449   3HD1  ILE  59          3HD1      ILE  59   4.147  -6.720  -4.442
  450    H    ILE  60           H        ILE  60   5.592  -8.164  -8.278
  451    HA   ILE  60           HA       ILE  60   5.202  -7.453 -11.141
  452    HB   ILE  60           HB       ILE  60   6.823  -9.259 -11.613
  453   1HG1  ILE  60          2HG1      ILE  60   7.739  -9.649  -8.880
  454   2HG1  ILE  60          1HG1      ILE  60   6.067 -10.177  -9.065
  455   1HG2  ILE  60          1HG2      ILE  60   7.830  -7.134 -11.320
  456   2HG2  ILE  60          2HG2      ILE  60   8.779  -8.218 -10.304
  457   3HG2  ILE  60          3HG2      ILE  60   7.571  -7.159  -9.577
  458   1HD1  ILE  60          1HD1      ILE  60   8.542 -11.277 -10.277
  459   2HD1  ILE  60          2HD1      ILE  60   7.131 -11.209 -11.334
  460   3HD1  ILE  60          3HD1      ILE  60   7.053 -12.100  -9.815
  461    H    THR  61           H        THR  61   4.722  -9.513 -12.561
  462    HA   THR  61           HA       THR  61   2.424 -10.914 -11.262
  463    HB   THR  61           HB       THR  61   1.597 -11.290 -13.568
  464    HG1  THR  61           HG1      THR  61   2.778 -10.777 -15.246
  465   1HG2  THR  61          1HG2      THR  61   0.961  -9.251 -12.304
  466   2HG2  THR  61          2HG2      THR  61   1.009  -8.966 -14.042
  467   3HG2  THR  61          3HG2      THR  61   2.329  -8.402 -13.022
  468    H    ASN  62           H        ASN  62   2.013 -13.167 -12.207
  469    HA   ASN  62           HA       ASN  62   4.285 -14.845 -11.698
  470   1HB   ASN  62          2HB       ASN  62   1.534 -15.329 -12.835
  471   2HB   ASN  62          1HB       ASN  62   2.725 -16.629 -12.771
  472   1HD2  ASN  62          1HD2      ASN  62   2.993 -17.689 -10.769
  473   2HD2  ASN  62          2HD2      ASN  62   2.298 -17.163  -9.313
  474    H    ASP  63           H        ASP  63   3.049 -13.360 -14.620
  475    HA   ASP  63           HA       ASP  63   4.525 -15.104 -16.448
  476   1HB   ASP  63          2HB       ASP  63   3.306 -12.371 -16.970
  477   2HB   ASP  63          1HB       ASP  63   3.788 -13.554 -18.186
  478    H    GLY  64           H        GLY  64   4.877 -11.709 -15.344
  479   1HA   GLY  64          2HA       GLY  64   7.420 -11.372 -14.701
  480   2HA   GLY  64          1HA       GLY  64   7.650 -11.680 -16.421
  481    H    VAL  65           H        VAL  65   5.269  -9.745 -14.566
  482    HA   VAL  65           HA       VAL  65   6.058  -7.375 -16.215
  483    HB   VAL  65           HB       VAL  65   3.249  -8.116 -15.322
  484   1HG1  VAL  65          1HG1      VAL  65   4.223  -5.882 -17.130
  485   2HG1  VAL  65          2HG1      VAL  65   3.733  -5.667 -15.450
  486   3HG1  VAL  65          3HG1      VAL  65   2.554  -6.191 -16.653
  487   1HG2  VAL  65          1HG2      VAL  65   4.544  -8.145 -18.069
  488   2HG2  VAL  65          2HG2      VAL  65   2.837  -8.447 -17.746
  489   3HG2  VAL  65          3HG2      VAL  65   4.059  -9.565 -17.144
  490    H    GLY  66           H        GLY  66   6.858  -5.823 -14.895
  491   1HA   GLY  66          2HA       GLY  66   6.506  -5.932 -12.009
  492   2HA   GLY  66          1HA       GLY  66   7.411  -4.708 -12.896
  493    H    VAL  67           H        VAL  67   4.195  -5.666 -11.830
  494    HA   VAL  67           HA       VAL  67   2.870  -3.263 -12.809
  495    HB   VAL  67           HB       VAL  67   1.966  -5.197 -10.648
  496   1HG1  VAL  67          1HG1      VAL  67   0.424  -3.267 -12.412
  497   2HG1  VAL  67          2HG1      VAL  67   0.737  -3.055 -10.690
  498   3HG1  VAL  67          3HG1      VAL  67  -0.284  -4.382 -11.244
  499   1HG2  VAL  67          1HG2      VAL  67   1.974  -6.669 -12.389
  500   2HG2  VAL  67          2HG2      VAL  67   2.093  -5.390 -13.597
  501   3HG2  VAL  67          3HG2      VAL  67   0.527  -5.800 -12.898
  502    H    ASN  68           H        ASN  68   2.534  -1.344 -11.715
  503    HA   ASN  68           HA       ASN  68   3.951  -1.042  -9.106
  504   1HB   ASN  68          2HB       ASN  68   3.294   0.850 -11.354
  505   2HB   ASN  68          1HB       ASN  68   3.622   1.477  -9.740
  506   1HD2  ASN  68          1HD2      ASN  68   5.575   2.448 -11.003
  507   2HD2  ASN  68          2HD2      ASN  68   6.972   1.491 -11.111
  508    HA   PRO  69           HA       PRO  69   0.171  -0.232  -7.006
  509   1HB   PRO  69          2HB       PRO  69   1.111   1.430  -5.024
  510   2HB   PRO  69          1HB       PRO  69   1.394  -0.319  -5.050
  511   1HG   PRO  69          2HG       PRO  69   3.291   1.897  -5.654
  512   2HG   PRO  69          1HG       PRO  69   3.629   0.256  -5.080
  513   1HD   PRO  69          2HD       PRO  69   3.918   1.186  -7.744
  514   2HD   PRO  69          1HD       PRO  69   3.963  -0.508  -7.213
  515    H    ALA  70           H        ALA  70  -0.268   1.114  -9.139
  516    HA   ALA  70           HA       ALA  70  -0.872   3.926  -8.319
  517   1HB   ALA  70          1HB       ALA  70   1.116   3.691  -9.927
  518   2HB   ALA  70          2HB       ALA  70  -0.178   4.781 -10.430
  519   3HB   ALA  70          3HB       ALA  70  -0.060   3.165 -11.131
  520    H    GLN  71           H        GLN  71  -1.664   1.243 -10.540
  521    HA   GLN  71           HA       GLN  71  -4.166   2.430 -11.426
  522   1HB   GLN  71          2HB       GLN  71  -3.002  -0.360 -11.628
  523   2HB   GLN  71          1HB       GLN  71  -4.579   0.063 -12.294
  524   1HG   GLN  71          2HG       GLN  71  -3.677   1.254 -14.016
  525   2HG   GLN  71          1HG       GLN  71  -2.387   1.915 -13.011
  526   1HE2  GLN  71          1HE2      GLN  71  -0.415   0.630 -12.756
  527   2HE2  GLN  71          2HE2      GLN  71  -0.078  -0.678 -13.786
  528    HA   PRO  72           HA       PRO  72  -6.832   1.049  -8.202
  529   1HB   PRO  72          2HB       PRO  72  -9.146   0.638  -9.630
  530   2HB   PRO  72          1HB       PRO  72  -8.515   2.243  -9.225
  531   1HG   PRO  72          2HG       PRO  72  -8.480   0.819 -11.845
  532   2HG   PRO  72          1HG       PRO  72  -8.470   2.558 -11.514
  533   1HD   PRO  72          2HD       PRO  72  -6.224   1.002 -12.242
  534   2HD   PRO  72          1HD       PRO  72  -6.180   2.650 -11.578
  535    H    ALA  73           H        ALA  73  -8.062  -0.849  -7.419
  536    HA   ALA  73           HA       ALA  73  -6.896  -3.358  -8.048
  537   1HB   ALA  73          1HB       ALA  73  -7.954  -3.133  -5.926
  538   2HB   ALA  73          2HB       ALA  73  -8.940  -4.293  -6.816
  539   3HB   ALA  73          3HB       ALA  73  -9.476  -2.620  -6.655
  540    H    GLY  74           H        GLY  74  -9.908  -1.870  -9.240
  541   1HA   GLY  74          2HA       GLY  74 -10.929  -4.123 -10.652
  542   2HA   GLY  74          1HA       GLY  74 -11.280  -2.442 -11.053
  543    H    ASN  75           H        ASN  75  -8.685  -1.544 -11.702
  544    HA   ASN  75           HA       ASN  75  -8.423  -2.535 -14.409
  545   1HB   ASN  75          2HB       ASN  75  -7.779  -0.196 -13.274
  546   2HB   ASN  75          1HB       ASN  75  -6.206  -0.983 -13.142
  547   1HD2  ASN  75          1HD2      ASN  75  -5.037  -1.440 -15.119
  548   2HD2  ASN  75          2HD2      ASN  75  -5.546  -0.841 -16.624
  549    H    ILE  76           H        ILE  76  -6.548  -3.020 -11.414
  550    HA   ILE  76           HA       ILE  76  -4.377  -4.479 -12.572
  551    HB   ILE  76           HB       ILE  76  -5.593  -4.665  -9.795
  552   1HG1  ILE  76          2HG1      ILE  76  -4.722  -2.419 -10.468
  553   2HG1  ILE  76          1HG1      ILE  76  -3.799  -3.136  -9.153
  554   1HG2  ILE  76          1HG2      ILE  76  -4.165  -6.643 -10.522
  555   2HG2  ILE  76          2HG2      ILE  76  -3.587  -5.781  -9.098
  556   3HG2  ILE  76          3HG2      ILE  76  -2.817  -5.516 -10.662
  557   1HD1  ILE  76          1HD1      ILE  76  -2.073  -3.873 -10.728
  558   2HD1  ILE  76          2HD1      ILE  76  -2.329  -2.136 -10.892
  559   3HD1  ILE  76          3HD1      ILE  76  -3.012  -3.245 -12.080
  560    H    PHE  77           H        PHE  77  -7.476  -5.594 -11.177
  561    HA   PHE  77           HA       PHE  77  -6.997  -8.397 -11.650
  562   1HB   PHE  77          2HB       PHE  77  -8.751  -7.323 -10.101
  563   2HB   PHE  77          1HB       PHE  77  -9.722  -7.086 -11.553
  564    HD1  PHE  77           HD1      PHE  77 -10.743  -8.951 -12.709
  565    HD2  PHE  77           HD2      PHE  77  -8.190  -9.604  -9.316
  566    HE1  PHE  77           HE1      PHE  77 -11.510 -11.305 -12.583
  567    HE2  PHE  77           HE2      PHE  77  -8.957 -11.958  -9.193
  568    HZ   PHE  77           HZ       PHE  77 -10.618 -12.809 -10.826
  569    H    LEU  78           H        LEU  78  -8.522  -5.820 -13.564
  570    HA   LEU  78           HA       LEU  78  -9.516  -7.506 -15.673
  571   1HB   LEU  78          2HB       LEU  78  -9.221  -4.637 -15.157
  572   2HB   LEU  78          1HB       LEU  78  -8.954  -5.046 -16.849
  573    HG   LEU  78           HG       LEU  78 -11.344  -4.533 -16.327
  574   1HD1  LEU  78          1HD1      LEU  78 -10.392  -7.127 -17.448
  575   2HD1  LEU  78          2HD1      LEU  78 -11.289  -5.823 -18.228
  576   3HD1  LEU  78          3HD1      LEU  78 -12.126  -6.960 -17.171
  577   1HD2  LEU  78          1HD2      LEU  78 -10.815  -6.532 -14.243
  578   2HD2  LEU  78          2HD2      LEU  78 -12.281  -6.869 -15.164
  579   3HD2  LEU  78          3HD2      LEU  78 -12.093  -5.322 -14.340
  580    H    LYS  79           H        LYS  79  -6.414  -5.850 -15.154
  581    HA   LYS  79           HA       LYS  79  -5.360  -6.511 -17.780
  582   1HB   LYS  79          2HB       LYS  79  -4.637  -4.683 -15.948
  583   2HB   LYS  79          1HB       LYS  79  -3.505  -5.962 -15.511
  584   1HG   LYS  79          2HG       LYS  79  -2.451  -5.925 -17.595
  585   2HG   LYS  79          1HG       LYS  79  -3.842  -5.198 -18.397
  586   1HD   LYS  79          2HD       LYS  79  -2.954  -3.155 -18.095
  587   2HD   LYS  79          1HD       LYS  79  -2.989  -3.402 -16.349
  588   1HE   LYS  79          2HE       LYS  79  -0.815  -4.931 -17.379
  589   2HE   LYS  79          1HE       LYS  79  -0.708  -3.321 -18.087
  590   1HZ   LYS  79          1HZ       LYS  79   0.430  -3.209 -16.056
  591   2HZ   LYS  79          2HZ       LYS  79  -0.784  -4.053 -15.220
  592   3HZ   LYS  79          3HZ       LYS  79  -1.064  -2.465 -15.759
  593    H    HIS  80           H        HIS  80  -4.478  -7.699 -14.498
  594    HA   HIS  80           HA       HIS  80  -3.465 -10.191 -15.806
  595   1HB   HIS  80          2HB       HIS  80  -2.799  -8.997 -13.097
  596   2HB   HIS  80          1HB       HIS  80  -2.130 -10.499 -13.736
  597    HD1  HIS  80           HD1      HIS  80  -0.758 -10.229 -16.070
  598    HD2  HIS  80           HD2      HIS  80  -1.447  -6.716 -13.932
  599    HE1  HIS  80           HE1      HIS  80   0.843  -8.499 -16.998
  600    H    GLY  81           H        GLY  81  -5.027  -9.187 -12.725
  601   1HA   GLY  81          2HA       GLY  81  -7.259 -10.249 -12.231
  602   2HA   GLY  81          1HA       GLY  81  -6.560 -11.759 -12.817
  603    H    SER  82           H        SER  82  -5.621 -13.074 -11.325
  604    HA   SER  82           HA       SER  82  -5.066 -11.920  -8.620
  605   1HB   SER  82          2HB       SER  82  -5.463 -14.243  -7.777
  606   2HB   SER  82          1HB       SER  82  -6.879 -13.532  -8.543
  607    HG   SER  82           HG       SER  82  -6.306 -15.744  -9.184
  608    H    GLU  83           H        GLU  83  -3.433 -12.943 -11.335
  609    HA   GLU  83           HA       GLU  83  -1.343 -14.498  -9.972
  610   1HB   GLU  83          2HB       GLU  83  -1.635 -13.444 -12.798
  611   2HB   GLU  83          1HB       GLU  83  -0.201 -14.304 -12.242
  612   1HG   GLU  83          2HG       GLU  83  -1.377 -16.129 -12.982
  613   2HG   GLU  83          1HG       GLU  83  -2.099 -16.021 -11.377
  614    H    LEU  84           H        LEU  84  -0.415 -13.118  -8.438
  615    HA   LEU  84           HA       LEU  84   1.174 -10.853  -9.558
  616   1HB   LEU  84          2HB       LEU  84  -0.555 -10.798  -7.069
  617   2HB   LEU  84          1HB       LEU  84   0.651  -9.569  -7.448
  618    HG   LEU  84           HG       LEU  84  -1.541 -10.312  -9.396
  619   1HD1  LEU  84          1HD1      LEU  84  -1.564  -8.173  -7.245
  620   2HD1  LEU  84          2HD1      LEU  84  -2.637  -9.570  -7.343
  621   3HD1  LEU  84          3HD1      LEU  84  -2.739  -8.292  -8.556
  622   1HD2  LEU  84          1HD2      LEU  84   0.358  -7.975  -9.056
  623   2HD2  LEU  84          2HD2      LEU  84  -1.026  -7.931 -10.148
  624   3HD2  LEU  84          3HD2      LEU  84   0.269  -9.099 -10.411
  625    H    ARG  85           H        ARG  85   2.916 -10.167  -7.981
  626    HA   ARG  85           HA       ARG  85   3.771 -12.205  -6.023
  627   1HB   ARG  85          2HB       ARG  85   4.952 -11.907  -8.706
  628   2HB   ARG  85          1HB       ARG  85   6.130 -11.831  -7.397
  629   1HG   ARG  85          2HG       ARG  85   5.945 -14.041  -6.984
  630   2HG   ARG  85          1HG       ARG  85   4.185 -13.951  -6.952
  631   1HD   ARG  85          2HD       ARG  85   4.027 -14.784  -9.041
  632   2HD   ARG  85          1HD       ARG  85   5.194 -13.615  -9.658
  633    HE   ARG  85           HE       ARG  85   6.505 -15.729  -8.171
  634   1HH1  ARG  85          1HH2      ARG  85   7.555 -14.503 -10.704
  635   2HH1  ARG  85          2HH2      ARG  85   7.359 -15.794 -11.840
  636   1HH2  ARG  85          2HH1      ARG  85   5.149 -17.579  -9.829
  637   2HH2  ARG  85          1HH1      ARG  85   5.990 -17.545 -11.344
  638    H    LEU  86           H        LEU  86   5.321 -11.355  -4.525
  639    HA   LEU  86           HA       LEU  86   5.510  -8.384  -4.602
  640   1HB   LEU  86          2HB       LEU  86   4.529  -9.633  -2.591
  641   2HB   LEU  86          1HB       LEU  86   6.179 -10.159  -2.250
  642    HG   LEU  86           HG       LEU  86   6.197  -7.337  -2.801
  643   1HD1  LEU  86          1HD1      LEU  86   3.767  -8.132  -1.631
  644   2HD1  LEU  86          2HD1      LEU  86   4.425  -6.497  -1.694
  645   3HD1  LEU  86          3HD1      LEU  86   4.745  -7.523  -0.296
  646   1HD2  LEU  86          1HD2      LEU  86   6.600  -8.791  -0.172
  647   2HD2  LEU  86          2HD2      LEU  86   7.310  -7.253  -0.665
  648   3HD2  LEU  86          3HD2      LEU  86   7.810  -8.748  -1.453
  649    H    ILE  87           H        ILE  87   7.430  -7.379  -4.862
  650    HA   ILE  87           HA       ILE  87   9.959  -8.860  -4.389
  651    HB   ILE  87           HB       ILE  87   9.490  -9.200  -6.769
  652   1HG1  ILE  87          2HG1      ILE  87  11.545  -6.988  -6.637
  653   2HG1  ILE  87          1HG1      ILE  87  11.842  -8.558  -5.892
  654   1HG2  ILE  87          1HG2      ILE  87   9.724  -6.483  -7.707
  655   2HG2  ILE  87          2HG2      ILE  87   8.371  -6.606  -6.586
  656   3HG2  ILE  87          3HG2      ILE  87   8.435  -7.648  -8.004
  657   1HD1  ILE  87          1HD1      ILE  87  11.477  -9.678  -8.042
  658   2HD1  ILE  87          2HD1      ILE  87  12.734  -8.452  -8.206
  659   3HD1  ILE  87          3HD1      ILE  87  11.106  -8.131  -8.803
  660    HA   PRO  88           HA       PRO  88  10.822  -4.882  -2.623
  661   1HB   PRO  88          2HB       PRO  88  13.422  -5.441  -1.903
  662   2HB   PRO  88          1HB       PRO  88  12.004  -5.985  -0.988
  663   1HG   PRO  88          2HG       PRO  88  13.796  -7.555  -2.785
  664   2HG   PRO  88          1HG       PRO  88  12.829  -8.101  -1.406
  665   1HD   PRO  88          2HD       PRO  88  12.150  -8.444  -4.122
  666   2HD   PRO  88          1HD       PRO  88  11.047  -8.641  -2.744
  667    H    ARG  89           H        ARG  89  11.515  -3.007  -3.565
  668    HA   ARG  89           HA       ARG  89  12.879  -3.074  -6.138
  669   1HB   ARG  89          2HB       ARG  89  11.946  -0.823  -4.340
  670   2HB   ARG  89          1HB       ARG  89  12.754  -0.541  -5.882
  671   1HG   ARG  89          2HG       ARG  89  10.989  -2.056  -6.933
  672   2HG   ARG  89          1HG       ARG  89  10.117  -1.944  -5.403
  673   1HD   ARG  89          2HD       ARG  89  11.010   0.661  -6.420
  674   2HD   ARG  89          1HD       ARG  89   9.888  -0.160  -7.504
  675    HE   ARG  89           HE       ARG  89   9.089  -0.044  -4.661
  676   1HH1  ARG  89          2HH1      ARG  89   7.096  -0.512  -6.799
  677   2HH1  ARG  89          1HH1      ARG  89   6.380   1.052  -7.007
  678   1HH2  ARG  89          1HH2      ARG  89   8.957   2.739  -5.379
  679   2HH2  ARG  89          2HH2      ARG  89   7.440   2.904  -6.199
  680    H    ASP  90           H        ASP  90  15.043  -3.037  -6.437
  681    HA   ASP  90           HA       ASP  90  16.809  -2.457  -4.126
  682   1HB   ASP  90          2HB       ASP  90  16.926  -4.419  -6.015
  683   2HB   ASP  90          1HB       ASP  90  18.006  -3.221  -6.728
  684    H    ARG  91           H        ARG  91  16.228  -1.329  -7.466
  685    HA   ARG  91           HA       ARG  91  18.031   0.994  -6.929
  686   1HB   ARG  91          2HB       ARG  91  17.066  -0.325  -9.467
  687   2HB   ARG  91          1HB       ARG  91  17.732   1.307  -9.486
  688   1HG   ARG  91          2HG       ARG  91  19.292  -0.762  -8.015
  689   2HG   ARG  91          1HG       ARG  91  19.279  -0.875  -9.775
  690   1HD   ARG  91          2HD       ARG  91  20.852   0.729  -9.830
  691   2HD   ARG  91          1HD       ARG  91  19.658   1.861  -9.197
  692    HE   ARG  91           HE       ARG  91  21.690   0.410  -7.581
  693   1HH1  ARG  91          1HH2      ARG  91  21.348   3.447  -7.820
  694   2HH1  ARG  91          2HH2      ARG  91  20.613   3.813  -6.297
  695   1HH2  ARG  91          2HH1      ARG  91  19.761   0.521  -5.608
  696   2HH2  ARG  91          1HH1      ARG  91  19.715   2.158  -5.042
  697    H    VAL  92           H        VAL  92  17.210   3.081  -8.084
  698    HA   VAL  92           HA       VAL  92  14.709   3.859  -6.926
  699    HB   VAL  92           HB       VAL  92  16.290   5.145  -9.183
  700   1HG1  VAL  92          1HG1      VAL  92  15.029   7.214  -8.421
  701   2HG1  VAL  92          2HG1      VAL  92  13.973   6.141  -7.502
  702   3HG1  VAL  92          3HG1      VAL  92  14.050   6.014  -9.260
  703   1HG2  VAL  92          1HG2      VAL  92  16.302   6.502  -6.620
  704   2HG2  VAL  92          2HG2      VAL  92  17.668   5.931  -7.577
  705   3HG2  VAL  92          3HG2      VAL  92  16.872   4.844  -6.438
  706    H    GLY  93           H        GLY  93  12.794   2.999  -7.561
  707   1HA   GLY  93          2HA       GLY  93  10.970   2.587  -9.020
  708   2HA   GLY  93          1HA       GLY  93  11.959   3.155 -10.370
  709    H    HIS  94           HN       HIS  94  12.390   0.560  -7.958
  710    HA   HIS  94           HA       HIS  94  12.581  -1.764  -8.224
  711   1HB   HIS  94          2HB       HIS  94  11.012  -1.216 -10.345
  712   2HB   HIS  94          1HB       HIS  94  12.478  -1.706 -11.198
  713    HD1  HIS  94           HD1      HIS  94  13.080  -4.174 -11.181
  714    HD2  HIS  94           HD2      HIS  94   9.961  -3.276  -8.569
  715    HE1  HIS  94           HE1      HIS  94  12.186  -6.392 -10.341
  Start of MODEL    2
    1   1H    MET   1          1H        MET   1 -23.476 -13.387 -14.079
    2   2H    MET   1          2H        MET   1 -23.716 -15.069 -14.107
    3   3H    MET   1          3H        MET   1 -22.205 -14.415 -14.530
    4    HA   MET   1           HA       MET   1 -22.262 -15.401 -12.265
    5   1HB   MET   1          2HB       MET   1 -21.272 -12.830 -13.129
    6   2HB   MET   1          1HB       MET   1 -21.701 -12.746 -11.420
    7   1HG   MET   1          2HG       MET   1 -20.310 -14.679 -10.923
    8   2HG   MET   1          1HG       MET   1 -19.980 -14.928 -12.633
    9   1HE   MET   1          1HE       MET   1 -17.101 -13.636 -10.146
   10   2HE   MET   1          2HE       MET   1 -16.911 -14.554 -11.641
   11   3HE   MET   1          3HE       MET   1 -18.177 -14.997 -10.503
   12    H    SER   2           H        SER   2 -23.970 -15.941 -10.963
   13    HA   SER   2           HA       SER   2 -26.018 -13.886 -10.355
   14   1HB   SER   2          2HB       SER   2 -27.202 -15.854  -9.247
   15   2HB   SER   2          1HB       SER   2 -26.981 -15.978 -10.987
   16    HG   SER   2           HG       SER   2 -26.171 -17.854 -10.371
   17    H    GLY   3           H        GLY   3 -24.534 -12.637  -9.024
   18   1HA   GLY   3          2HA       GLY   3 -23.753 -11.906  -6.952
   19   2HA   GLY   3          1HA       GLY   3 -24.878 -13.050  -6.235
   20    H    GLY   4           H        GLY   4 -21.783 -13.266  -8.059
   21   1HA   GLY   4          2HA       GLY   4 -19.729 -14.113  -7.189
   22   2HA   GLY   4          1HA       GLY   4 -20.592 -14.694  -5.769
   23    H    THR   5           H        THR   5 -21.250 -16.834  -5.723
   24    HA   THR   5           HA       THR   5 -20.616 -18.427  -8.167
   25    HB   THR   5           HB       THR   5 -20.498 -19.161  -5.233
   26    HG1  THR   5           HG1      THR   5 -18.418 -18.927  -5.519
   27   1HG2  THR   5          1HG2      THR   5 -21.106 -21.223  -6.035
   28   2HG2  THR   5          2HG2      THR   5 -19.403 -21.282  -6.481
   29   3HG2  THR   5          3HG2      THR   5 -20.614 -20.844  -7.687
   30    H    ALA   6           H        ALA   6 -22.691 -19.072  -5.278
   31    HA   ALA   6           HA       ALA   6 -24.670 -20.290  -7.127
   32   1HB   ALA   6          1HB       ALA   6 -25.693 -21.174  -5.026
   33   2HB   ALA   6          2HB       ALA   6 -24.439 -20.343  -4.107
   34   3HB   ALA   6          3HB       ALA   6 -24.003 -21.641  -5.219
   35    H    ALA   7           H        ALA   7 -26.379 -19.457  -4.389
   36    HA   ALA   7           HA       ALA   7 -27.578 -17.101  -5.765
   37   1HB   ALA   7          1HB       ALA   7 -28.682 -19.010  -3.679
   38   2HB   ALA   7          2HB       ALA   7 -29.195 -18.853  -5.360
   39   3HB   ALA   7          3HB       ALA   7 -29.528 -17.558  -4.211
   40    H    THR   8           H        THR   8 -25.309 -16.301  -4.582
   41    HA   THR   8           HA       THR   8 -26.024 -15.318  -1.858
   42    HB   THR   8           HB       THR   8 -23.462 -14.422  -2.274
   43    HG1  THR   8           HG1      THR   8 -22.576 -15.543  -3.786
   44   1HG2  THR   8          1HG2      THR   8 -24.034 -17.216  -1.290
   45   2HG2  THR   8          2HG2      THR   8 -24.545 -15.793  -0.384
   46   3HG2  THR   8          3HG2      THR   8 -22.831 -16.066  -0.698
   47    H    THR   9           H        THR   9 -25.016 -12.970  -1.509
   48    HA   THR   9           HA       THR   9 -26.561 -11.196  -3.147
   49    HB   THR   9           HB       THR   9 -25.961 -10.714  -0.788
   50    HG1  THR   9           HG1      THR   9 -26.280  -8.745  -1.379
   51   1HG2  THR   9          1HG2      THR   9 -23.605  -9.684  -0.505
   52   2HG2  THR   9          2HG2      THR   9 -23.198 -10.551  -1.985
   53   3HG2  THR   9          3HG2      THR   9 -23.728 -11.443  -0.559
   54    H    ALA  10           H        ALA  10 -25.816  -9.519  -4.566
   55    HA   ALA  10           HA       ALA  10 -23.747 -10.389  -6.407
   56   1HB   ALA  10          1HB       ALA  10 -24.291  -8.273  -7.606
   57   2HB   ALA  10          2HB       ALA  10 -25.335  -7.808  -6.262
   58   3HB   ALA  10          3HB       ALA  10 -25.730  -9.224  -7.239
   59    H    GLY  11           H        GLY  11 -21.675 -10.283  -5.619
   60   1HA   GLY  11          2HA       GLY  11 -20.753  -7.630  -4.577
   61   2HA   GLY  11          1HA       GLY  11 -20.199  -9.147  -3.870
   62    H    SER  12           H        SER  12 -19.867  -6.969  -6.580
   63    HA   SER  12           HA       SER  12 -18.006  -8.752  -8.008
   64   1HB   SER  12          2HB       SER  12 -17.735  -6.690  -9.499
   65   2HB   SER  12          1HB       SER  12 -19.348  -7.392  -9.442
   66    HG   SER  12           HG       SER  12 -18.428  -4.955  -8.545
   67    H    LYS  13           H        LYS  13 -16.197  -9.034  -6.714
   68    HA   LYS  13           HA       LYS  13 -14.616  -6.570  -6.090
   69   1HB   LYS  13          2HB       LYS  13 -14.763  -9.071  -4.375
   70   2HB   LYS  13          1HB       LYS  13 -13.878  -7.591  -4.004
   71   1HG   LYS  13          2HG       LYS  13 -16.307  -6.516  -4.371
   72   2HG   LYS  13          1HG       LYS  13 -16.810  -8.132  -3.878
   73   1HD   LYS  13          2HD       LYS  13 -15.385  -7.939  -1.854
   74   2HD   LYS  13          1HD       LYS  13 -14.946  -6.300  -2.338
   75   1HE   LYS  13          2HE       LYS  13 -17.551  -5.938  -2.432
   76   2HE   LYS  13          1HE       LYS  13 -17.593  -7.344  -1.369
   77   1HZ   LYS  13          1HZ       LYS  13 -17.467  -5.151  -0.218
   78   2HZ   LYS  13          2HZ       LYS  13 -15.903  -4.960  -0.854
   79   3HZ   LYS  13          3HZ       LYS  13 -16.242  -6.243   0.208
   80    H    VAL  14           H        VAL  14 -12.297  -6.859  -6.193
   81    HA   VAL  14           HA       VAL  14 -11.497  -9.212  -7.854
   82    HB   VAL  14           HB       VAL  14  -9.513  -7.746  -8.481
   83   1HG1  VAL  14          1HG1      VAL  14 -12.376  -7.188  -9.169
   84   2HG1  VAL  14          2HG1      VAL  14 -11.095  -7.865 -10.176
   85   3HG1  VAL  14          3HG1      VAL  14 -11.124  -6.136  -9.830
   86   1HG2  VAL  14          1HG2      VAL  14  -9.681  -5.361  -8.064
   87   2HG2  VAL  14          2HG2      VAL  14  -9.780  -6.193  -6.513
   88   3HG2  VAL  14          3HG2      VAL  14 -11.242  -5.563  -7.272
   89    H    THR  15           H        THR  15 -10.271 -10.712  -6.875
   90    HA   THR  15           HA       THR  15  -8.877 -10.007  -4.338
   91    HB   THR  15           HB       THR  15 -10.485 -11.926  -4.323
   92    HG1  THR  15           HG1      THR  15  -9.193 -12.532  -2.814
   93   1HG2  THR  15          1HG2      THR  15 -10.219 -13.823  -5.630
   94   2HG2  THR  15          2HG2      THR  15  -8.492 -13.553  -5.860
   95   3HG2  THR  15          3HG2      THR  15  -9.662 -12.582  -6.753
   96    H    PHE  16           H        PHE  16  -6.637 -10.500  -4.066
   97    HA   PHE  16           HA       PHE  16  -5.172 -11.180  -6.587
   98   1HB   PHE  16          2HB       PHE  16  -4.317  -9.143  -4.512
   99   2HB   PHE  16          1HB       PHE  16  -3.453  -9.545  -5.995
  100    HD1  PHE  16           HD1      PHE  16  -6.040  -7.509  -4.526
  101    HD2  PHE  16           HD2      PHE  16  -4.662  -9.186  -8.236
  102    HE1  PHE  16           HE1      PHE  16  -7.405  -5.861  -5.781
  103    HE2  PHE  16           HE2      PHE  16  -6.027  -7.537  -9.487
  104    HZ   PHE  16           HZ       PHE  16  -7.399  -5.877  -8.259
  105    H    LYS  17           H        LYS  17  -3.572 -12.659  -6.380
  106    HA   LYS  17           HA       LYS  17  -3.035 -13.785  -3.664
  107   1HB   LYS  17          2HB       LYS  17  -3.723 -14.974  -6.160
  108   2HB   LYS  17          1HB       LYS  17  -2.060 -15.436  -5.809
  109   1HG   LYS  17          2HG       LYS  17  -2.697 -16.310  -3.644
  110   2HG   LYS  17          1HG       LYS  17  -4.346 -15.709  -3.840
  111   1HD   LYS  17          2HD       LYS  17  -4.652 -17.180  -5.793
  112   2HD   LYS  17          1HD       LYS  17  -3.002 -17.776  -5.604
  113   1HE   LYS  17          2HE       LYS  17  -3.978 -18.177  -3.092
  114   2HE   LYS  17          1HE       LYS  17  -5.433 -18.432  -4.055
  115   1HZ   LYS  17          1HZ       LYS  17  -3.230 -19.702  -5.288
  116   2HZ   LYS  17          2HZ       LYS  17  -4.667 -20.390  -4.699
  117   3HZ   LYS  17          3HZ       LYS  17  -3.330 -20.198  -3.670
  118    H    ILE  18           H        ILE  18  -1.191 -12.702  -2.941
  119    HA   ILE  18           HA       ILE  18   1.060 -12.365  -4.863
  120    HB   ILE  18           HB       ILE  18   0.752 -11.221  -2.070
  121   1HG1  ILE  18          2HG1      ILE  18   0.584  -9.135  -3.869
  122   2HG1  ILE  18          1HG1      ILE  18  -0.321 -10.404  -4.692
  123   1HG2  ILE  18          1HG2      ILE  18   2.570  -9.724  -2.791
  124   2HG2  ILE  18          2HG2      ILE  18   2.627 -10.535  -4.355
  125   3HG2  ILE  18          3HG2      ILE  18   3.082 -11.408  -2.892
  126   1HD1  ILE  18          1HD1      ILE  18  -0.968  -8.931  -2.210
  127   2HD1  ILE  18          2HD1      ILE  18  -1.281 -10.666  -2.154
  128   3HD1  ILE  18          3HD1      ILE  18  -2.045  -9.671  -3.394
  129    H    THR  19           H        THR  19   2.777 -13.700  -4.766
  130    HA   THR  19           HA       THR  19   3.297 -15.213  -2.236
  131    HB   THR  19           HB       THR  19   2.276 -16.716  -3.925
  132    HG1  THR  19           HG1      THR  19   3.679 -17.817  -2.728
  133   1HG2  THR  19          1HG2      THR  19   4.495 -15.607  -5.625
  134   2HG2  THR  19          2HG2      THR  19   2.791 -15.820  -6.026
  135   3HG2  THR  19          3HG2      THR  19   3.859 -17.221  -5.939
  136    H    LEU  20           H        LEU  20   5.621 -15.962  -2.102
  137    HA   LEU  20           HA       LEU  20   7.415 -13.776  -2.747
  138   1HB   LEU  20          2HB       LEU  20   7.450 -16.065  -1.041
  139   2HB   LEU  20          1HB       LEU  20   8.882 -16.143  -2.067
  140    HG   LEU  20           HG       LEU  20   8.268 -13.460  -0.978
  141   1HD1  LEU  20          1HD1      LEU  20   8.271 -15.749   0.766
  142   2HD1  LEU  20          2HD1      LEU  20   8.119 -14.044   1.190
  143   3HD1  LEU  20          3HD1      LEU  20   9.716 -14.785   1.077
  144   1HD2  LEU  20          1HD2      LEU  20  10.357 -13.374  -1.875
  145   2HD2  LEU  20          2HD2      LEU  20  10.564 -15.123  -1.788
  146   3HD2  LEU  20          3HD2      LEU  20  10.870 -14.126  -0.365
  147    H    THR  21           H        THR  21   9.252 -13.856  -4.171
  148    HA   THR  21           HA       THR  21   8.750 -15.417  -6.617
  149    HB   THR  21           HB       THR  21  10.825 -14.120  -7.419
  150    HG1  THR  21           HG1      THR  21  11.838 -13.169  -5.858
  151   1HG2  THR  21          1HG2      THR  21   8.307 -13.524  -7.675
  152   2HG2  THR  21          2HG2      THR  21   9.504 -12.267  -7.987
  153   3HG2  THR  21          3HG2      THR  21   8.636 -12.298  -6.451
  154    H    SER  22           H        SER  22  11.301 -15.177  -4.128
  155    HA   SER  22           HA       SER  22  13.036 -17.137  -5.341
  156   1HB   SER  22          2HB       SER  22  14.116 -17.211  -3.084
  157   2HB   SER  22          1HB       SER  22  13.929 -15.574  -3.703
  158    HG   SER  22           HG       SER  22  13.253 -15.845  -1.493
  159    H    ASP  23           H        ASP  23  10.634 -17.358  -2.699
  160    HA   ASP  23           HA       ASP  23  10.678 -20.330  -3.055
  161   1HB   ASP  23          2HB       ASP  23   9.967 -20.490  -0.693
  162   2HB   ASP  23          1HB       ASP  23  11.500 -19.631  -0.835
  163    HA   PRO  24           HA       PRO  24   6.397 -20.115  -4.045
  164   1HB   PRO  24          2HB       PRO  24   5.591 -22.584  -3.129
  165   2HB   PRO  24          1HB       PRO  24   6.521 -22.345  -4.619
  166   1HG   PRO  24          2HG       PRO  24   7.441 -23.381  -1.976
  167   2HG   PRO  24          1HG       PRO  24   8.084 -23.706  -3.596
  168   1HD   PRO  24          2HD       PRO  24   9.209 -21.938  -1.703
  169   2HD   PRO  24          1HD       PRO  24   9.613 -22.004  -3.432
  170    H    LYS  25           H        LYS  25   7.193 -21.216  -0.745
  171    HA   LYS  25           HA       LYS  25   6.268 -20.671   1.324
  172   1HB   LYS  25          2HB       LYS  25   5.929 -18.373  -0.222
  173   2HB   LYS  25          1HB       LYS  25   4.329 -18.675   0.456
  174   1HG   LYS  25          2HG       LYS  25   5.902 -19.155   2.635
  175   2HG   LYS  25          1HG       LYS  25   6.844 -17.908   1.818
  176   1HD   LYS  25          2HD       LYS  25   3.875 -17.556   2.193
  177   2HD   LYS  25          1HD       LYS  25   4.986 -17.168   3.506
  178   1HE   LYS  25          2HE       LYS  25   5.462 -15.199   2.526
  179   2HE   LYS  25          1HE       LYS  25   6.054 -16.050   1.102
  180   1HZ   LYS  25          1HZ       LYS  25   3.216 -16.066   1.164
  181   2HZ   LYS  25          2HZ       LYS  25   4.259 -15.453  -0.026
  182   3HZ   LYS  25          3HZ       LYS  25   3.795 -14.476   1.283
  183    H    LEU  26           H        LEU  26   4.816 -21.931   2.336
  184    HA   LEU  26           HA       LEU  26   2.723 -23.317   0.979
  185   1HB   LEU  26          2HB       LEU  26   3.788 -23.185   3.682
  186   2HB   LEU  26          1HB       LEU  26   2.030 -23.300   3.702
  187    HG   LEU  26           HG       LEU  26   3.086 -25.538   3.701
  188   1HD1  LEU  26          1HD1      LEU  26   0.883 -24.981   2.488
  189   2HD1  LEU  26          2HD1      LEU  26   1.679 -26.491   2.046
  190   3HD1  LEU  26          3HD1      LEU  26   1.819 -25.079   0.997
  191   1HD2  LEU  26          1HD2      LEU  26   5.023 -24.525   2.174
  192   2HD2  LEU  26          2HD2      LEU  26   3.992 -25.129   0.876
  193   3HD2  LEU  26          3HD2      LEU  26   4.610 -26.239   2.100
  194    HA   PRO  27           HA       PRO  27  -0.335 -20.201   2.926
  195   1HB   PRO  27          2HB       PRO  27   0.689 -18.083   4.349
  196   2HB   PRO  27          1HB       PRO  27   0.269 -19.641   5.079
  197   1HG   PRO  27          2HG       PRO  27   2.963 -18.520   4.473
  198   2HG   PRO  27          1HG       PRO  27   2.492 -19.712   5.696
  199   1HD   PRO  27          2HD       PRO  27   3.735 -20.272   3.212
  200   2HD   PRO  27          1HD       PRO  27   2.988 -21.458   4.303
  201    H    PHE  28           H        PHE  28  -1.195 -18.796   1.427
  202    HA   PHE  28           HA       PHE  28   0.690 -17.057  -0.110
  203   1HB   PHE  28          2HB       PHE  28  -2.016 -18.229  -0.793
  204   2HB   PHE  28          1HB       PHE  28  -1.254 -16.972  -1.766
  205    HD1  PHE  28           HD1      PHE  28  -1.109 -20.489  -0.715
  206    HD2  PHE  28           HD2      PHE  28   0.815 -17.411  -3.007
  207    HE1  PHE  28           HE1      PHE  28   0.265 -22.204  -1.863
  208    HE2  PHE  28           HE2      PHE  28   2.190 -19.125  -4.155
  209    HZ   PHE  28           HZ       PHE  28   1.915 -21.521  -3.583
  210    H    LYS  29           H        LYS  29   0.146 -14.852  -0.453
  211    HA   LYS  29           HA       LYS  29  -1.552 -13.682   1.660
  212   1HB   LYS  29          2HB       LYS  29   0.580 -12.716  -0.167
  213   2HB   LYS  29          1HB       LYS  29  -0.684 -11.545   0.205
  214   1HG   LYS  29          2HG       LYS  29   0.898 -11.222   1.931
  215   2HG   LYS  29          1HG       LYS  29  -0.333 -12.246   2.672
  216   1HD   LYS  29          2HD       LYS  29   1.027 -14.244   2.169
  217   2HD   LYS  29          1HD       LYS  29   2.265 -13.217   1.447
  218   1HE   LYS  29          2HE       LYS  29   2.751 -12.173   3.541
  219   2HE   LYS  29          1HE       LYS  29   1.316 -12.864   4.296
  220   1HZ   LYS  29          1HZ       LYS  29   2.614 -14.522   4.947
  221   2HZ   LYS  29          2HZ       LYS  29   3.913 -13.983   3.997
  222   3HZ   LYS  29          3HZ       LYS  29   2.734 -15.011   3.329
  223    H    VAL  30           H        VAL  30  -3.696 -13.974   1.098
  224    HA   VAL  30           HA       VAL  30  -4.565 -13.229  -1.650
  225    HB   VAL  30           HB       VAL  30  -6.168 -14.509   0.590
  226   1HG1  VAL  30          1HG1      VAL  30  -7.457 -15.228  -1.621
  227   2HG1  VAL  30          2HG1      VAL  30  -6.712 -13.762  -2.262
  228   3HG1  VAL  30          3HG1      VAL  30  -7.777 -13.671  -0.858
  229   1HG2  VAL  30          1HG2      VAL  30  -4.809 -15.766  -1.819
  230   2HG2  VAL  30          2HG2      VAL  30  -5.834 -16.613  -0.660
  231   3HG2  VAL  30          3HG2      VAL  30  -4.287 -15.943  -0.143
  232    H    LEU  31           H        LEU  31  -5.275 -11.184  -1.947
  233    HA   LEU  31           HA       LEU  31  -6.419  -9.720   0.401
  234   1HB   LEU  31          2HB       LEU  31  -4.523  -8.948  -1.731
  235   2HB   LEU  31          1HB       LEU  31  -5.790  -7.763  -1.411
  236    HG   LEU  31           HG       LEU  31  -4.657  -8.886   1.046
  237   1HD1  LEU  31          1HD1      LEU  31  -2.860  -7.860  -1.084
  238   2HD1  LEU  31          2HD1      LEU  31  -2.505  -8.928   0.274
  239   3HD1  LEU  31          3HD1      LEU  31  -2.605  -7.186   0.525
  240   1HD2  LEU  31          1HD2      LEU  31  -6.096  -6.714   0.431
  241   2HD2  LEU  31          2HD2      LEU  31  -4.491  -6.002   0.268
  242   3HD2  LEU  31          3HD2      LEU  31  -4.984  -6.724   1.799
  243    H    SER  32           H        SER  32  -8.608  -9.782   0.220
  244    HA   SER  32           HA       SER  32  -9.853  -9.639  -2.480
  245   1HB   SER  32          2HB       SER  32 -10.748 -10.600   0.209
  246   2HB   SER  32          1HB       SER  32 -11.973  -9.993  -0.901
  247    HG   SER  32           HG       SER  32 -11.662 -12.190  -1.252
  248    H    VAL  33           H        VAL  33 -10.166  -7.576  -3.143
  249    HA   VAL  33           HA       VAL  33 -11.495  -5.680  -1.266
  250    HB   VAL  33           HB       VAL  33 -10.049  -3.839  -2.222
  251   1HG1  VAL  33          1HG1      VAL  33  -8.231  -5.838  -0.928
  252   2HG1  VAL  33          2HG1      VAL  33  -9.645  -5.276  -0.037
  253   3HG1  VAL  33          3HG1      VAL  33  -8.432  -4.119  -0.584
  254   1HG2  VAL  33          1HG2      VAL  33  -8.285  -6.124  -3.144
  255   2HG2  VAL  33          2HG2      VAL  33  -8.027  -4.399  -3.402
  256   3HG2  VAL  33          3HG2      VAL  33  -9.345  -5.227  -4.232
  257    HA   PRO  34           HA       PRO  34 -14.053  -4.782  -4.725
  258   1HB   PRO  34          2HB       PRO  34 -14.696  -2.157  -4.191
  259   2HB   PRO  34          1HB       PRO  34 -15.377  -3.535  -3.309
  260   1HG   PRO  34          2HG       PRO  34 -13.281  -1.597  -2.436
  261   2HG   PRO  34          1HG       PRO  34 -14.441  -2.510  -1.459
  262   1HD   PRO  34          2HD       PRO  34 -11.720  -3.157  -1.782
  263   2HD   PRO  34          1HD       PRO  34 -12.974  -4.252  -1.162
  264    H    GLU  35           H        GLU  35 -14.201  -3.412  -6.692
  265    HA   GLU  35           HA       GLU  35 -11.681  -2.871  -7.904
  266   1HB   GLU  35          2HB       GLU  35 -14.525  -2.176  -8.602
  267   2HB   GLU  35          1HB       GLU  35 -13.197  -1.519  -9.558
  268   1HG   GLU  35          2HG       GLU  35 -13.543  -3.491 -10.712
  269   2HG   GLU  35          1HG       GLU  35 -12.384  -4.060  -9.512
  270    H    SER  36           H        SER  36 -13.839  -0.807  -6.031
  271    HA   SER  36           HA       SER  36 -12.787   1.739  -6.769
  272   1HB   SER  36          2HB       SER  36 -13.647   2.477  -4.527
  273   2HB   SER  36          1HB       SER  36 -14.835   1.594  -5.480
  274    HG   SER  36           HG       SER  36 -14.682   0.884  -3.278
  275    H    THR  37           H        THR  37 -11.694  -0.639  -4.352
  276    HA   THR  37           HA       THR  37  -9.691   1.004  -3.123
  277    HB   THR  37           HB       THR  37  -9.760  -2.015  -3.456
  278    HG1  THR  37           HG1      THR  37 -10.539  -0.416  -1.248
  279   1HG2  THR  37          1HG2      THR  37  -8.460  -0.870  -1.088
  280   2HG2  THR  37          2HG2      THR  37  -7.644  -0.457  -2.594
  281   3HG2  THR  37          3HG2      THR  37  -7.903  -2.148  -2.167
  282    HA   PRO  38           HA       PRO  38  -6.907   1.066  -6.604
  283   1HB   PRO  38          2HB       PRO  38  -5.050   2.694  -5.397
  284   2HB   PRO  38          1HB       PRO  38  -6.555   3.289  -6.119
  285   1HG   PRO  38          2HG       PRO  38  -5.853   2.972  -3.239
  286   2HG   PRO  38          1HG       PRO  38  -7.008   4.081  -3.997
  287   1HD   PRO  38          2HD       PRO  38  -7.653   1.680  -2.639
  288   2HD   PRO  38          1HD       PRO  38  -8.748   2.631  -3.665
  289    H    PHE  39           H        PHE  39  -4.619   0.432  -7.011
  290    HA   PHE  39           HA       PHE  39  -3.835  -1.903  -5.522
  291   1HB   PHE  39          2HB       PHE  39  -3.277  -1.143  -8.001
  292   2HB   PHE  39          1HB       PHE  39  -1.855  -0.441  -7.229
  293    HD1  PHE  39           HD1      PHE  39   0.034  -1.797  -7.064
  294    HD2  PHE  39           HD2      PHE  39  -3.853  -3.626  -7.093
  295    HE1  PHE  39           HE1      PHE  39   1.087  -4.039  -6.965
  296    HE2  PHE  39           HE2      PHE  39  -2.799  -5.867  -6.995
  297    HZ   PHE  39           HZ       PHE  39  -0.329  -6.075  -6.931
  298    H    THR  40           H        THR  40  -3.281   1.464  -4.982
  299    HA   THR  40           HA       THR  40  -0.752   1.400  -3.660
  300    HB   THR  40           HB       THR  40  -1.667   3.416  -2.396
  301    HG1  THR  40           HG1      THR  40  -3.713   3.847  -2.534
  302   1HG2  THR  40          1HG2      THR  40  -0.579   4.164  -4.263
  303   2HG2  THR  40          2HG2      THR  40  -2.217   4.595  -4.756
  304   3HG2  THR  40          3HG2      THR  40  -1.484   3.102  -5.342
  305    H    ALA  41           H        ALA  41  -4.069   0.922  -2.431
  306    HA   ALA  41           HA       ALA  41  -3.178   0.318   0.278
  307   1HB   ALA  41          1HB       ALA  41  -5.406   1.258  -0.082
  308   2HB   ALA  41          2HB       ALA  41  -5.559  -0.353   0.620
  309   3HB   ALA  41          3HB       ALA  41  -5.845  -0.111  -1.103
  310    H    VAL  42           H        VAL  42  -4.126  -1.572  -2.591
  311    HA   VAL  42           HA       VAL  42  -4.174  -4.148  -1.341
  312    HB   VAL  42           HB       VAL  42  -3.416  -3.424  -4.193
  313   1HG1  VAL  42          1HG1      VAL  42  -4.705  -6.008  -3.705
  314   2HG1  VAL  42          2HG1      VAL  42  -3.138  -5.874  -2.908
  315   3HG1  VAL  42          3HG1      VAL  42  -3.263  -5.635  -4.649
  316   1HG2  VAL  42          1HG2      VAL  42  -5.724  -2.728  -3.240
  317   2HG2  VAL  42          2HG2      VAL  42  -6.079  -4.455  -3.209
  318   3HG2  VAL  42          3HG2      VAL  42  -5.711  -3.658  -4.738
  319    H    LEU  43           H        LEU  43  -1.528  -2.487  -3.096
  320    HA   LEU  43           HA       LEU  43   0.469  -4.481  -2.580
  321   1HB   LEU  43          2HB       LEU  43   0.590  -2.623  -4.310
  322   2HB   LEU  43          1HB       LEU  43   0.956  -1.517  -2.986
  323    HG   LEU  43           HG       LEU  43   2.603  -3.928  -2.885
  324   1HD1  LEU  43          1HD1      LEU  43   2.135  -2.832  -5.483
  325   2HD1  LEU  43          2HD1      LEU  43   3.284  -4.087  -5.021
  326   3HD1  LEU  43          3HD1      LEU  43   3.772  -2.393  -4.998
  327   1HD2  LEU  43          1HD2      LEU  43   3.496  -2.237  -1.613
  328   2HD2  LEU  43          2HD2      LEU  43   2.853  -0.970  -2.658
  329   3HD2  LEU  43          3HD2      LEU  43   4.310  -1.844  -3.128
  330    H    LYS  44           H        LYS  44  -0.581  -1.608  -0.781
  331    HA   LYS  44           HA       LYS  44   1.508  -1.553   1.166
  332   1HB   LYS  44          2HB       LYS  44  -0.636   0.024   0.659
  333   2HB   LYS  44          1HB       LYS  44  -1.245  -0.864   2.054
  334   1HG   LYS  44          2HG       LYS  44   1.362  -0.218   2.779
  335   2HG   LYS  44          1HG       LYS  44   0.801   1.220   1.926
  336   1HD   LYS  44          2HD       LYS  44  -0.306   1.812   3.797
  337   2HD   LYS  44          1HD       LYS  44  -1.362   0.421   3.545
  338   1HE   LYS  44          2HE       LYS  44   0.411  -0.981   4.726
  339   2HE   LYS  44          1HE       LYS  44   1.176   0.540   5.189
  340   1HZ   LYS  44          1HZ       LYS  44  -0.415  -0.389   6.851
  341   2HZ   LYS  44          2HZ       LYS  44  -1.669  -0.096   5.745
  342   3HZ   LYS  44          3HZ       LYS  44  -0.756   1.199   6.361
  343    H    PHE  45           H        PHE  45  -1.668  -3.186   1.181
  344    HA   PHE  45           HA       PHE  45  -1.339  -4.421   3.761
  345   1HB   PHE  45          2HB       PHE  45  -3.353  -4.275   1.782
  346   2HB   PHE  45          1HB       PHE  45  -3.002  -5.989   1.991
  347    HD1  PHE  45           HD1      PHE  45  -3.659  -2.869   3.953
  348    HD2  PHE  45           HD2      PHE  45  -3.897  -7.155   3.820
  349    HE1  PHE  45           HE1      PHE  45  -4.907  -2.867   6.096
  350    HE2  PHE  45           HE2      PHE  45  -5.146  -7.152   5.961
  351    HZ   PHE  45           HZ       PHE  45  -5.650  -5.008   7.099
  352    H    ALA  46           H        ALA  46  -0.724  -5.561   0.430
  353    HA   ALA  46           HA       ALA  46   0.043  -8.227   1.080
  354   1HB   ALA  46          1HB       ALA  46   1.268  -8.173  -1.091
  355   2HB   ALA  46          2HB       ALA  46   1.010  -6.430  -1.167
  356   3HB   ALA  46          3HB       ALA  46  -0.368  -7.528  -1.231
  357    H    ALA  47           H        ALA  47   1.998  -5.249   0.811
  358    HA   ALA  47           HA       ALA  47   4.522  -6.469   1.417
  359   1HB   ALA  47          1HB       ALA  47   4.590  -4.292   0.460
  360   2HB   ALA  47          2HB       ALA  47   5.133  -4.073   2.123
  361   3HB   ALA  47          3HB       ALA  47   3.485  -3.639   1.669
  362    H    GLU  48           H        GLU  48   1.995  -5.040   3.475
  363    HA   GLU  48           HA       GLU  48   3.393  -5.090   5.956
  364   1HB   GLU  48          2HB       GLU  48   1.182  -3.976   5.563
  365   2HB   GLU  48          1HB       GLU  48   0.430  -5.570   5.503
  366   1HG   GLU  48          2HG       GLU  48   2.045  -5.455   7.860
  367   2HG   GLU  48          1HG       GLU  48   1.054  -3.997   7.812
  368    H    GLU  49           H        GLU  49   1.351  -7.576   4.395
  369    HA   GLU  49           HA       GLU  49   1.752  -9.532   6.504
  370   1HB   GLU  49          2HB       GLU  49   0.566  -9.550   3.746
  371   2HB   GLU  49          1HB       GLU  49   0.951 -11.088   4.514
  372   1HG   GLU  49          2HG       GLU  49  -1.120 -10.879   5.439
  373   2HG   GLU  49          1HG       GLU  49  -0.304  -9.798   6.568
  374    H    PHE  50           H        PHE  50   3.413  -8.717   3.494
  375    HA   PHE  50           HA       PHE  50   5.083 -11.117   3.487
  376   1HB   PHE  50          2HB       PHE  50   4.730  -8.717   1.807
  377   2HB   PHE  50          1HB       PHE  50   6.386  -9.319   1.880
  378    HD1  PHE  50           HD1      PHE  50   6.950 -11.577   1.087
  379    HD2  PHE  50           HD2      PHE  50   2.944 -10.050   0.827
  380    HE1  PHE  50           HE1      PHE  50   6.357 -13.396  -0.489
  381    HE2  PHE  50           HE2      PHE  50   2.353 -11.868  -0.748
  382    HZ   PHE  50           HZ       PHE  50   4.058 -13.539  -1.406
  383    H    LYS  51           H        LYS  51   5.094  -8.487   5.528
  384    HA   LYS  51           HA       LYS  51   6.664  -7.636   7.023
  385   1HB   LYS  51          2HB       LYS  51   7.869 -10.246   6.187
  386   2HB   LYS  51          1HB       LYS  51   8.863  -9.123   7.117
  387   1HG   LYS  51          2HG       LYS  51   6.502  -9.019   8.495
  388   2HG   LYS  51          1HG       LYS  51   6.509 -10.696   7.951
  389   1HD   LYS  51          2HD       LYS  51   9.057 -10.531   8.782
  390   2HD   LYS  51          1HD       LYS  51   8.352  -9.306   9.837
  391   1HE   LYS  51          2HE       LYS  51   7.333 -12.154   9.553
  392   2HE   LYS  51          1HE       LYS  51   8.302 -11.547  10.895
  393   1HZ   LYS  51          1HZ       LYS  51   6.580 -10.274  11.685
  394   2HZ   LYS  51          2HZ       LYS  51   5.727 -11.607  11.070
  395   3HZ   LYS  51          3HZ       LYS  51   5.802 -10.163  10.181
  396    H    VAL  52           H        VAL  52   6.597  -6.518   4.422
  397    HA   VAL  52           HA       VAL  52   9.423  -5.588   4.191
  398    HB   VAL  52           HB       VAL  52   9.057  -5.402   1.696
  399   1HG1  VAL  52          1HG1      VAL  52  10.309  -7.289   2.813
  400   2HG1  VAL  52          2HG1      VAL  52   9.602  -7.709   1.253
  401   3HG1  VAL  52          3HG1      VAL  52   8.822  -8.234   2.744
  402   1HG2  VAL  52          1HG2      VAL  52   6.532  -5.577   1.898
  403   2HG2  VAL  52          2HG2      VAL  52   6.751  -7.300   2.201
  404   3HG2  VAL  52          3HG2      VAL  52   7.253  -6.603   0.661
  405    HA   PRO  53           HA       PRO  53   7.576  -1.604   4.320
  406   1HB   PRO  53          2HB       PRO  53   9.503  -0.159   2.989
  407   2HB   PRO  53          1HB       PRO  53   9.683  -0.745   4.652
  408   1HG   PRO  53          2HG       PRO  53  10.933  -1.782   2.149
  409   2HG   PRO  53          1HG       PRO  53  11.523  -1.869   3.817
  410   1HD   PRO  53          2HD       PRO  53  10.293  -3.974   2.393
  411   2HD   PRO  53          1HD       PRO  53  10.555  -3.922   4.150
  412    H    ALA  54           H        ALA  54   5.984  -0.671   3.110
  413    HA   ALA  54           HA       ALA  54   5.434  -1.423   0.402
  414   1HB   ALA  54          1HB       ALA  54   3.711   0.357   0.486
  415   2HB   ALA  54          2HB       ALA  54   4.413   0.952   1.991
  416   3HB   ALA  54          3HB       ALA  54   3.673  -0.648   1.935
  417    H    ALA  55           H        ALA  55   7.267   1.237   1.801
  418    HA   ALA  55           HA       ALA  55   7.418   2.834  -0.616
  419   1HB   ALA  55          1HB       ALA  55   9.556   3.684   0.758
  420   2HB   ALA  55          2HB       ALA  55   8.731   2.833   2.065
  421   3HB   ALA  55          3HB       ALA  55   7.915   4.145   1.214
  422    H    THR  56           H        THR  56   8.911  -0.106   0.311
  423    HA   THR  56           HA       THR  56  10.850   0.175  -1.934
  424    HB   THR  56           HB       THR  56  11.599  -1.262   0.620
  425    HG1  THR  56           HG1      THR  56  12.164   0.560   1.500
  426   1HG2  THR  56          1HG2      THR  56  12.903  -1.780  -1.386
  427   2HG2  THR  56          2HG2      THR  56  13.885  -0.851  -0.252
  428   3HG2  THR  56          3HG2      THR  56  13.185  -0.062  -1.666
  429    H    SER  57           H        SER  57   8.409  -1.016  -2.251
  430    HA   SER  57           HA       SER  57   9.157  -3.847  -2.664
  431   1HB   SER  57          2HB       SER  57   7.054  -4.662  -1.640
  432   2HB   SER  57          1HB       SER  57   8.078  -3.856  -0.456
  433    HG   SER  57           HG       SER  57   5.646  -3.313  -0.800
  434    H    ALA  58           H        ALA  58   7.906  -4.867  -4.303
  435    HA   ALA  58           HA       ALA  58   5.853  -3.244  -5.705
  436   1HB   ALA  58          1HB       ALA  58   8.058  -4.531  -7.306
  437   2HB   ALA  58          2HB       ALA  58   8.260  -2.902  -6.661
  438   3HB   ALA  58          3HB       ALA  58   6.947  -3.248  -7.787
  439    H    ILE  59           H        ILE  59   4.668  -4.608  -7.345
  440    HA   ILE  59           HA       ILE  59   4.836  -7.517  -6.647
  441    HB   ILE  59           HB       ILE  59   2.440  -5.702  -6.896
  442   1HG1  ILE  59          2HG1      ILE  59   2.972  -7.939  -4.933
  443   2HG1  ILE  59          1HG1      ILE  59   3.655  -6.329  -4.699
  444   1HG2  ILE  59          1HG2      ILE  59   1.811  -7.472  -8.362
  445   2HG2  ILE  59          2HG2      ILE  59   1.094  -7.888  -6.806
  446   3HG2  ILE  59          3HG2      ILE  59   2.570  -8.692  -7.340
  447   1HD1  ILE  59          1HD1      ILE  59   0.907  -7.256  -4.302
  448   2HD1  ILE  59          2HD1      ILE  59   0.996  -5.806  -5.302
  449   3HD1  ILE  59          3HD1      ILE  59   1.702  -5.808  -3.685
  450    H    ILE  60           H        ILE  60   5.286  -8.747  -8.403
  451    HA   ILE  60           HA       ILE  60   4.835  -7.577 -11.105
  452    HB   ILE  60           HB       ILE  60   6.389  -9.326 -11.906
  453   1HG1  ILE  60          2HG1      ILE  60   7.382 -10.144  -9.297
  454   2HG1  ILE  60          1HG1      ILE  60   5.691 -10.601  -9.495
  455   1HG2  ILE  60          1HG2      ILE  60   8.186  -8.477  -9.898
  456   2HG2  ILE  60          2HG2      ILE  60   7.007  -7.177 -10.077
  457   3HG2  ILE  60          3HG2      ILE  60   7.922  -7.738 -11.477
  458   1HD1  ILE  60          1HD1      ILE  60   6.592 -11.339 -11.915
  459   2HD1  ILE  60          2HD1      ILE  60   6.654 -12.420 -10.523
  460   3HD1  ILE  60          3HD1      ILE  60   8.092 -11.519 -11.004
  461    H    THR  61           H        THR  61   4.247  -9.309 -12.827
  462    HA   THR  61           HA       THR  61   1.994 -10.956 -11.747
  463    HB   THR  61           HB       THR  61   2.364 -10.023 -14.609
  464    HG1  THR  61           HG1      THR  61   1.662  -8.154 -14.006
  465   1HG2  THR  61          1HG2      THR  61   0.429 -11.106 -15.010
  466   2HG2  THR  61          2HG2      THR  61  -0.347 -10.343 -13.624
  467   3HG2  THR  61          3HG2      THR  61   0.574 -11.826 -13.410
  468    H    ASN  62           H        ASN  62   1.622 -13.053 -12.792
  469    HA   ASN  62           HA       ASN  62   3.838 -14.765 -12.907
  470   1HB   ASN  62          2HB       ASN  62   1.015 -14.953 -13.360
  471   2HB   ASN  62          1HB       ASN  62   1.846 -15.824 -14.648
  472   1HD2  ASN  62          1HD2      ASN  62   3.300 -17.617 -14.004
  473   2HD2  ASN  62          2HD2      ASN  62   3.141 -18.341 -12.476
  474    H    ASP  63           H        ASP  63   2.504 -12.766 -15.494
  475    HA   ASP  63           HA       ASP  63   3.938 -14.166 -17.621
  476   1HB   ASP  63          2HB       ASP  63   2.547 -11.469 -17.549
  477   2HB   ASP  63          1HB       ASP  63   3.240 -12.187 -19.003
  478    H    GLY  64           H        GLY  64   4.456 -11.221 -15.691
  479   1HA   GLY  64          2HA       GLY  64   6.955 -10.900 -15.187
  480   2HA   GLY  64          1HA       GLY  64   7.165 -10.965 -16.936
  481    H    VAL  65           H        VAL  65   4.715  -9.309 -14.921
  482    HA   VAL  65           HA       VAL  65   5.572  -6.734 -16.187
  483    HB   VAL  65           HB       VAL  65   2.758  -7.469 -15.318
  484   1HG1  VAL  65          1HG1      VAL  65   4.020  -4.994 -15.915
  485   2HG1  VAL  65          2HG1      VAL  65   2.303  -5.291 -15.648
  486   3HG1  VAL  65          3HG1      VAL  65   2.967  -5.374 -17.279
  487   1HG2  VAL  65          1HG2      VAL  65   4.120  -7.566 -18.020
  488   2HG2  VAL  65          2HG2      VAL  65   2.367  -7.466 -17.853
  489   3HG2  VAL  65          3HG2      VAL  65   3.236  -8.857 -17.205
  490    H    GLY  66           H        GLY  66   6.398  -5.377 -14.686
  491   1HA   GLY  66          2HA       GLY  66   6.178  -5.893 -11.847
  492   2HA   GLY  66          1HA       GLY  66   6.968  -4.502 -12.584
  493    H    VAL  67           H        VAL  67   3.886  -5.792 -11.506
  494    HA   VAL  67           HA       VAL  67   2.269  -3.493 -12.111
  495    HB   VAL  67           HB       VAL  67   1.836  -5.446  -9.830
  496   1HG1  VAL  67          1HG1      VAL  67  -0.564  -4.937 -10.352
  497   2HG1  VAL  67          2HG1      VAL  67  -0.011  -3.712 -11.494
  498   3HG1  VAL  67          3HG1      VAL  67   0.340  -3.538  -9.774
  499   1HG2  VAL  67          1HG2      VAL  67   2.073  -6.893 -11.663
  500   2HG2  VAL  67          2HG2      VAL  67   1.418  -5.715 -12.801
  501   3HG2  VAL  67          3HG2      VAL  67   0.344  -6.551 -11.678
  502    H    ASN  68           H        ASN  68   2.147  -1.559 -11.093
  503    HA   ASN  68           HA       ASN  68   3.593  -1.241  -8.493
  504   1HB   ASN  68          2HB       ASN  68   3.027   0.772 -10.694
  505   2HB   ASN  68          1HB       ASN  68   3.796   1.165  -9.157
  506   1HD2  ASN  68          1HD2      ASN  68   4.463   0.222 -12.348
  507   2HD2  ASN  68          2HD2      ASN  68   6.048  -0.335 -12.116
  508    HA   PRO  69           HA       PRO  69  -0.154   0.083  -6.597
  509   1HB   PRO  69          2HB       PRO  69   0.840   1.891  -4.773
  510   2HB   PRO  69          1HB       PRO  69   1.011   0.135  -4.605
  511   1HG   PRO  69          2HG       PRO  69   3.060   2.155  -5.381
  512   2HG   PRO  69          1HG       PRO  69   3.279   0.569  -4.623
  513   1HD   PRO  69          2HD       PRO  69   3.695   1.182  -7.360
  514   2HD   PRO  69          1HD       PRO  69   3.615  -0.444  -6.650
  515    H    ALA  70           H        ALA  70  -0.466   1.207  -8.867
  516    HA   ALA  70           HA       ALA  70  -0.941   4.114  -8.372
  517   1HB   ALA  70          1HB       ALA  70  -0.009   4.761 -10.429
  518   2HB   ALA  70          2HB       ALA  70  -0.076   3.124 -11.081
  519   3HB   ALA  70          3HB       ALA  70   1.124   3.538  -9.856
  520    H    GLN  71           H        GLN  71  -1.731   1.279 -10.408
  521    HA   GLN  71           HA       GLN  71  -4.186   2.531 -11.411
  522   1HB   GLN  71          2HB       GLN  71  -3.005  -0.245 -11.685
  523   2HB   GLN  71          1HB       GLN  71  -4.555   0.206 -12.391
  524   1HG   GLN  71          2HG       GLN  71  -3.294   0.814 -14.186
  525   2HG   GLN  71          1HG       GLN  71  -2.978   2.271 -13.243
  526   1HE2  GLN  71          1HE2      GLN  71  -1.630  -0.962 -14.019
  527   2HE2  GLN  71          2HE2      GLN  71  -0.029  -0.561 -13.622
  528    HA   PRO  72           HA       PRO  72  -6.934   1.015  -8.326
  529   1HB   PRO  72          2HB       PRO  72  -9.187   0.552  -9.836
  530   2HB   PRO  72          1HB       PRO  72  -8.620   2.170  -9.388
  531   1HG   PRO  72          2HG       PRO  72  -8.451   0.785 -12.024
  532   2HG   PRO  72          1HG       PRO  72  -8.509   2.519 -11.669
  533   1HD   PRO  72          2HD       PRO  72  -6.190   1.052 -12.344
  534   2HD   PRO  72          1HD       PRO  72  -6.222   2.687 -11.648
  535    H    ALA  73           H        ALA  73  -7.894  -0.934  -7.492
  536    HA   ALA  73           HA       ALA  73  -6.708  -3.390  -8.185
  537   1HB   ALA  73          1HB       ALA  73  -9.373  -2.887  -6.830
  538   2HB   ALA  73          2HB       ALA  73  -7.807  -3.063  -6.037
  539   3HB   ALA  73          3HB       ALA  73  -8.540  -4.441  -6.855
  540    H    GLY  74           H        GLY  74  -9.792  -2.016  -9.340
  541   1HA   GLY  74          2HA       GLY  74 -10.761  -4.297 -10.735
  542   2HA   GLY  74          1HA       GLY  74 -11.142  -2.629 -11.159
  543    H    ASN  75           H        ASN  75  -8.692  -1.616 -11.904
  544    HA   ASN  75           HA       ASN  75  -8.335  -2.708 -14.552
  545   1HB   ASN  75          2HB       ASN  75  -7.475  -0.389 -13.083
  546   2HB   ASN  75          1HB       ASN  75  -6.079  -1.119 -13.876
  547   1HD2  ASN  75          1HD2      ASN  75  -6.076  -1.219 -16.231
  548   2HD2  ASN  75          2HD2      ASN  75  -7.187  -0.331 -17.158
  549    H    ILE  76           H        ILE  76  -6.496  -2.987 -11.523
  550    HA   ILE  76           HA       ILE  76  -4.189  -4.307 -12.552
  551    HB   ILE  76           HB       ILE  76  -5.544  -4.570  -9.847
  552   1HG1  ILE  76          2HG1      ILE  76  -4.770  -2.271 -10.547
  553   2HG1  ILE  76          1HG1      ILE  76  -3.963  -2.889  -9.110
  554   1HG2  ILE  76          1HG2      ILE  76  -3.662  -6.294 -10.811
  555   2HG2  ILE  76          2HG2      ILE  76  -3.827  -5.876  -9.107
  556   3HG2  ILE  76          3HG2      ILE  76  -2.632  -5.050 -10.104
  557   1HD1  ILE  76          1HD1      ILE  76  -2.472  -1.804 -10.904
  558   2HD1  ILE  76          2HD1      ILE  76  -2.787  -3.244 -11.872
  559   3HD1  ILE  76          3HD1      ILE  76  -1.977  -3.390 -10.313
  560    H    PHE  77           H        PHE  77  -7.320  -5.598 -11.441
  561    HA   PHE  77           HA       PHE  77  -6.591  -8.376 -11.838
  562   1HB   PHE  77          2HB       PHE  77  -8.500  -7.355 -10.381
  563   2HB   PHE  77          1HB       PHE  77  -9.424  -7.351 -11.882
  564    HD1  PHE  77           HD1      PHE  77  -9.665  -9.539 -13.175
  565    HD2  PHE  77           HD2      PHE  77  -8.195  -9.354  -9.143
  566    HE1  PHE  77           HE1      PHE  77 -10.146 -11.953 -12.889
  567    HE2  PHE  77           HE2      PHE  77  -8.677 -11.770  -8.858
  568    HZ   PHE  77           HZ       PHE  77  -9.652 -13.070 -10.731
  569    H    LEU  78           H        LEU  78  -8.295  -5.941 -13.799
  570    HA   LEU  78           HA       LEU  78  -9.060  -7.724 -15.922
  571   1HB   LEU  78          2HB       LEU  78  -8.690  -4.726 -15.771
  572   2HB   LEU  78          1HB       LEU  78  -9.211  -5.534 -17.250
  573    HG   LEU  78           HG       LEU  78 -10.619  -5.993 -14.615
  574   1HD1  LEU  78          1HD1      LEU  78 -11.530  -4.025 -16.718
  575   2HD1  LEU  78          2HD1      LEU  78 -10.536  -3.522 -15.350
  576   3HD1  LEU  78          3HD1      LEU  78 -12.131  -4.224 -15.072
  577   1HD2  LEU  78          1HD2      LEU  78 -11.169  -6.515 -17.532
  578   2HD2  LEU  78          2HD2      LEU  78 -12.508  -6.371 -16.393
  579   3HD2  LEU  78          3HD2      LEU  78 -11.289  -7.625 -16.165
  580    H    LYS  79           H        LYS  79  -6.150  -5.754 -15.375
  581    HA   LYS  79           HA       LYS  79  -5.026  -6.487 -18.000
  582   1HB   LYS  79          2HB       LYS  79  -4.353  -4.612 -15.812
  583   2HB   LYS  79          1HB       LYS  79  -2.972  -5.297 -16.669
  584   1HG   LYS  79          2HG       LYS  79  -3.668  -4.422 -18.741
  585   2HG   LYS  79          1HG       LYS  79  -5.319  -4.157 -18.177
  586   1HD   LYS  79          2HD       LYS  79  -4.805  -2.112 -17.364
  587   2HD   LYS  79          1HD       LYS  79  -3.370  -2.727 -16.544
  588   1HE   LYS  79          2HE       LYS  79  -2.322  -2.801 -18.926
  589   2HE   LYS  79          1HE       LYS  79  -3.634  -1.708 -19.368
  590   1HZ   LYS  79          1HZ       LYS  79  -2.683  -0.652 -17.057
  591   2HZ   LYS  79          2HZ       LYS  79  -2.295  -0.110 -18.618
  592   3HZ   LYS  79          3HZ       LYS  79  -1.270  -1.202 -17.816
  593    H    HIS  80           H        HIS  80  -3.879  -6.846 -14.622
  594    HA   HIS  80           HA       HIS  80  -2.031  -8.976 -15.452
  595   1HB   HIS  80          2HB       HIS  80  -2.594  -8.095 -12.614
  596   2HB   HIS  80          1HB       HIS  80  -1.128  -8.834 -13.253
  597    HD1  HIS  80           HD1      HIS  80  -0.030  -7.260 -15.336
  598    HD2  HIS  80           HD2      HIS  80  -2.338  -5.361 -12.430
  599    HE1  HIS  80           HE1      HIS  80   0.535  -4.794 -15.468
  600    H    GLY  81           H        GLY  81  -4.584  -8.809 -12.919
  601   1HA   GLY  81          2HA       GLY  81  -6.372 -10.637 -13.214
  602   2HA   GLY  81          1HA       GLY  81  -5.004 -11.742 -13.337
  603    H    SER  82           H        SER  82  -4.814 -12.871 -11.471
  604    HA   SER  82           HA       SER  82  -5.110 -11.374  -8.896
  605   1HB   SER  82          2HB       SER  82  -5.906 -13.567  -7.923
  606   2HB   SER  82          1HB       SER  82  -7.011 -12.840  -9.083
  607    HG   SER  82           HG       SER  82  -6.571 -15.134  -9.376
  608    H    GLU  83           H        GLU  83  -3.644 -14.331 -10.336
  609    HA   GLU  83           HA       GLU  83  -1.786 -14.760  -8.210
  610   1HB   GLU  83          2HB       GLU  83  -2.383 -16.426 -10.011
  611   2HB   GLU  83          1HB       GLU  83  -1.361 -15.506 -11.116
  612   1HG   GLU  83          2HG       GLU  83  -0.150 -17.426 -10.081
  613   2HG   GLU  83          1HG       GLU  83   0.585 -15.874  -9.684
  614    H    LEU  84           H        LEU  84  -0.342 -13.296  -7.572
  615    HA   LEU  84           HA       LEU  84   1.396 -11.959  -9.597
  616   1HB   LEU  84          2HB       LEU  84   0.097 -10.665  -7.175
  617   2HB   LEU  84          1HB       LEU  84   1.328  -9.901  -8.180
  618    HG   LEU  84           HG       LEU  84  -1.072 -11.013  -9.563
  619   1HD1  LEU  84          1HD1      LEU  84  -1.904  -8.467  -9.066
  620   2HD1  LEU  84          2HD1      LEU  84  -1.136  -8.862  -7.528
  621   3HD1  LEU  84          3HD1      LEU  84  -2.446  -9.868  -8.144
  622   1HD2  LEU  84          1HD2      LEU  84  -0.664  -8.693 -10.728
  623   2HD2  LEU  84          2HD2      LEU  84   0.455 -10.021 -11.036
  624   3HD2  LEU  84          3HD2      LEU  84   0.886  -8.752  -9.889
  625    H    ARG  85           H        ARG  85   3.384 -10.989  -8.395
  626    HA   ARG  85           HA       ARG  85   4.175 -12.744  -6.103
  627   1HB   ARG  85          2HB       ARG  85   5.425 -12.432  -8.753
  628   2HB   ARG  85          1HB       ARG  85   6.549 -12.257  -7.405
  629   1HG   ARG  85          2HG       ARG  85   6.200 -14.428  -6.652
  630   2HG   ARG  85          1HG       ARG  85   4.594 -14.531  -7.375
  631   1HD   ARG  85          2HD       ARG  85   7.167 -14.416  -8.973
  632   2HD   ARG  85          1HD       ARG  85   6.319 -15.908  -8.575
  633    HE   ARG  85           HE       ARG  85   5.657 -14.289 -10.770
  634   1HH1  ARG  85          2HH1      ARG  85   4.347 -16.848  -9.296
  635   2HH1  ARG  85          1HH1      ARG  85   2.686 -16.378  -9.427
  636   1HH2  ARG  85          1HH2      ARG  85   3.404 -13.111 -10.364
  637   2HH2  ARG  85          2HH2      ARG  85   2.151 -14.259 -10.033
  638    H    LEU  86           H        LEU  86   5.643 -11.758  -4.596
  639    HA   LEU  86           HA       LEU  86   5.682  -8.781  -4.778
  640   1HB   LEU  86          2HB       LEU  86   4.733 -10.182  -2.743
  641   2HB   LEU  86          1HB       LEU  86   6.433 -10.256  -2.280
  642    HG   LEU  86           HG       LEU  86   5.683  -7.575  -3.129
  643   1HD1  LEU  86          1HD1      LEU  86   3.812  -9.025  -1.410
  644   2HD1  LEU  86          2HD1      LEU  86   3.632  -7.451  -2.185
  645   3HD1  LEU  86          3HD1      LEU  86   4.458  -7.579  -0.631
  646   1HD2  LEU  86          1HD2      LEU  86   6.532  -8.462  -0.373
  647   2HD2  LEU  86          2HD2      LEU  86   6.923  -6.963  -1.216
  648   3HD2  LEU  86          3HD2      LEU  86   7.670  -8.479  -1.721
  649    H    ILE  87           H        ILE  87   7.581  -7.734  -5.052
  650    HA   ILE  87           HA       ILE  87  10.129  -9.211  -4.530
  651    HB   ILE  87           HB       ILE  87  11.056  -8.035  -6.578
  652   1HG1  ILE  87          2HG1      ILE  87   8.274  -7.744  -7.618
  653   2HG1  ILE  87          1HG1      ILE  87   8.834  -6.504  -6.497
  654   1HG2  ILE  87          1HG2      ILE  87   8.993 -10.191  -6.599
  655   2HG2  ILE  87          2HG2      ILE  87  10.696 -10.260  -7.051
  656   3HG2  ILE  87          3HG2      ILE  87   9.518  -9.553  -8.157
  657   1HD1  ILE  87          1HD1      ILE  87  10.988  -6.900  -8.246
  658   2HD1  ILE  87          2HD1      ILE  87   9.877  -5.531  -8.242
  659   3HD1  ILE  87          3HD1      ILE  87   9.560  -6.920  -9.280
  660    HA   PRO  88           HA       PRO  88  11.270  -5.499  -2.428
  661   1HB   PRO  88          2HB       PRO  88  14.006  -5.825  -2.486
  662   2HB   PRO  88          1HB       PRO  88  12.935  -6.735  -1.407
  663   1HG   PRO  88          2HG       PRO  88  14.316  -7.649  -3.890
  664   2HG   PRO  88          1HG       PRO  88  13.814  -8.588  -2.475
  665   1HD   PRO  88          2HD       PRO  88  12.458  -8.498  -4.947
  666   2HD   PRO  88          1HD       PRO  88  11.790  -9.112  -3.420
  667    H    ARG  89           H        ARG  89  10.645  -3.897  -3.962
  668    HA   ARG  89           HA       ARG  89  12.777  -3.041  -5.884
  669   1HB   ARG  89          2HB       ARG  89  10.107  -3.811  -6.413
  670   2HB   ARG  89          1HB       ARG  89  10.155  -2.058  -6.595
  671   1HG   ARG  89          2HG       ARG  89  12.507  -2.994  -7.823
  672   2HG   ARG  89          1HG       ARG  89  11.241  -4.113  -8.329
  673   1HD   ARG  89          2HD       ARG  89  10.060  -2.490  -9.455
  674   2HD   ARG  89          1HD       ARG  89  10.598  -1.200  -8.379
  675    HE   ARG  89           HE       ARG  89  12.148  -2.295 -10.664
  676   1HH1  ARG  89          1HH2      ARG  89  13.867  -1.484  -8.317
  677   2HH1  ARG  89          2HH2      ARG  89  14.219   0.168  -8.700
  678   1HH2  ARG  89          2HH1      ARG  89  11.671   0.447 -11.037
  679   2HH2  ARG  89          1HH1      ARG  89  12.978   1.265 -10.247
  680    H    ASP  90           H        ASP  90  13.502  -0.970  -5.605
  681    HA   ASP  90           HA       ASP  90  12.534   0.644  -3.412
  682   1HB   ASP  90          2HB       ASP  90  14.085   2.380  -4.273
  683   2HB   ASP  90          1HB       ASP  90  14.874   0.810  -4.142
  684    H    ARG  91           H        ARG  91  11.296   2.569  -3.496
  685    HA   ARG  91           HA       ARG  91   9.535   2.759  -5.876
  686   1HB   ARG  91          2HB       ARG  91   8.900   2.746  -3.256
  687   2HB   ARG  91          1HB       ARG  91   9.073   4.484  -3.496
  688   1HG   ARG  91          2HG       ARG  91   6.817   4.115  -4.023
  689   2HG   ARG  91          1HG       ARG  91   7.588   4.086  -5.608
  690   1HD   ARG  91          2HD       ARG  91   7.746   1.451  -4.522
  691   2HD   ARG  91          1HD       ARG  91   6.083   2.010  -4.338
  692    HE   ARG  91           HE       ARG  91   6.259   2.590  -6.852
  693   1HH1  ARG  91          1HH2      ARG  91   5.825  -0.350  -6.208
  694   2HH1  ARG  91          2HH2      ARG  91   7.010  -1.099  -7.225
  695   1HH2  ARG  91          2HH1      ARG  91   8.791   1.844  -7.764
  696   2HH2  ARG  91          1HH1      ARG  91   8.701   0.149  -8.109
  697    H    VAL  92           H        VAL  92  10.106   4.197  -7.417
  698    HA   VAL  92           HA       VAL  92  11.682   6.606  -6.628
  699    HB   VAL  92           HB       VAL  92  11.241   5.392  -9.381
  700   1HG1  VAL  92          1HG1      VAL  92  13.305   7.458  -8.593
  701   2HG1  VAL  92          2HG1      VAL  92  11.700   7.926  -9.155
  702   3HG1  VAL  92          3HG1      VAL  92  12.769   7.006 -10.211
  703   1HG2  VAL  92          1HG2      VAL  92  12.646   3.878  -8.240
  704   2HG2  VAL  92          2HG2      VAL  92  13.453   5.160  -7.337
  705   3HG2  VAL  92          3HG2      VAL  92  13.785   4.947  -9.057
  706    H    GLY  93           H        GLY  93   9.772   7.716  -5.827
  707   1HA   GLY  93          2HA       GLY  93   7.849   8.565  -7.957
  708   2HA   GLY  93          1HA       GLY  93   7.487   8.572  -6.230
  709    H    HIS  94           HN       HIS  94  10.293   9.804  -8.075
  710    HA   HIS  94           HA       HIS  94   9.594  12.579  -7.377
  711   1HB   HIS  94          2HB       HIS  94  11.874  12.937  -6.323
  712   2HB   HIS  94          1HB       HIS  94  10.751  11.978  -5.361
  713    HD1  HIS  94           HD1      HIS  94  13.914  11.706  -7.368
  714    HD2  HIS  94           HD2      HIS  94  11.425   9.214  -5.138
  715    HE1  HIS  94           HE1      HIS  94  15.168   9.529  -7.061
  Start of MODEL    3
    1   1H    MET   1          1H        MET   1 -20.666 -11.845 -16.695
    2   2H    MET   1          2H        MET   1 -21.572 -11.143 -15.440
    3   3H    MET   1          3H        MET   1 -19.876 -11.093 -15.397
    4    HA   MET   1           HA       MET   1 -20.545  -9.947 -17.808
    5   1HB   MET   1          2HB       MET   1 -22.868  -9.871 -16.539
    6   2HB   MET   1          1HB       MET   1 -22.120  -8.514 -15.696
    7   1HG   MET   1          2HG       MET   1 -21.450  -7.825 -18.197
    8   2HG   MET   1          1HG       MET   1 -22.895  -8.771 -18.565
    9   1HE   MET   1          1HE       MET   1 -25.413  -6.200 -18.470
   10   2HE   MET   1          2HE       MET   1 -25.079  -7.922 -18.625
   11   3HE   MET   1          3HE       MET   1 -24.154  -6.764 -19.574
   12    H    SER   2           H        SER   2 -20.558  -8.711 -14.436
   13    HA   SER   2           HA       SER   2 -18.266  -6.960 -15.143
   14   1HB   SER   2          2HB       SER   2 -20.534  -6.735 -13.379
   15   2HB   SER   2          1HB       SER   2 -19.055  -6.562 -12.442
   16    HG   SER   2           HG       SER   2 -20.102  -4.974 -14.470
   17    H    GLY   3           H        GLY   3 -16.248  -7.197 -14.195
   18   1HA   GLY   3          2HA       GLY   3 -15.901  -9.475 -12.275
   19   2HA   GLY   3          1HA       GLY   3 -14.748  -9.151 -13.572
   20    H    GLY   4           H        GLY   4 -13.734  -6.936 -13.532
   21   1HA   GLY   4          2HA       GLY   4 -13.395  -5.946 -10.726
   22   2HA   GLY   4          1HA       GLY   4 -12.033  -6.100 -11.838
   23    H    THR   5           H        THR   5 -15.339  -4.736 -12.097
   24    HA   THR   5           HA       THR   5 -14.138  -2.116 -12.807
   25    HB   THR   5           HB       THR   5 -14.448  -3.194 -14.968
   26    HG1  THR   5           HG1      THR   5 -15.160  -1.352 -15.616
   27   1HG2  THR   5          1HG2      THR   5 -16.444  -4.223 -15.679
   28   2HG2  THR   5          2HG2      THR   5 -17.395  -3.472 -14.398
   29   3HG2  THR   5          3HG2      THR   5 -16.267  -4.772 -14.013
   30    H    ALA   6           H        ALA   6 -17.192  -3.910 -12.200
   31    HA   ALA   6           HA       ALA   6 -18.118  -1.549 -10.635
   32   1HB   ALA   6          1HB       ALA   6 -19.248  -2.536 -13.121
   33   2HB   ALA   6          2HB       ALA   6 -19.658  -1.082 -12.212
   34   3HB   ALA   6          3HB       ALA   6 -20.429  -2.617 -11.814
   35    H    ALA   7           H        ALA   7 -19.019  -2.109  -8.707
   36    HA   ALA   7           HA       ALA   7 -19.260  -4.985  -8.060
   37   1HB   ALA   7          1HB       ALA   7 -19.848  -3.858  -5.729
   38   2HB   ALA   7          2HB       ALA   7 -19.105  -2.442  -6.476
   39   3HB   ALA   7          3HB       ALA   7 -18.177  -3.930  -6.290
   40    H    THR   8           H        THR   8 -21.191  -5.777  -8.837
   41    HA   THR   8           HA       THR   8 -23.680  -4.365  -7.961
   42    HB   THR   8           HB       THR   8 -23.245  -5.803 -10.605
   43    HG1  THR   8           HG1      THR   8 -22.543  -3.904 -11.134
   44   1HG2  THR   8          1HG2      THR   8 -25.650  -4.681  -9.214
   45   2HG2  THR   8          2HG2      THR   8 -25.504  -6.145 -10.186
   46   3HG2  THR   8          3HG2      THR   8 -25.555  -4.566 -10.972
   47    H    THR   9           H        THR   9 -22.981  -7.492  -9.574
   48    HA   THR   9           HA       THR   9 -24.019  -8.900  -7.160
   49    HB   THR   9           HB       THR   9 -24.945  -9.453 -10.002
   50    HG1  THR   9           HG1      THR   9 -26.260  -8.325  -7.756
   51   1HG2  THR   9          1HG2      THR   9 -26.596 -10.933  -8.696
   52   2HG2  THR   9          2HG2      THR   9 -25.487 -10.764  -7.335
   53   3HG2  THR   9          3HG2      THR   9 -24.937 -11.518  -8.833
   54    H    ALA  10           H        ALA  10 -22.889  -9.663 -10.487
   55    HA   ALA  10           HA       ALA  10 -21.202 -11.835  -9.375
   56   1HB   ALA  10          1HB       ALA  10 -21.502 -12.833 -11.382
   57   2HB   ALA  10          2HB       ALA  10 -20.963 -11.393 -12.247
   58   3HB   ALA  10          3HB       ALA  10 -22.651 -11.548 -11.759
   59    H    GLY  11           H        GLY  11 -19.020 -11.595  -9.118
   60   1HA   GLY  11          2HA       GLY  11 -16.883 -10.631  -9.183
   61   2HA   GLY  11          1HA       GLY  11 -17.334  -9.954 -10.749
   62    H    SER  12           H        SER  12 -18.318  -9.443  -7.335
   63    HA   SER  12           HA       SER  12 -18.684  -6.576  -7.837
   64   1HB   SER  12          2HB       SER  12 -19.196  -8.451  -5.580
   65   2HB   SER  12          1HB       SER  12 -18.918  -6.762  -5.161
   66    HG   SER  12           HG       SER  12 -21.160  -7.588  -5.777
   67    H    LYS  13           H        LYS  13 -16.421  -8.639  -6.010
   68    HA   LYS  13           HA       LYS  13 -14.597  -6.274  -5.778
   69   1HB   LYS  13          2HB       LYS  13 -14.803  -8.696  -3.957
   70   2HB   LYS  13          1HB       LYS  13 -13.634  -7.389  -3.783
   71   1HG   LYS  13          2HG       LYS  13 -15.929  -5.946  -3.892
   72   2HG   LYS  13          1HG       LYS  13 -16.535  -7.428  -3.152
   73   1HD   LYS  13          2HD       LYS  13 -13.985  -6.558  -2.004
   74   2HD   LYS  13          1HD       LYS  13 -15.261  -5.359  -1.809
   75   1HE   LYS  13          2HE       LYS  13 -16.479  -6.687  -0.403
   76   2HE   LYS  13          1HE       LYS  13 -16.042  -8.166  -1.257
   77   1HZ   LYS  13          1HZ       LYS  13 -14.459  -6.673   0.748
   78   2HZ   LYS  13          2HZ       LYS  13 -13.741  -7.804  -0.298
   79   3HZ   LYS  13          3HZ       LYS  13 -14.950  -8.297   0.789
   80    H    VAL  14           H        VAL  14 -12.258  -6.850  -5.876
   81    HA   VAL  14           HA       VAL  14 -11.804  -9.180  -7.699
   82    HB   VAL  14           HB       VAL  14  -9.727  -7.874  -8.399
   83   1HG1  VAL  14          1HG1      VAL  14 -11.970  -7.973  -9.629
   84   2HG1  VAL  14          2HG1      VAL  14 -10.936  -6.595 -10.007
   85   3HG1  VAL  14          3HG1      VAL  14 -12.312  -6.393  -8.922
   86   1HG2  VAL  14          1HG2      VAL  14  -9.657  -5.500  -7.912
   87   2HG2  VAL  14          2HG2      VAL  14  -9.765  -6.363  -6.378
   88   3HG2  VAL  14          3HG2      VAL  14 -11.195  -5.583  -7.053
   89    H    THR  15           H        THR  15 -10.422 -10.754  -7.021
   90    HA   THR  15           HA       THR  15  -8.993 -10.331  -4.434
   91    HB   THR  15           HB       THR  15  -9.535 -12.953  -5.859
   92    HG1  THR  15           HG1      THR  15 -11.489 -12.760  -5.167
   93   1HG2  THR  15          1HG2      THR  15  -7.717 -12.683  -4.023
   94   2HG2  THR  15          2HG2      THR  15  -8.885 -13.994  -3.853
   95   3HG2  THR  15          3HG2      THR  15  -9.079 -12.514  -2.914
   96    H    PHE  16           H        PHE  16  -6.755 -10.682  -4.294
   97    HA   PHE  16           HA       PHE  16  -5.340 -11.301  -6.860
   98   1HB   PHE  16          2HB       PHE  16  -4.442  -9.277  -4.787
   99   2HB   PHE  16          1HB       PHE  16  -3.660  -9.623  -6.328
  100    HD1  PHE  16           HD1      PHE  16  -5.128  -9.328  -8.473
  101    HD2  PHE  16           HD2      PHE  16  -6.064  -7.585  -4.660
  102    HE1  PHE  16           HE1      PHE  16  -6.596  -7.672  -9.590
  103    HE2  PHE  16           HE2      PHE  16  -7.530  -5.929  -5.779
  104    HZ   PHE  16           HZ       PHE  16  -7.794  -5.972  -8.243
  105    H    LYS  17           H        LYS  17  -3.631 -12.717  -6.682
  106    HA   LYS  17           HA       LYS  17  -3.008 -13.738  -3.937
  107   1HB   LYS  17          2HB       LYS  17  -3.363 -15.069  -6.579
  108   2HB   LYS  17          1HB       LYS  17  -2.081 -15.703  -5.546
  109   1HG   LYS  17          2HG       LYS  17  -3.560 -16.373  -3.887
  110   2HG   LYS  17          1HG       LYS  17  -4.765 -15.165  -4.331
  111   1HD   LYS  17          2HD       LYS  17  -4.859 -16.545  -6.589
  112   2HD   LYS  17          1HD       LYS  17  -4.221 -17.838  -5.577
  113   1HE   LYS  17          2HE       LYS  17  -6.260 -18.192  -4.683
  114   2HE   LYS  17          1HE       LYS  17  -6.353 -16.507  -4.174
  115   1HZ   LYS  17          1HZ       LYS  17  -7.178 -15.893  -6.328
  116   2HZ   LYS  17          2HZ       LYS  17  -8.142 -17.141  -5.703
  117   3HZ   LYS  17          3HZ       LYS  17  -6.991 -17.476  -6.906
  118    H    ILE  18           H        ILE  18  -1.196 -12.588  -3.351
  119    HA   ILE  18           HA       ILE  18   0.995 -12.284  -5.350
  120    HB   ILE  18           HB       ILE  18   0.644 -10.960  -2.641
  121   1HG1  ILE  18          2HG1      ILE  18   0.478  -9.081  -4.744
  122   2HG1  ILE  18          1HG1      ILE  18  -0.549 -10.428  -5.231
  123   1HG2  ILE  18          1HG2      ILE  18   2.777 -10.308  -2.907
  124   2HG2  ILE  18          2HG2      ILE  18   2.319  -9.489  -4.401
  125   3HG2  ILE  18          3HG2      ILE  18   2.874 -11.162  -4.447
  126   1HD1  ILE  18          1HD1      ILE  18  -0.786  -9.590  -2.396
  127   2HD1  ILE  18          2HD1      ILE  18  -2.040 -10.080  -3.534
  128   3HD1  ILE  18          3HD1      ILE  18  -1.390  -8.442  -3.589
  129    H    THR  19           H        THR  19   2.654 -13.702  -5.231
  130    HA   THR  19           HA       THR  19   3.171 -15.090  -2.628
  131    HB   THR  19           HB       THR  19   4.091 -15.991  -5.373
  132    HG1  THR  19           HG1      THR  19   2.187 -16.786  -5.688
  133   1HG2  THR  19          1HG2      THR  19   5.025 -16.797  -3.012
  134   2HG2  THR  19          2HG2      THR  19   4.777 -17.934  -4.334
  135   3HG2  THR  19          3HG2      THR  19   3.575 -17.799  -3.050
  136    H    LEU  20           H        LEU  20   5.099 -14.630  -1.635
  137    HA   LEU  20           HA       LEU  20   6.879 -12.635  -2.703
  138   1HB   LEU  20          2HB       LEU  20   6.487 -13.873  -0.213
  139   2HB   LEU  20          1HB       LEU  20   8.129 -14.314  -0.680
  140    HG   LEU  20           HG       LEU  20   7.215 -11.469  -1.002
  141   1HD1  LEU  20          1HD1      LEU  20   8.363 -11.215   1.346
  142   2HD1  LEU  20          2HD1      LEU  20   7.894 -12.905   1.547
  143   3HD1  LEU  20          3HD1      LEU  20   6.665 -11.674   1.253
  144   1HD2  LEU  20          1HD2      LEU  20   9.616 -11.053  -0.637
  145   2HD2  LEU  20          2HD2      LEU  20   9.381 -12.221  -1.936
  146   3HD2  LEU  20          3HD2      LEU  20   9.873 -12.771  -0.334
  147    H    THR  21           H        THR  21   8.141 -13.024  -4.449
  148    HA   THR  21           HA       THR  21   9.181 -15.753  -4.945
  149    HB   THR  21           HB       THR  21   8.108 -14.441  -6.789
  150    HG1  THR  21           HG1      THR  21   9.357 -15.729  -7.851
  151   1HG2  THR  21          1HG2      THR  21   9.021 -12.469  -7.636
  152   2HG2  THR  21          2HG2      THR  21  10.604 -12.778  -6.923
  153   3HG2  THR  21          3HG2      THR  21   9.264 -12.259  -5.902
  154    H    SER  22           H        SER  22  10.356 -12.564  -3.988
  155    HA   SER  22           HA       SER  22  13.147 -13.060  -4.521
  156   1HB   SER  22          2HB       SER  22  13.540 -11.171  -2.936
  157   2HB   SER  22          1HB       SER  22  12.351 -10.783  -4.175
  158    HG   SER  22           HG       SER  22  11.281 -10.221  -2.411
  159    H    ASP  23           H        ASP  23  11.105 -13.540  -1.644
  160    HA   ASP  23           HA       ASP  23  13.389 -14.861  -0.273
  161   1HB   ASP  23          2HB       ASP  23  11.779 -13.042   0.774
  162   2HB   ASP  23          1HB       ASP  23  10.715 -14.427   1.022
  163    HA   PRO  24           HA       PRO  24  11.479 -18.707  -1.453
  164   1HB   PRO  24          2HB       PRO  24  13.445 -20.288  -0.359
  165   2HB   PRO  24          1HB       PRO  24  13.598 -19.468  -1.922
  166   1HG   PRO  24          2HG       PRO  24  14.873 -18.788   0.684
  167   2HG   PRO  24          1HG       PRO  24  15.423 -18.431  -0.962
  168   1HD   PRO  24          2HD       PRO  24  14.156 -16.611   0.804
  169   2HD   PRO  24          1HD       PRO  24  14.435 -16.366  -0.934
  170    H    LYS  25           H        LYS  25  10.615 -20.615  -0.321
  171    HA   LYS  25           HA       LYS  25   9.480 -21.672   1.421
  172   1HB   LYS  25          2HB       LYS  25  12.019 -20.846   2.506
  173   2HB   LYS  25          1HB       LYS  25  10.782 -20.685   3.752
  174   1HG   LYS  25          2HG       LYS  25  10.019 -23.054   2.941
  175   2HG   LYS  25          1HG       LYS  25  11.636 -23.144   2.245
  176   1HD   LYS  25          2HD       LYS  25  12.313 -22.266   4.690
  177   2HD   LYS  25          1HD       LYS  25  10.808 -23.082   5.112
  178   1HE   LYS  25          2HE       LYS  25  11.939 -25.033   5.101
  179   2HE   LYS  25          1HE       LYS  25  12.148 -24.842   3.364
  180   1HZ   LYS  25          1HZ       LYS  25  13.969 -23.854   5.489
  181   2HZ   LYS  25          2HZ       LYS  25  14.146 -23.495   3.839
  182   3HZ   LYS  25          3HZ       LYS  25  14.280 -25.100   4.381
  183    H    LEU  26           H        LEU  26   8.003 -19.703   0.563
  184    HA   LEU  26           HA       LEU  26   6.838 -18.504   3.005
  185   1HB   LEU  26          2HB       LEU  26   8.449 -17.011   1.160
  186   2HB   LEU  26          1HB       LEU  26   6.781 -16.454   1.020
  187    HG   LEU  26           HG       LEU  26   7.467 -16.873   3.802
  188   1HD1  LEU  26          1HD1      LEU  26   9.047 -14.819   3.818
  189   2HD1  LEU  26          2HD1      LEU  26   9.337 -15.205   2.122
  190   3HD1  LEU  26          3HD1      LEU  26   9.736 -16.380   3.374
  191   1HD2  LEU  26          1HD2      LEU  26   5.872 -15.282   3.787
  192   2HD2  LEU  26          2HD2      LEU  26   6.112 -14.991   2.063
  193   3HD2  LEU  26          3HD2      LEU  26   7.099 -14.136   3.248
  194    HA   PRO  27           HA       PRO  27   3.217 -19.710   0.719
  195   1HB   PRO  27          2HB       PRO  27   1.392 -18.753   2.543
  196   2HB   PRO  27          1HB       PRO  27   2.286 -20.268   2.748
  197   1HG   PRO  27          2HG       PRO  27   2.693 -17.650   4.114
  198   2HG   PRO  27          1HG       PRO  27   3.074 -19.284   4.681
  199   1HD   PRO  27          2HD       PRO  27   4.932 -17.422   3.642
  200   2HD   PRO  27          1HD       PRO  27   5.221 -19.157   3.888
  201    H    PHE  28           H        PHE  28   1.429 -18.695  -0.419
  202    HA   PHE  28           HA       PHE  28   1.952 -15.929  -1.210
  203   1HB   PHE  28          2HB       PHE  28   0.126 -16.261  -2.820
  204   2HB   PHE  28          1HB       PHE  28   1.240 -17.624  -2.869
  205    HD1  PHE  28           HD1      PHE  28   0.579 -19.829  -2.067
  206    HD2  PHE  28           HD2      PHE  28  -2.117 -16.492  -1.814
  207    HE1  PHE  28           HE1      PHE  28  -1.296 -21.379  -1.591
  208    HE2  PHE  28           HE2      PHE  28  -3.990 -18.046  -1.335
  209    HZ   PHE  28           HZ       PHE  28  -3.579 -20.487  -1.224
  210    H    LYS  29           H        LYS  29   0.319 -14.213  -1.135
  211    HA   LYS  29           HA       LYS  29  -1.463 -14.454   1.259
  212   1HB   LYS  29          2HB       LYS  29   0.564 -12.624   0.792
  213   2HB   LYS  29          1HB       LYS  29  -0.880 -11.736   0.310
  214   1HG   LYS  29          2HG       LYS  29  -1.630 -13.032   2.672
  215   2HG   LYS  29          1HG       LYS  29   0.018 -12.488   2.978
  216   1HD   LYS  29          2HD       LYS  29  -1.341 -10.654   3.620
  217   2HD   LYS  29          1HD       LYS  29  -0.732 -10.218   2.024
  218   1HE   LYS  29          2HE       LYS  29  -2.814 -10.168   1.165
  219   2HE   LYS  29          1HE       LYS  29  -3.187 -11.759   1.819
  220   1HZ   LYS  29          1HZ       LYS  29  -4.062 -10.888   3.709
  221   2HZ   LYS  29          2HZ       LYS  29  -4.429  -9.619   2.640
  222   3HZ   LYS  29          3HZ       LYS  29  -3.088  -9.499   3.675
  223    H    VAL  30           H        VAL  30  -3.626 -14.161   0.942
  224    HA   VAL  30           HA       VAL  30  -4.544 -13.460  -1.802
  225    HB   VAL  30           HB       VAL  30  -6.126 -14.604   0.526
  226   1HG1  VAL  30          1HG1      VAL  30  -6.765 -14.507  -2.437
  227   2HG1  VAL  30          2HG1      VAL  30  -7.419 -13.382  -1.246
  228   3HG1  VAL  30          3HG1      VAL  30  -7.814 -15.098  -1.148
  229   1HG2  VAL  30          1HG2      VAL  30  -4.825 -16.433   0.054
  230   2HG2  VAL  30          2HG2      VAL  30  -4.394 -15.841  -1.552
  231   3HG2  VAL  30          3HG2      VAL  30  -5.957 -16.615  -1.287
  232    H    LEU  31           H        LEU  31  -5.284 -11.428  -2.158
  233    HA   LEU  31           HA       LEU  31  -6.241  -9.834   0.190
  234   1HB   LEU  31          2HB       LEU  31  -4.240  -9.253  -1.762
  235   2HB   LEU  31          1HB       LEU  31  -5.592  -8.158  -2.049
  236    HG   LEU  31           HG       LEU  31  -4.970  -8.479   0.799
  237   1HD1  LEU  31          1HD1      LEU  31  -2.814  -7.675   0.881
  238   2HD1  LEU  31          2HD1      LEU  31  -2.963  -6.819  -0.653
  239   3HD1  LEU  31          3HD1      LEU  31  -2.708  -8.563  -0.639
  240   1HD2  LEU  31          1HD2      LEU  31  -5.149  -6.089  -1.066
  241   2HD2  LEU  31          2HD2      LEU  31  -5.109  -6.009   0.696
  242   3HD2  LEU  31          3HD2      LEU  31  -6.480  -6.759  -0.121
  243    H    SER  32           H        SER  32  -8.445  -9.913   0.122
  244    HA   SER  32           HA       SER  32  -9.811  -9.747  -2.521
  245   1HB   SER  32          2HB       SER  32 -10.303 -11.335  -0.284
  246   2HB   SER  32          1HB       SER  32 -11.538 -10.085  -0.185
  247    HG   SER  32           HG       SER  32 -12.400 -11.561  -1.524
  248    H    VAL  33           H        VAL  33  -9.990  -7.610  -3.065
  249    HA   VAL  33           HA       VAL  33 -11.407  -5.821  -1.141
  250    HB   VAL  33           HB       VAL  33  -9.923  -3.935  -1.965
  251   1HG1  VAL  33          1HG1      VAL  33  -9.393  -4.588   0.203
  252   2HG1  VAL  33          2HG1      VAL  33  -7.864  -4.887  -0.622
  253   3HG1  VAL  33          3HG1      VAL  33  -8.959  -6.226  -0.284
  254   1HG2  VAL  33          1HG2      VAL  33  -7.881  -4.427  -3.096
  255   2HG2  VAL  33          2HG2      VAL  33  -9.122  -5.324  -3.971
  256   3HG2  VAL  33          3HG2      VAL  33  -8.066  -6.162  -2.834
  257    HA   PRO  34           HA       PRO  34 -13.822  -4.752  -4.658
  258   1HB   PRO  34          2HB       PRO  34 -14.525  -2.171  -4.011
  259   2HB   PRO  34          1HB       PRO  34 -15.222  -3.604  -3.238
  260   1HG   PRO  34          2HG       PRO  34 -13.201  -1.687  -2.166
  261   2HG   PRO  34          1HG       PRO  34 -14.382  -2.678  -1.292
  262   1HD   PRO  34          2HD       PRO  34 -11.631  -3.248  -1.549
  263   2HD   PRO  34          1HD       PRO  34 -12.882  -4.395  -1.022
  264    H    GLU  35           H        GLU  35 -13.826  -3.435  -6.611
  265    HA   GLU  35           HA       GLU  35 -11.264  -2.691  -7.591
  266   1HB   GLU  35          2HB       GLU  35 -12.462  -1.724  -9.517
  267   2HB   GLU  35          1HB       GLU  35 -13.122  -3.299  -9.086
  268   1HG   GLU  35          2HG       GLU  35 -14.392  -0.970  -7.752
  269   2HG   GLU  35          1HG       GLU  35 -14.657  -1.093  -9.489
  270    H    SER  36           H        SER  36 -13.557  -0.850  -5.715
  271    HA   SER  36           HA       SER  36 -12.806   1.800  -6.441
  272   1HB   SER  36          2HB       SER  36 -14.102   0.516  -4.091
  273   2HB   SER  36          1HB       SER  36 -13.396   2.107  -3.822
  274    HG   SER  36           HG       SER  36 -15.639   2.035  -4.601
  275    H    THR  37           H        THR  37 -11.396  -0.444  -4.036
  276    HA   THR  37           HA       THR  37  -9.469   1.450  -3.021
  277    HB   THR  37           HB       THR  37  -8.306  -0.572  -2.113
  278    HG1  THR  37           HG1      THR  37  -8.613  -2.249  -3.352
  279   1HG2  THR  37          1HG2      THR  37 -10.348   0.534  -1.046
  280   2HG2  THR  37          2HG2      THR  37 -10.010  -1.124  -0.548
  281   3HG2  THR  37          3HG2      THR  37 -11.291  -0.798  -1.716
  282    HA   PRO  38           HA       PRO  38  -6.686   1.341  -6.459
  283   1HB   PRO  38          2HB       PRO  38  -4.695   2.819  -5.277
  284   2HB   PRO  38          1HB       PRO  38  -6.183   3.524  -5.931
  285   1HG   PRO  38          2HG       PRO  38  -5.409   3.088  -3.086
  286   2HG   PRO  38          1HG       PRO  38  -6.517   4.285  -3.777
  287   1HD   PRO  38          2HD       PRO  38  -7.265   1.889  -2.459
  288   2HD   PRO  38          1HD       PRO  38  -8.332   2.936  -3.419
  289    H    PHE  39           H        PHE  39  -4.451   0.591  -6.947
  290    HA   PHE  39           HA       PHE  39  -3.765  -1.841  -5.578
  291   1HB   PHE  39          2HB       PHE  39  -3.229  -1.105  -8.023
  292   2HB   PHE  39          1HB       PHE  39  -1.812  -0.335  -7.311
  293    HD1  PHE  39           HD1      PHE  39  -3.644  -3.587  -6.819
  294    HD2  PHE  39           HD2      PHE  39   0.121  -1.621  -7.468
  295    HE1  PHE  39           HE1      PHE  39  -2.486  -5.778  -6.751
  296    HE2  PHE  39           HE2      PHE  39   1.277  -3.813  -7.399
  297    HZ   PHE  39           HZ       PHE  39  -0.027  -5.891  -7.041
  298    H    THR  40           H        THR  40  -2.950   1.477  -4.966
  299    HA   THR  40           HA       THR  40  -0.433   1.151  -3.646
  300    HB   THR  40           HB       THR  40  -1.115   3.261  -2.406
  301    HG1  THR  40           HG1      THR  40  -3.138   3.755  -2.409
  302   1HG2  THR  40          1HG2      THR  40   0.032   3.826  -4.317
  303   2HG2  THR  40          2HG2      THR  40  -1.541   4.504  -4.735
  304   3HG2  THR  40          3HG2      THR  40  -1.063   2.929  -5.367
  305    H    ALA  41           H        ALA  41  -3.789   1.004  -2.441
  306    HA   ALA  41           HA       ALA  41  -3.023   0.380   0.291
  307   1HB   ALA  41          1HB       ALA  41  -5.208   1.405  -0.248
  308   2HB   ALA  41          2HB       ALA  41  -5.421  -0.128   0.597
  309   3HB   ALA  41          3HB       ALA  41  -5.664  -0.042  -1.149
  310    H    VAL  42           H        VAL  42  -3.973  -1.521  -2.569
  311    HA   VAL  42           HA       VAL  42  -4.143  -4.075  -1.284
  312    HB   VAL  42           HB       VAL  42  -3.325  -3.402  -4.134
  313   1HG1  VAL  42          1HG1      VAL  42  -4.370  -5.799  -4.421
  314   2HG1  VAL  42          2HG1      VAL  42  -3.958  -5.976  -2.715
  315   3HG1  VAL  42          3HG1      VAL  42  -2.693  -5.638  -3.897
  316   1HG2  VAL  42          1HG2      VAL  42  -6.016  -4.466  -3.398
  317   2HG2  VAL  42          2HG2      VAL  42  -5.565  -3.344  -4.681
  318   3HG2  VAL  42          3HG2      VAL  42  -5.687  -2.775  -3.017
  319    H    LEU  43           H        LEU  43  -1.410  -2.450  -2.916
  320    HA   LEU  43           HA       LEU  43   0.523  -4.521  -2.444
  321   1HB   LEU  43          2HB       LEU  43   0.685  -2.542  -4.069
  322   2HB   LEU  43          1HB       LEU  43   1.139  -1.567  -2.672
  323    HG   LEU  43           HG       LEU  43   2.641  -4.071  -2.797
  324   1HD1  LEU  43          1HD1      LEU  43   4.076  -3.149  -4.736
  325   2HD1  LEU  43          2HD1      LEU  43   2.662  -2.180  -5.151
  326   3HD1  LEU  43          3HD1      LEU  43   2.559  -3.941  -5.161
  327   1HD2  LEU  43          1HD2      LEU  43   4.463  -2.077  -2.915
  328   2HD2  LEU  43          2HD2      LEU  43   3.656  -2.537  -1.417
  329   3HD2  LEU  43          3HD2      LEU  43   3.069  -1.159  -2.347
  330    H    LYS  44           H        LYS  44  -0.519  -1.713  -0.539
  331    HA   LYS  44           HA       LYS  44   1.548  -1.831   1.448
  332   1HB   LYS  44          2HB       LYS  44  -1.225  -0.670   1.343
  333   2HB   LYS  44          1HB       LYS  44  -0.352  -0.709   2.875
  334   1HG   LYS  44          2HG       LYS  44   1.383   0.230   0.749
  335   2HG   LYS  44          1HG       LYS  44  -0.083   1.208   0.830
  336   1HD   LYS  44          2HD       LYS  44   0.310   1.844   3.060
  337   2HD   LYS  44          1HD       LYS  44   1.429   0.510   3.342
  338   1HE   LYS  44          2HE       LYS  44   3.049   1.543   1.780
  339   2HE   LYS  44          1HE       LYS  44   1.936   2.887   1.527
  340   1HZ   LYS  44          1HZ       LYS  44   3.671   3.342   3.200
  341   2HZ   LYS  44          2HZ       LYS  44   3.034   2.103   4.171
  342   3HZ   LYS  44          3HZ       LYS  44   2.099   3.478   3.822
  343    H    PHE  45           H        PHE  45  -1.783  -3.155   1.446
  344    HA   PHE  45           HA       PHE  45  -1.600  -4.478   3.969
  345   1HB   PHE  45          2HB       PHE  45  -3.631  -4.041   2.284
  346   2HB   PHE  45          1HB       PHE  45  -3.247  -5.687   1.786
  347    HD1  PHE  45           HD1      PHE  45  -4.664  -7.240   2.785
  348    HD2  PHE  45           HD2      PHE  45  -3.282  -3.887   5.090
  349    HE1  PHE  45           HE1      PHE  45  -5.856  -8.114   4.776
  350    HE2  PHE  45           HE2      PHE  45  -4.473  -4.763   7.079
  351    HZ   PHE  45           HZ       PHE  45  -5.760  -6.876   6.923
  352    H    ALA  46           H        ALA  46  -0.838  -5.602   0.670
  353    HA   ALA  46           HA       ALA  46  -0.271  -8.327   1.387
  354   1HB   ALA  46          1HB       ALA  46   1.018  -8.336  -0.790
  355   2HB   ALA  46          2HB       ALA  46   0.672  -6.613  -0.927
  356   3HB   ALA  46          3HB       ALA  46  -0.650  -7.780  -0.931
  357    H    ALA  47           H        ALA  47   1.881  -5.493   0.969
  358    HA   ALA  47           HA       ALA  47   4.306  -6.885   1.632
  359   1HB   ALA  47          1HB       ALA  47   4.863  -4.320   2.340
  360   2HB   ALA  47          2HB       ALA  47   3.461  -4.063   1.303
  361   3HB   ALA  47          3HB       ALA  47   4.883  -4.894   0.673
  362    H    GLU  48           H        GLU  48   1.939  -5.115   3.614
  363    HA   GLU  48           HA       GLU  48   3.412  -5.070   6.052
  364   1HB   GLU  48          2HB       GLU  48   0.631  -4.665   5.223
  365   2HB   GLU  48          1HB       GLU  48   0.763  -5.377   6.831
  366   1HG   GLU  48          2HG       GLU  48   0.931  -3.128   7.372
  367   2HG   GLU  48          1HG       GLU  48   2.633  -3.520   7.139
  368    H    GLU  49           H        GLU  49   1.133  -7.516   4.779
  369    HA   GLU  49           HA       GLU  49   1.468  -9.291   7.056
  370   1HB   GLU  49          2HB       GLU  49   0.108  -9.409   4.405
  371   2HB   GLU  49          1HB       GLU  49   0.518 -10.948   5.161
  372   1HG   GLU  49          2HG       GLU  49  -1.582 -10.551   6.083
  373   2HG   GLU  49          1HG       GLU  49  -0.537  -9.836   7.309
  374    H    PHE  50           H        PHE  50   3.121  -8.848   3.979
  375    HA   PHE  50           HA       PHE  50   4.562 -11.391   4.139
  376   1HB   PHE  50          2HB       PHE  50   4.452  -9.076   2.277
  377   2HB   PHE  50          1HB       PHE  50   5.967  -9.973   2.319
  378    HD1  PHE  50           HD1      PHE  50   3.192  -9.747   0.425
  379    HD2  PHE  50           HD2      PHE  50   5.245 -12.723   2.748
  380    HE1  PHE  50           HE1      PHE  50   2.179 -11.533  -0.963
  381    HE2  PHE  50           HE2      PHE  50   4.229 -14.505   1.358
  382    HZ   PHE  50           HZ       PHE  50   2.699 -13.912  -0.496
  383    H    LYS  51           H        LYS  51   4.840  -8.661   5.972
  384    HA   LYS  51           HA       LYS  51   6.501  -7.824   7.371
  385   1HB   LYS  51          2HB       LYS  51   7.590 -10.538   6.657
  386   2HB   LYS  51          1HB       LYS  51   8.568  -9.417   7.607
  387   1HG   LYS  51          2HG       LYS  51   7.128  -9.467   9.415
  388   2HG   LYS  51          1HG       LYS  51   5.718  -9.818   8.419
  389   1HD   LYS  51          2HD       LYS  51   6.875 -12.102   7.970
  390   2HD   LYS  51          1HD       LYS  51   7.852 -11.711   9.383
  391   1HE   LYS  51          2HE       LYS  51   4.888 -11.393   9.606
  392   2HE   LYS  51          1HE       LYS  51   5.547 -13.025   9.628
  393   1HZ   LYS  51          1HZ       LYS  51   5.492 -12.308  11.848
  394   2HZ   LYS  51          2HZ       LYS  51   6.158 -10.792  11.473
  395   3HZ   LYS  51          3HZ       LYS  51   7.118 -12.188  11.385
  396    H    VAL  52           H        VAL  52   6.435  -6.814   4.768
  397    HA   VAL  52           HA       VAL  52   9.299  -6.087   4.390
  398    HB   VAL  52           HB       VAL  52   8.874  -6.093   1.882
  399   1HG1  VAL  52          1HG1      VAL  52  10.144  -7.882   3.063
  400   2HG1  VAL  52          2HG1      VAL  52   9.274  -8.492   1.655
  401   3HG1  VAL  52          3HG1      VAL  52   8.638  -8.776   3.275
  402   1HG2  VAL  52          1HG2      VAL  52   6.451  -6.135   1.854
  403   2HG2  VAL  52          2HG2      VAL  52   6.419  -7.623   2.800
  404   3HG2  VAL  52          3HG2      VAL  52   7.027  -7.643   1.146
  405    HA   PRO  53           HA       PRO  53   7.676  -2.015   4.199
  406   1HB   PRO  53          2HB       PRO  53   9.559  -0.799   2.606
  407   2HB   PRO  53          1HB       PRO  53   9.818  -1.224   4.305
  408   1HG   PRO  53          2HG       PRO  53  10.865  -2.566   1.851
  409   2HG   PRO  53          1HG       PRO  53  11.560  -2.509   3.481
  410   1HD   PRO  53          2HD       PRO  53  10.160  -4.694   2.371
  411   2HD   PRO  53          1HD       PRO  53  10.527  -4.465   4.095
  412    H    ALA  54           H        ALA  54   5.906  -1.447   3.082
  413    HA   ALA  54           HA       ALA  54   5.425  -2.246   0.333
  414   1HB   ALA  54          1HB       ALA  54   3.463  -2.113   1.602
  415   2HB   ALA  54          2HB       ALA  54   3.409  -0.610   0.682
  416   3HB   ALA  54          3HB       ALA  54   3.942  -0.597   2.364
  417    H    ALA  55           H        ALA  55   6.487   0.729   1.915
  418    HA   ALA  55           HA       ALA  55   6.125   2.534  -0.264
  419   1HB   ALA  55          1HB       ALA  55   8.379   2.672   1.748
  420   2HB   ALA  55          2HB       ALA  55   6.716   3.095   2.158
  421   3HB   ALA  55          3HB       ALA  55   7.581   4.011   0.923
  422    H    THR  56           H        THR  56   8.680   0.179   0.411
  423    HA   THR  56           HA       THR  56   9.992   1.003  -2.151
  424    HB   THR  56           HB       THR  56  12.107   0.063  -1.135
  425    HG1  THR  56           HG1      THR  56  11.977  -0.838   0.740
  426   1HG2  THR  56          1HG2      THR  56  10.755   2.387   0.258
  427   2HG2  THR  56          2HG2      THR  56  11.745   2.465  -1.200
  428   3HG2  THR  56          3HG2      THR  56  12.482   2.038   0.345
  429    H    SER  57           H        SER  57   7.915  -0.768  -2.343
  430    HA   SER  57           HA       SER  57   9.322  -3.238  -3.162
  431   1HB   SER  57          2HB       SER  57   7.699  -4.710  -2.074
  432   2HB   SER  57          1HB       SER  57   8.512  -3.715  -0.874
  433    HG   SER  57           HG       SER  57   6.061  -3.929  -0.909
  434    H    ALA  58           H        ALA  58   8.320  -4.297  -4.878
  435    HA   ALA  58           HA       ALA  58   5.872  -2.980  -5.993
  436   1HB   ALA  58          1HB       ALA  58   7.124  -2.403  -7.777
  437   2HB   ALA  58          2HB       ALA  58   7.300  -4.120  -8.136
  438   3HB   ALA  58          3HB       ALA  58   8.511  -3.296  -7.155
  439    H    ILE  59           H        ILE  59   4.740  -4.485  -7.615
  440    HA   ILE  59           HA       ILE  59   4.997  -7.338  -6.745
  441    HB   ILE  59           HB       ILE  59   2.548  -5.598  -7.000
  442   1HG1  ILE  59          2HG1      ILE  59   3.278  -7.759  -5.003
  443   2HG1  ILE  59          1HG1      ILE  59   3.732  -6.066  -4.802
  444   1HG2  ILE  59          1HG2      ILE  59   2.214  -8.562  -6.785
  445   2HG2  ILE  59          2HG2      ILE  59   2.520  -7.891  -8.385
  446   3HG2  ILE  59          3HG2      ILE  59   1.120  -7.356  -7.460
  447   1HD1  ILE  59          1HD1      ILE  59   1.423  -5.374  -4.746
  448   2HD1  ILE  59          2HD1      ILE  59   1.593  -6.722  -3.621
  449   3HD1  ILE  59          3HD1      ILE  59   0.874  -6.986  -5.210
  450    H    ILE  60           H        ILE  60   5.503  -8.606  -8.462
  451    HA   ILE  60           HA       ILE  60   4.917  -7.590 -11.197
  452    HB   ILE  60           HB       ILE  60   6.504  -9.307 -11.976
  453   1HG1  ILE  60          2HG1      ILE  60   7.425 -10.004  -9.257
  454   2HG1  ILE  60          1HG1      ILE  60   5.844 -10.658  -9.680
  455   1HG2  ILE  60          1HG2      ILE  60   7.271  -7.041 -11.113
  456   2HG2  ILE  60          2HG2      ILE  60   8.500  -8.303 -11.114
  457   3HG2  ILE  60          3HG2      ILE  60   7.700  -7.851  -9.609
  458   1HD1  ILE  60          1HD1      ILE  60   8.369 -10.963 -11.331
  459   2HD1  ILE  60          2HD1      ILE  60   6.786 -11.622 -11.742
  460   3HD1  ILE  60          3HD1      ILE  60   7.648 -12.216 -10.323
  461    H    THR  61           H        THR  61   4.382  -9.503 -12.803
  462    HA   THR  61           HA       THR  61   2.095 -10.991 -11.601
  463    HB   THR  61           HB       THR  61   1.350 -11.292 -13.962
  464    HG1  THR  61           HG1      THR  61   2.579 -10.677 -15.565
  465   1HG2  THR  61          1HG2      THR  61   1.358  -8.585 -14.336
  466   2HG2  THR  61          2HG2      THR  61   1.711  -8.693 -12.613
  467   3HG2  THR  61          3HG2      THR  61   0.249  -9.435 -13.260
  468    H    ASN  62           H        ASN  62   1.709 -13.201 -12.770
  469    HA   ASN  62           HA       ASN  62   3.998 -14.882 -12.242
  470   1HB   ASN  62          2HB       ASN  62   1.190 -15.267 -13.118
  471   2HB   ASN  62          1HB       ASN  62   2.325 -16.528 -13.604
  472   1HD2  ASN  62          1HD2      ASN  62   2.780 -18.095 -12.036
  473   2HD2  ASN  62          2HD2      ASN  62   2.470 -17.920 -10.376
  474    H    ASP  63           H        ASP  63   2.839 -13.245 -15.094
  475    HA   ASP  63           HA       ASP  63   4.331 -14.950 -16.964
  476   1HB   ASP  63          2HB       ASP  63   2.920 -12.289 -17.352
  477   2HB   ASP  63          1HB       ASP  63   3.629 -13.250 -18.650
  478    H    GLY  64           H        GLY  64   4.561 -11.520 -15.918
  479   1HA   GLY  64          2HA       GLY  64   7.147 -11.211 -15.230
  480   2HA   GLY  64          1HA       GLY  64   7.317 -11.373 -16.977
  481    H    VAL  65           H        VAL  65   5.015  -9.640 -14.837
  482    HA   VAL  65           HA       VAL  65   5.668  -7.131 -16.335
  483    HB   VAL  65           HB       VAL  65   2.916  -8.011 -15.395
  484   1HG1  VAL  65          1HG1      VAL  65   2.822  -5.691 -15.289
  485   2HG1  VAL  65          2HG1      VAL  65   2.381  -5.959 -16.975
  486   3HG1  VAL  65          3HG1      VAL  65   4.027  -5.480 -16.559
  487   1HG2  VAL  65          1HG2      VAL  65   2.826  -7.598 -18.130
  488   2HG2  VAL  65          2HG2      VAL  65   2.939  -9.174 -17.347
  489   3HG2  VAL  65          3HG2      VAL  65   4.400  -8.363 -17.910
  490    H    GLY  66           H        GLY  66   6.431  -5.622 -14.946
  491   1HA   GLY  66          2HA       GLY  66   6.257  -5.988 -12.064
  492   2HA   GLY  66          1HA       GLY  66   7.062  -4.657 -12.891
  493    H    VAL  67           H        VAL  67   4.004  -5.818 -11.641
  494    HA   VAL  67           HA       VAL  67   2.436  -3.507 -12.427
  495    HB   VAL  67           HB       VAL  67   1.885  -5.401 -10.121
  496   1HG1  VAL  67          1HG1      VAL  67  -0.091  -3.979 -11.905
  497   2HG1  VAL  67          2HG1      VAL  67   0.556  -3.216 -10.452
  498   3HG1  VAL  67          3HG1      VAL  67  -0.370  -4.711 -10.326
  499   1HG2  VAL  67          1HG2      VAL  67   1.438  -5.682 -13.096
  500   2HG2  VAL  67          2HG2      VAL  67   0.435  -6.546 -11.930
  501   3HG2  VAL  67          3HG2      VAL  67   2.173  -6.839 -11.986
  502    H    ASN  68           H        ASN  68   2.385  -1.536 -11.471
  503    HA   ASN  68           HA       ASN  68   3.768  -1.211  -8.838
  504   1HB   ASN  68          2HB       ASN  68   3.555   0.495 -11.288
  505   2HB   ASN  68          1HB       ASN  68   3.690   1.302  -9.726
  506   1HD2  ASN  68          1HD2      ASN  68   5.771   1.413  -8.798
  507   2HD2  ASN  68          2HD2      ASN  68   7.124   0.580  -9.391
  508    HA   PRO  69           HA       PRO  69   0.020   0.233  -7.037
  509   1HB   PRO  69          2HB       PRO  69   1.025   2.025  -5.205
  510   2HB   PRO  69          1HB       PRO  69   1.146   0.267  -5.024
  511   1HG   PRO  69          2HG       PRO  69   3.265   2.225  -5.771
  512   2HG   PRO  69          1HG       PRO  69   3.424   0.642  -4.994
  513   1HD   PRO  69          2HD       PRO  69   3.920   1.216  -7.724
  514   2HD   PRO  69          1HD       PRO  69   3.776  -0.401  -7.002
  515    H    ALA  70           H        ALA  70  -0.080   1.393  -9.386
  516    HA   ALA  70           HA       ALA  70  -0.505   4.310  -8.866
  517   1HB   ALA  70          1HB       ALA  70   0.511   3.061 -11.435
  518   2HB   ALA  70          2HB       ALA  70   1.495   3.955 -10.276
  519   3HB   ALA  70          3HB       ALA  70   0.215   4.779 -11.166
  520    H    GLN  71           H        GLN  71  -1.876   1.353  -9.976
  521    HA   GLN  71           HA       GLN  71  -4.159   2.839 -11.216
  522   1HB   GLN  71          2HB       GLN  71  -4.629   0.733 -12.459
  523   2HB   GLN  71          1HB       GLN  71  -3.030   1.374 -12.824
  524   1HG   GLN  71          2HG       GLN  71  -2.855  -0.368 -10.535
  525   2HG   GLN  71          1HG       GLN  71  -3.672  -1.210 -11.850
  526   1HE2  GLN  71          1HE2      GLN  71  -2.406  -1.850 -13.664
  527   2HE2  GLN  71          2HE2      GLN  71  -0.748  -1.519 -13.809
  528    HA   PRO  72           HA       PRO  72  -6.839   1.162  -8.155
  529   1HB   PRO  72          2HB       PRO  72  -9.115   0.661  -9.618
  530   2HB   PRO  72          1HB       PRO  72  -8.580   2.285  -9.153
  531   1HG   PRO  72          2HG       PRO  72  -8.433   0.951 -11.818
  532   2HG   PRO  72          1HG       PRO  72  -8.538   2.676 -11.431
  533   1HD   PRO  72          2HD       PRO  72  -6.194   1.303 -12.189
  534   2HD   PRO  72          1HD       PRO  72  -6.257   2.916 -11.448
  535    H    ALA  73           H        ALA  73  -7.869  -0.809  -7.368
  536    HA   ALA  73           HA       ALA  73  -6.613  -3.244  -8.111
  537   1HB   ALA  73          1HB       ALA  73  -7.555  -3.821  -6.152
  538   2HB   ALA  73          2HB       ALA  73  -9.123  -3.895  -6.956
  539   3HB   ALA  73          3HB       ALA  73  -8.592  -2.396  -6.200
  540    H    GLY  74           H        GLY  74  -9.745  -1.874  -9.117
  541   1HA   GLY  74          2HA       GLY  74 -10.783  -4.112 -10.510
  542   2HA   GLY  74          1HA       GLY  74 -11.133  -2.432 -10.925
  543    H    ASN  75           H        ASN  75  -8.590  -1.529 -11.656
  544    HA   ASN  75           HA       ASN  75  -8.351  -2.569 -14.341
  545   1HB   ASN  75          2HB       ASN  75  -7.738  -0.204 -13.354
  546   2HB   ASN  75          1HB       ASN  75  -6.174  -0.957 -13.041
  547   1HD2  ASN  75          1HD2      ASN  75  -4.821  -1.469 -14.870
  548   2HD2  ASN  75          2HD2      ASN  75  -5.220  -1.006 -16.454
  549    H    ILE  76           H        ILE  76  -6.580  -3.120 -11.320
  550    HA   ILE  76           HA       ILE  76  -4.324  -4.504 -12.392
  551    HB   ILE  76           HB       ILE  76  -5.741  -4.832  -9.726
  552   1HG1  ILE  76          2HG1      ILE  76  -4.739  -2.566 -10.350
  553   2HG1  ILE  76          1HG1      ILE  76  -4.121  -3.290  -8.869
  554   1HG2  ILE  76          1HG2      ILE  76  -3.083  -5.536  -9.379
  555   2HG2  ILE  76          2HG2      ILE  76  -3.487  -6.270 -10.931
  556   3HG2  ILE  76          3HG2      ILE  76  -4.433  -6.664  -9.496
  557   1HD1  ILE  76          1HD1      ILE  76  -2.785  -3.377 -11.591
  558   2HD1  ILE  76          2HD1      ILE  76  -2.178  -4.180 -10.142
  559   3HD1  ILE  76          3HD1      ILE  76  -2.262  -2.420 -10.204
  560    H    PHE  77           H        PHE  77  -7.527  -5.696 -11.349
  561    HA   PHE  77           HA       PHE  77  -6.928  -8.472 -11.973
  562   1HB   PHE  77          2HB       PHE  77  -8.757  -7.460 -10.382
  563   2HB   PHE  77          1HB       PHE  77  -9.724  -7.366 -11.854
  564    HD1  PHE  77           HD1      PHE  77 -10.231  -9.438 -13.158
  565    HD2  PHE  77           HD2      PHE  77  -8.270  -9.571  -9.337
  566    HE1  PHE  77           HE1      PHE  77 -10.748 -11.855 -12.976
  567    HE2  PHE  77           HE2      PHE  77  -8.788 -11.989  -9.157
  568    HZ   PHE  77           HZ       PHE  77 -10.026 -13.131 -10.976
  569    H    LEU  78           H        LEU  78  -8.540  -5.801 -13.683
  570    HA   LEU  78           HA       LEU  78  -9.509  -7.348 -15.898
  571   1HB   LEU  78          2HB       LEU  78  -8.880  -4.418 -15.530
  572   2HB   LEU  78          1HB       LEU  78  -9.438  -5.051 -17.078
  573    HG   LEU  78           HG       LEU  78 -10.926  -5.555 -14.490
  574   1HD1  LEU  78          1HD1      LEU  78 -10.867  -3.169 -16.268
  575   2HD1  LEU  78          2HD1      LEU  78 -11.260  -3.285 -14.553
  576   3HD1  LEU  78          3HD1      LEU  78 -12.460  -3.732 -15.766
  577   1HD2  LEU  78          1HD2      LEU  78 -12.638  -6.377 -15.852
  578   2HD2  LEU  78          2HD2      LEU  78 -11.210  -6.899 -16.746
  579   3HD2  LEU  78          3HD2      LEU  78 -12.095  -5.462 -17.259
  580    H    LYS  79           H        LYS  79  -6.427  -5.639 -15.350
  581    HA   LYS  79           HA       LYS  79  -5.469  -6.404 -18.037
  582   1HB   LYS  79          2HB       LYS  79  -4.922  -4.275 -16.309
  583   2HB   LYS  79          1HB       LYS  79  -3.461  -5.260 -16.264
  584   1HG   LYS  79          2HG       LYS  79  -4.200  -5.225 -18.964
  585   2HG   LYS  79          1HG       LYS  79  -4.474  -3.577 -18.406
  586   1HD   LYS  79          2HD       LYS  79  -2.019  -4.409 -17.258
  587   2HD   LYS  79          1HD       LYS  79  -1.971  -4.893 -18.951
  588   1HE   LYS  79          2HE       LYS  79  -1.872  -2.751 -19.683
  589   2HE   LYS  79          1HE       LYS  79  -3.080  -2.205 -18.521
  590   1HZ   LYS  79          1HZ       LYS  79  -1.254  -2.473 -16.802
  591   2HZ   LYS  79          2HZ       LYS  79  -1.091  -1.174 -17.887
  592   3HZ   LYS  79          3HZ       LYS  79  -0.173  -2.585 -18.103
  593    H    HIS  80           H        HIS  80  -4.305  -6.891 -14.667
  594    HA   HIS  80           HA       HIS  80  -2.567  -9.085 -15.603
  595   1HB   HIS  80          2HB       HIS  80  -2.979  -8.152 -12.749
  596   2HB   HIS  80          1HB       HIS  80  -1.614  -9.058 -13.400
  597    HD1  HIS  80           HD1      HIS  80  -0.426  -7.650 -15.560
  598    HD2  HIS  80           HD2      HIS  80  -2.403  -5.462 -12.612
  599    HE1  HIS  80           HE1      HIS  80   0.415  -5.269 -15.750
  600    H    GLY  81           H        GLY  81  -4.915  -8.858 -12.884
  601   1HA   GLY  81          2HA       GLY  81  -6.852 -10.515 -13.029
  602   2HA   GLY  81          1HA       GLY  81  -5.626 -11.714 -13.439
  603    H    SER  82           H        SER  82  -5.160 -12.997 -11.728
  604    HA   SER  82           HA       SER  82  -5.151 -11.762  -8.997
  605   1HB   SER  82          2HB       SER  82  -6.948 -13.542  -9.582
  606   2HB   SER  82          1HB       SER  82  -5.620 -14.697  -9.517
  607    HG   SER  82           HG       SER  82  -6.997 -13.693  -7.507
  608    H    GLU  83           H        GLU  83  -3.621 -14.236 -11.079
  609    HA   GLU  83           HA       GLU  83  -1.597 -15.077  -9.280
  610   1HB   GLU  83          2HB       GLU  83  -2.014 -15.154 -12.210
  611   2HB   GLU  83          1HB       GLU  83  -0.333 -15.264 -11.689
  612   1HG   GLU  83          2HG       GLU  83  -1.098 -17.512 -11.718
  613   2HG   GLU  83          1HG       GLU  83  -1.142 -17.046 -10.018
  614    H    LEU  84           H        LEU  84  -0.363 -13.623  -8.186
  615    HA   LEU  84           HA       LEU  84   1.258 -11.694  -9.784
  616   1HB   LEU  84          2HB       LEU  84  -0.402 -11.072  -7.329
  617   2HB   LEU  84          1HB       LEU  84   0.917 -10.035  -7.872
  618    HG   LEU  84           HG       LEU  84  -1.182 -10.863  -9.849
  619   1HD1  LEU  84          1HD1      LEU  84  -2.597  -8.992  -9.215
  620   2HD1  LEU  84          2HD1      LEU  84  -1.479  -8.535  -7.931
  621   3HD1  LEU  84          3HD1      LEU  84  -2.386 -10.042  -7.815
  622   1HD2  LEU  84          1HD2      LEU  84   0.406  -9.604 -10.948
  623   2HD2  LEU  84          2HD2      LEU  84   0.862  -8.717  -9.494
  624   3HD2  LEU  84          3HD2      LEU  84  -0.613  -8.289 -10.363
  625    H    ARG  85           H        ARG  85   3.048 -10.746  -8.304
  626    HA   ARG  85           HA       ARG  85   3.958 -12.673  -6.223
  627   1HB   ARG  85          2HB       ARG  85   5.259 -12.090  -8.843
  628   2HB   ARG  85          1HB       ARG  85   6.314 -12.224  -7.437
  629   1HG   ARG  85          2HG       ARG  85   5.381 -14.435  -6.924
  630   2HG   ARG  85          1HG       ARG  85   4.279 -14.301  -8.294
  631   1HD   ARG  85          2HD       ARG  85   6.886 -13.741  -9.272
  632   2HD   ARG  85          1HD       ARG  85   7.010 -15.196  -8.285
  633    HE   ARG  85           HE       ARG  85   4.735 -15.439  -9.997
  634   1HH1  ARG  85          2HH1      ARG  85   7.096 -17.378  -9.556
  635   2HH1  ARG  85          1HH1      ARG  85   7.726 -17.481 -11.165
  636   1HH2  ARG  85          1HH2      ARG  85   6.018 -14.670 -12.296
  637   2HH2  ARG  85          2HH2      ARG  85   7.114 -15.942 -12.721
  638    H    LEU  86           H        LEU  86   5.603 -11.735  -4.796
  639    HA   LEU  86           HA       LEU  86   5.525  -8.744  -4.813
  640   1HB   LEU  86          2HB       LEU  86   4.619 -10.228  -2.829
  641   2HB   LEU  86          1HB       LEU  86   6.326 -10.338  -2.401
  642    HG   LEU  86           HG       LEU  86   5.760  -7.616  -3.068
  643   1HD1  LEU  86          1HD1      LEU  86   3.986  -7.018  -1.622
  644   2HD1  LEU  86          2HD1      LEU  86   3.990  -8.592  -0.826
  645   3HD1  LEU  86          3HD1      LEU  86   3.385  -8.439  -2.475
  646   1HD2  LEU  86          1HD2      LEU  86   7.129  -9.152  -1.126
  647   2HD2  LEU  86          2HD2      LEU  86   6.020  -8.112  -0.233
  648   3HD2  LEU  86          3HD2      LEU  86   7.192  -7.402  -1.343
  649    H    ILE  87           H        ILE  87   7.394  -7.731  -5.294
  650    HA   ILE  87           HA       ILE  87   9.976  -9.151  -4.766
  651    HB   ILE  87           HB       ILE  87  10.867  -8.047  -6.826
  652   1HG1  ILE  87          2HG1      ILE  87   8.195  -7.558  -7.952
  653   2HG1  ILE  87          1HG1      ILE  87   8.591  -6.473  -6.623
  654   1HG2  ILE  87          1HG2      ILE  87  10.381 -10.061  -7.703
  655   2HG2  ILE  87          2HG2      ILE  87   8.822  -9.415  -8.213
  656   3HG2  ILE  87          3HG2      ILE  87   8.974 -10.223  -6.654
  657   1HD1  ILE  87          1HD1      ILE  87  10.610  -5.743  -7.714
  658   2HD1  ILE  87          2HD1      ILE  87   9.308  -5.642  -8.901
  659   3HD1  ILE  87          3HD1      ILE  87  10.450  -6.985  -8.957
  660    HA   PRO  88           HA       PRO  88  11.205  -5.442  -2.723
  661   1HB   PRO  88          2HB       PRO  88  13.933  -5.708  -2.960
  662   2HB   PRO  88          1HB       PRO  88  12.949  -6.663  -1.837
  663   1HG   PRO  88          2HG       PRO  88  14.210  -7.501  -4.404
  664   2HG   PRO  88          1HG       PRO  88  13.773  -8.482  -2.995
  665   1HD   PRO  88          2HD       PRO  88  12.312  -8.301  -5.418
  666   2HD   PRO  88          1HD       PRO  88  11.740  -9.024  -3.900
  667    H    ARG  89           H        ARG  89  11.100  -3.391  -3.551
  668    HA   ARG  89           HA       ARG  89  12.174  -2.841  -6.261
  669   1HB   ARG  89          2HB       ARG  89   9.823  -2.121  -5.284
  670   2HB   ARG  89          1HB       ARG  89  10.749  -0.790  -4.592
  671   1HG   ARG  89          2HG       ARG  89  11.603  -1.069  -7.287
  672   2HG   ARG  89          1HG       ARG  89   9.841  -1.118  -7.301
  673   1HD   ARG  89          2HD       ARG  89  11.035   0.940  -5.537
  674   2HD   ARG  89          1HD       ARG  89  11.278   1.192  -7.264
  675    HE   ARG  89           HE       ARG  89   8.942   1.556  -7.501
  676   1HH1  ARG  89          2HH1      ARG  89   9.296   2.638  -4.645
  677   2HH1  ARG  89          1HH1      ARG  89   7.954   1.889  -3.847
  678   1HH2  ARG  89          1HH2      ARG  89   7.404  -0.431  -6.376
  679   2HH2  ARG  89          2HH2      ARG  89   6.879   0.147  -4.829
  680    H    ASP  90           H        ASP  90  12.278  -1.268  -3.028
  681    HA   ASP  90           HA       ASP  90  15.099  -0.491  -3.615
  682   1HB   ASP  90          2HB       ASP  90  12.801   1.290  -2.872
  683   2HB   ASP  90          1HB       ASP  90  14.412   1.684  -2.270
  684    H    ARG  91           H        ARG  91  16.269   0.148  -1.583
  685    HA   ARG  91           HA       ARG  91  15.328  -1.539   0.694
  686   1HB   ARG  91          2HB       ARG  91  17.902  -1.104  -0.579
  687   2HB   ARG  91          1HB       ARG  91  17.992  -0.750   1.146
  688   1HG   ARG  91          2HG       ARG  91  16.440  -3.164   0.594
  689   2HG   ARG  91          1HG       ARG  91  18.093  -3.282  -0.004
  690   1HD   ARG  91          2HD       ARG  91  18.896  -3.516   2.086
  691   2HD   ARG  91          1HD       ARG  91  18.066  -2.054   2.615
  692    HE   ARG  91           HE       ARG  91  16.924  -4.802   2.717
  693   1HH1  ARG  91          1HH2      ARG  91  17.533  -3.074   5.146
  694   2HH1  ARG  91          2HH2      ARG  91  15.954  -2.488   5.550
  695   1HH2  ARG  91          2HH1      ARG  91  14.565  -3.345   2.481
  696   2HH2  ARG  91          1HH1      ARG  91  14.266  -2.644   4.036
  697    H    VAL  92           H        VAL  92  14.709  -0.518   2.550
  698    HA   VAL  92           HA       VAL  92  14.987   2.420   2.710
  699    HB   VAL  92           HB       VAL  92  13.527   2.233   4.708
  700   1HG1  VAL  92          1HG1      VAL  92  12.786   1.061   2.062
  701   2HG1  VAL  92          2HG1      VAL  92  12.191   2.521   2.853
  702   3HG1  VAL  92          3HG1      VAL  92  11.615   0.939   3.375
  703   1HG2  VAL  92          1HG2      VAL  92  14.031  -0.693   4.245
  704   2HG2  VAL  92          2HG2      VAL  92  12.479  -0.189   4.910
  705   3HG2  VAL  92          3HG2      VAL  92  13.972   0.203   5.761
  706    H    GLY  93           H        GLY  93  16.123  -0.465   4.445
  707   1HA   GLY  93          2HA       GLY  93  17.609   1.178   6.398
  708   2HA   GLY  93          1HA       GLY  93  17.527  -0.585   6.372
  709    H    HIS  94           HN       HIS  94  19.013   2.216   4.786
  710    HA   HIS  94           HA       HIS  94  20.812   0.638   3.139
  711   1HB   HIS  94          2HB       HIS  94  20.700   3.561   3.909
  712   2HB   HIS  94          1HB       HIS  94  22.013   2.910   2.931
  713    HD1  HIS  94           HD1      HIS  94  18.589   4.159   2.687
  714    HD2  HIS  94           HD2      HIS  94  21.011   1.612   0.445
  715    HE1  HIS  94           HE1      HIS  94  17.504   3.959   0.405
  Start of MODEL    4
    1   1H    MET   1          1H        MET   1  -7.379  -3.108   6.791
    2   2H    MET   1          2H        MET   1  -7.934  -2.021   7.969
    3   3H    MET   1          3H        MET   1  -7.788  -3.672   8.339
    4    HA   MET   1           HA       MET   1  -5.508  -1.906   7.628
    5   1HB   MET   1          2HB       MET   1  -6.759  -1.435   9.834
    6   2HB   MET   1          1HB       MET   1  -6.145  -3.007  10.364
    7   1HG   MET   1          2HG       MET   1  -4.150  -2.076  10.842
    8   2HG   MET   1          1HG       MET   1  -3.979  -1.568   9.163
    9   1HE   MET   1          1HE       MET   1  -3.122   1.845  10.461
   10   2HE   MET   1          2HE       MET   1  -2.943   0.662   9.165
   11   3HE   MET   1          3HE       MET   1  -2.477   0.236  10.810
   12    H    SER   2           H        SER   2  -3.687  -3.053   7.183
   13    HA   SER   2           HA       SER   2  -2.327  -4.909   6.724
   14   1HB   SER   2          2HB       SER   2  -3.199  -5.097   9.560
   15   2HB   SER   2          1HB       SER   2  -2.469  -6.549   8.884
   16    HG   SER   2           HG       SER   2  -1.083  -4.772   9.856
   17    H    GLY   3           H        GLY   3  -4.606  -5.204   5.333
   18   1HA   GLY   3          2HA       GLY   3  -5.414  -7.092   4.069
   19   2HA   GLY   3          1HA       GLY   3  -5.116  -8.128   5.466
   20    H    GLY   4           H        GLY   4  -6.776  -5.018   5.723
   21   1HA   GLY   4          2HA       GLY   4  -9.213  -6.462   6.640
   22   2HA   GLY   4          1HA       GLY   4  -8.830  -4.777   7.001
   23    H    THR   5           H        THR   5  -8.718  -3.311   5.051
   24    HA   THR   5           HA       THR   5  -9.670  -2.366   3.148
   25    HB   THR   5           HB       THR   5 -10.317  -5.248   2.442
   26    HG1  THR   5           HG1      THR   5  -8.222  -5.206   2.217
   27   1HG2  THR   5          1HG2      THR   5 -10.801  -4.492   0.247
   28   2HG2  THR   5          2HG2      THR   5 -10.160  -2.883   0.575
   29   3HG2  THR   5          3HG2      THR   5 -11.681  -3.395   1.308
   30    H    ALA   6           H        ALA   6 -11.566  -1.285   3.003
   31    HA   ALA   6           HA       ALA   6 -13.893  -2.313   4.526
   32   1HB   ALA   6          1HB       ALA   6 -14.772  -0.015   4.267
   33   2HB   ALA   6          2HB       ALA   6 -13.397   0.394   3.243
   34   3HB   ALA   6          3HB       ALA   6 -13.143   0.003   4.944
   35    H    ALA   7           H        ALA   7 -15.782  -2.953   3.545
   36    HA   ALA   7           HA       ALA   7 -15.887  -3.669   0.808
   37   1HB   ALA   7          1HB       ALA   7 -18.352  -3.859   1.161
   38   2HB   ALA   7          2HB       ALA   7 -18.164  -3.037   2.711
   39   3HB   ALA   7          3HB       ALA   7 -17.425  -4.617   2.459
   40    H    THR   8           H        THR   8 -17.043  -0.717   2.444
   41    HA   THR   8           HA       THR   8 -17.748   1.347   1.603
   42    HB   THR   8           HB       THR   8 -15.893   0.632  -0.695
   43    HG1  THR   8           HG1      THR   8 -14.782   0.397   1.213
   44   1HG2  THR   8          1HG2      THR   8 -16.797   2.629  -1.385
   45   2HG2  THR   8          2HG2      THR   8 -15.577   3.277  -0.290
   46   3HG2  THR   8          3HG2      THR   8 -17.248   3.112   0.250
   47    H    THR   9           H        THR   9 -19.761  -0.239   1.236
   48    HA   THR   9           HA       THR   9 -21.551  -0.946  -0.108
   49    HB   THR   9           HB       THR   9 -22.449   0.872  -1.547
   50    HG1  THR   9           HG1      THR   9 -20.806   1.908  -2.430
   51   1HG2  THR   9          1HG2      THR   9 -21.348   2.053   1.004
   52   2HG2  THR   9          2HG2      THR   9 -22.623   0.836   1.006
   53   3HG2  THR   9          3HG2      THR   9 -22.892   2.392   0.222
   54    H    ALA  10           H        ALA  10 -19.493  -2.386  -0.989
   55    HA   ALA  10           HA       ALA  10 -19.742  -2.252  -3.965
   56   1HB   ALA  10          1HB       ALA  10 -17.444  -1.553  -2.919
   57   2HB   ALA  10          2HB       ALA  10 -17.457  -2.665  -4.287
   58   3HB   ALA  10          3HB       ALA  10 -17.237  -3.284  -2.652
   59    H    GLY  11           H        GLY  11 -20.997  -3.985  -4.459
   60   1HA   GLY  11          2HA       GLY  11 -21.120  -6.381  -2.822
   61   2HA   GLY  11          1HA       GLY  11 -21.904  -6.158  -4.386
   62    H    SER  12           H        SER  12 -19.885  -5.748  -6.130
   63    HA   SER  12           HA       SER  12 -18.585  -8.376  -6.232
   64   1HB   SER  12          2HB       SER  12 -17.763  -7.577  -8.456
   65   2HB   SER  12          1HB       SER  12 -19.512  -7.473  -8.291
   66    HG   SER  12           HG       SER  12 -18.861  -5.527  -9.082
   67    H    LYS  13           H        LYS  13 -16.451  -8.797  -5.840
   68    HA   LYS  13           HA       LYS  13 -14.618  -6.488  -5.331
   69   1HB   LYS  13          2HB       LYS  13 -14.977  -8.978  -3.639
   70   2HB   LYS  13          1HB       LYS  13 -13.633  -7.850  -3.455
   71   1HG   LYS  13          2HG       LYS  13 -15.358  -6.011  -3.157
   72   2HG   LYS  13          1HG       LYS  13 -16.580  -7.279  -3.066
   73   1HD   LYS  13          2HD       LYS  13 -15.905  -7.975  -0.996
   74   2HD   LYS  13          1HD       LYS  13 -14.203  -7.651  -1.329
   75   1HE   LYS  13          2HE       LYS  13 -15.010  -5.129  -1.310
   76   2HE   LYS  13          1HE       LYS  13 -16.332  -5.785  -0.344
   77   1HZ   LYS  13          1HZ       LYS  13 -14.348  -6.947   0.888
   78   2HZ   LYS  13          2HZ       LYS  13 -14.818  -5.364   1.280
   79   3HZ   LYS  13          3HZ       LYS  13 -13.475  -5.630   0.275
   80    H    VAL  14           H        VAL  14 -12.407  -6.902  -5.805
   81    HA   VAL  14           HA       VAL  14 -11.973  -9.239  -7.612
   82    HB   VAL  14           HB       VAL  14  -9.917  -7.891  -8.328
   83   1HG1  VAL  14          1HG1      VAL  14 -11.777  -7.934  -9.808
   84   2HG1  VAL  14          2HG1      VAL  14 -11.378  -6.226  -9.622
   85   3HG1  VAL  14          3HG1      VAL  14 -12.744  -6.912  -8.746
   86   1HG2  VAL  14          1HG2      VAL  14  -9.567  -5.748  -7.564
   87   2HG2  VAL  14          2HG2      VAL  14 -10.358  -6.395  -6.128
   88   3HG2  VAL  14          3HG2      VAL  14 -11.283  -5.451  -7.293
   89    H    THR  15           H        THR  15 -10.575 -10.824  -7.012
   90    HA   THR  15           HA       THR  15  -9.113 -10.493  -4.440
   91    HB   THR  15           HB       THR  15  -8.825 -13.010  -4.643
   92    HG1  THR  15           HG1      THR  15  -9.444 -13.911  -6.417
   93   1HG2  THR  15          1HG2      THR  15 -10.774 -11.661  -3.500
   94   2HG2  THR  15          2HG2      THR  15 -10.901 -13.410  -3.678
   95   3HG2  THR  15          3HG2      THR  15 -11.744 -12.346  -4.804
   96    H    PHE  16           H        PHE  16  -6.869 -10.770  -4.304
   97    HA   PHE  16           HA       PHE  16  -5.420 -11.159  -6.894
   98   1HB   PHE  16          2HB       PHE  16  -4.700  -9.204  -4.693
   99   2HB   PHE  16          1HB       PHE  16  -3.757  -9.495  -6.152
  100    HD1  PHE  16           HD1      PHE  16  -5.011  -9.206  -8.426
  101    HD2  PHE  16           HD2      PHE  16  -6.368  -7.542  -4.705
  102    HE1  PHE  16           HE1      PHE  16  -6.400  -7.571  -9.663
  103    HE2  PHE  16           HE2      PHE  16  -7.757  -5.905  -5.947
  104    HZ   PHE  16           HZ       PHE  16  -7.773  -5.923  -8.424
  105    H    LYS  17           H        LYS  17  -3.716 -12.548  -6.804
  106    HA   LYS  17           HA       LYS  17  -3.054 -13.739  -4.141
  107   1HB   LYS  17          2HB       LYS  17  -3.982 -15.132  -6.189
  108   2HB   LYS  17          1HB       LYS  17  -2.311 -15.037  -6.747
  109   1HG   LYS  17          2HG       LYS  17  -1.737 -15.788  -4.297
  110   2HG   LYS  17          1HG       LYS  17  -3.408 -16.355  -4.278
  111   1HD   LYS  17          2HD       LYS  17  -2.463 -18.248  -5.155
  112   2HD   LYS  17          1HD       LYS  17  -2.627 -17.354  -6.666
  113   1HE   LYS  17          2HE       LYS  17  -0.172 -16.830  -5.064
  114   2HE   LYS  17          1HE       LYS  17  -0.280 -18.403  -5.854
  115   1HZ   LYS  17          1HZ       LYS  17   0.700 -17.035  -7.436
  116   2HZ   LYS  17          2HZ       LYS  17  -0.312 -15.716  -7.080
  117   3HZ   LYS  17          3HZ       LYS  17  -0.928 -17.064  -7.910
  118    H    ILE  18           H        ILE  18  -1.166 -12.947  -3.352
  119    HA   ILE  18           HA       ILE  18   1.038 -12.363  -5.294
  120    HB   ILE  18           HB       ILE  18   0.510 -10.916  -2.680
  121   1HG1  ILE  18          2HG1      ILE  18   0.213  -9.114  -4.785
  122   2HG1  ILE  18          1HG1      ILE  18  -0.618 -10.559  -5.360
  123   1HG2  ILE  18          1HG2      ILE  18   2.473  -9.852  -3.029
  124   2HG2  ILE  18          2HG2      ILE  18   2.137  -9.624  -4.744
  125   3HG2  ILE  18          3HG2      ILE  18   2.837 -11.140  -4.177
  126   1HD1  ILE  18          1HD1      ILE  18  -1.852  -8.748  -3.825
  127   2HD1  ILE  18          2HD1      ILE  18  -1.123  -9.712  -2.542
  128   3HD1  ILE  18          3HD1      ILE  18  -2.216 -10.469  -3.700
  129    H    THR  19           H        THR  19   2.882 -13.488  -4.915
  130    HA   THR  19           HA       THR  19   3.270 -14.701  -2.205
  131    HB   THR  19           HB       THR  19   2.696 -16.378  -3.982
  132    HG1  THR  19           HG1      THR  19   3.866 -17.455  -2.620
  133   1HG2  THR  19          1HG2      THR  19   3.869 -15.072  -5.818
  134   2HG2  THR  19          2HG2      THR  19   4.196 -16.803  -5.801
  135   3HG2  THR  19          3HG2      THR  19   5.390 -15.675  -5.163
  136    H    LEU  20           H        LEU  20   5.370 -14.567  -1.342
  137    HA   LEU  20           HA       LEU  20   7.031 -12.413  -2.287
  138   1HB   LEU  20          2HB       LEU  20   6.784 -13.562   0.111
  139   2HB   LEU  20          1HB       LEU  20   8.164 -14.497  -0.467
  140    HG   LEU  20           HG       LEU  20   9.223 -12.247  -1.104
  141   1HD1  LEU  20          1HD1      LEU  20   7.720 -10.858   0.981
  142   2HD1  LEU  20          2HD1      LEU  20   6.703 -11.297  -0.390
  143   3HD1  LEU  20          3HD1      LEU  20   8.146 -10.316  -0.642
  144   1HD2  LEU  20          1HD2      LEU  20   9.845 -11.791   1.325
  145   2HD2  LEU  20          2HD2      LEU  20  10.087 -13.451   0.783
  146   3HD2  LEU  20          3HD2      LEU  20   8.683 -13.042   1.768
  147    H    THR  21           H        THR  21   8.825 -12.437  -3.581
  148    HA   THR  21           HA       THR  21   9.590 -15.060  -4.787
  149    HB   THR  21           HB       THR  21  10.528 -13.645  -6.647
  150    HG1  THR  21           HG1      THR  21  10.673 -11.602  -6.280
  151   1HG2  THR  21          1HG2      THR  21   8.137 -14.613  -6.520
  152   2HG2  THR  21          2HG2      THR  21   8.434 -13.330  -7.693
  153   3HG2  THR  21          3HG2      THR  21   7.631 -12.962  -6.168
  154    H    SER  22           H        SER  22  10.704 -12.876  -2.488
  155    HA   SER  22           HA       SER  22  13.535 -12.884  -3.168
  156   1HB   SER  22          2HB       SER  22  11.838 -11.727  -1.112
  157   2HB   SER  22          1HB       SER  22  13.283 -12.439  -0.401
  158    HG   SER  22           HG       SER  22  13.682 -10.308  -1.052
  159    H    ASP  23           H        ASP  23  11.685 -14.470  -0.526
  160    HA   ASP  23           HA       ASP  23  13.887 -16.441  -0.238
  161   1HB   ASP  23          2HB       ASP  23  11.909 -15.268   1.543
  162   2HB   ASP  23          1HB       ASP  23  11.875 -17.029   1.634
  163    HA   PRO  24           HA       PRO  24  11.495 -19.412  -2.482
  164   1HB   PRO  24          2HB       PRO  24  13.151 -21.551  -1.981
  165   2HB   PRO  24          1HB       PRO  24  13.508 -20.289  -3.173
  166   1HG   PRO  24          2HG       PRO  24  14.723 -20.730  -0.489
  167   2HG   PRO  24          1HG       PRO  24  15.405 -19.920  -1.909
  168   1HD   PRO  24          2HD       PRO  24  14.302 -18.647   0.375
  169   2HD   PRO  24          1HD       PRO  24  14.727 -17.867  -1.163
  170    H    LYS  25           H        LYS  25  10.171 -21.304  -2.040
  171    HA   LYS  25           HA       LYS  25   8.820 -22.702  -0.746
  172   1HB   LYS  25          2HB       LYS  25  11.253 -23.238   0.185
  173   2HB   LYS  25          1HB       LYS  25  10.632 -22.431   1.626
  174   1HG   LYS  25          2HG       LYS  25   8.533 -24.071   0.969
  175   2HG   LYS  25          1HG       LYS  25   9.914 -25.056   0.482
  176   1HD   LYS  25          2HD       LYS  25  10.386 -23.764   3.052
  177   2HD   LYS  25          1HD       LYS  25   8.924 -24.751   3.082
  178   1HE   LYS  25          2HE       LYS  25  10.070 -26.711   2.660
  179   2HE   LYS  25          1HE       LYS  25  11.373 -25.892   1.800
  180   1HZ   LYS  25          1HZ       LYS  25  10.939 -25.500   4.702
  181   2HZ   LYS  25          2HZ       LYS  25  12.332 -25.171   3.788
  182   3HZ   LYS  25          3HZ       LYS  25  11.881 -26.778   4.108
  183    H    LEU  26           H        LEU  26   7.797 -20.294  -0.884
  184    HA   LEU  26           HA       LEU  26   6.942 -19.666   1.908
  185   1HB   LEU  26          2HB       LEU  26   8.348 -17.938   0.086
  186   2HB   LEU  26          1HB       LEU  26   6.729 -17.293   0.353
  187    HG   LEU  26           HG       LEU  26   7.561 -18.116   2.891
  188   1HD1  LEU  26          1HD1      LEU  26   9.759 -17.281   3.231
  189   2HD1  LEU  26          2HD1      LEU  26   9.791 -16.498   1.651
  190   3HD1  LEU  26          3HD1      LEU  26   9.871 -18.257   1.766
  191   1HD2  LEU  26          1HD2      LEU  26   7.607 -15.391   1.556
  192   2HD2  LEU  26          2HD2      LEU  26   7.714 -15.645   3.298
  193   3HD2  LEU  26          3HD2      LEU  26   6.255 -16.113   2.426
  194    HA   PRO  27           HA       PRO  27   2.906 -20.152   0.180
  195   1HB   PRO  27          2HB       PRO  27   1.503 -18.996   2.246
  196   2HB   PRO  27          1HB       PRO  27   2.196 -20.626   2.317
  197   1HG   PRO  27          2HG       PRO  27   3.158 -18.116   3.615
  198   2HG   PRO  27          1HG       PRO  27   3.372 -19.798   4.128
  199   1HD   PRO  27          2HD       PRO  27   5.325 -18.212   2.849
  200   2HD   PRO  27          1HD       PRO  27   5.377 -19.980   3.031
  201    H    PHE  28           H        PHE  28   1.063 -18.841  -0.589
  202    HA   PHE  28           HA       PHE  28   1.867 -16.040  -1.207
  203   1HB   PHE  28          2HB       PHE  28   0.105 -16.153  -2.959
  204   2HB   PHE  28          1HB       PHE  28   1.312 -17.422  -3.147
  205    HD1  PHE  28           HD1      PHE  28  -2.143 -16.688  -1.998
  206    HD2  PHE  28           HD2      PHE  28   0.740 -19.748  -2.890
  207    HE1  PHE  28           HE1      PHE  28  -3.928 -18.405  -1.888
  208    HE2  PHE  28           HE2      PHE  28  -1.047 -21.463  -2.777
  209    HZ   PHE  28           HZ       PHE  28  -3.381 -20.792  -2.276
  210    H    LYS  29           H        LYS  29   0.153 -14.353  -1.154
  211    HA   LYS  29           HA       LYS  29  -1.819 -14.846   1.049
  212   1HB   LYS  29          2HB       LYS  29   0.143 -12.706   0.598
  213   2HB   LYS  29          1HB       LYS  29  -1.481 -12.099   0.919
  214   1HG   LYS  29          2HG       LYS  29  -0.717 -12.333   3.089
  215   2HG   LYS  29          1HG       LYS  29  -1.414 -13.934   2.846
  216   1HD   LYS  29          2HD       LYS  29   0.622 -14.958   2.833
  217   2HD   LYS  29          1HD       LYS  29   1.383 -13.646   1.936
  218   1HE   LYS  29          2HE       LYS  29   2.101 -12.621   3.824
  219   2HE   LYS  29          1HE       LYS  29   0.560 -12.868   4.644
  220   1HZ   LYS  29          1HZ       LYS  29   2.562 -15.018   4.229
  221   2HZ   LYS  29          2HZ       LYS  29   1.170 -15.076   5.203
  222   3HZ   LYS  29          3HZ       LYS  29   2.475 -14.080   5.638
  223    H    VAL  30           H        VAL  30  -3.947 -14.362   0.613
  224    HA   VAL  30           HA       VAL  30  -4.565 -13.309  -2.109
  225    HB   VAL  30           HB       VAL  30  -6.370 -14.765  -0.147
  226   1HG1  VAL  30          1HG1      VAL  30  -6.717 -13.846  -3.012
  227   2HG1  VAL  30          2HG1      VAL  30  -7.712 -13.429  -1.618
  228   3HG1  VAL  30          3HG1      VAL  30  -7.752 -15.066  -2.270
  229   1HG2  VAL  30          1HG2      VAL  30  -6.067 -16.706  -1.612
  230   2HG2  VAL  30          2HG2      VAL  30  -4.496 -16.160  -1.028
  231   3HG2  VAL  30          3HG2      VAL  30  -5.010 -15.771  -2.670
  232    H    LEU  31           H        LEU  31  -5.252 -11.228  -2.243
  233    HA   LEU  31           HA       LEU  31  -6.367  -9.947   0.222
  234   1HB   LEU  31          2HB       LEU  31  -4.354  -9.106  -1.686
  235   2HB   LEU  31          1HB       LEU  31  -5.677  -7.941  -1.636
  236    HG   LEU  31           HG       LEU  31  -4.858  -8.909   1.019
  237   1HD1  LEU  31          1HD1      LEU  31  -2.654  -8.901  -0.070
  238   2HD1  LEU  31          2HD1      LEU  31  -2.781  -7.557   1.062
  239   3HD1  LEU  31          3HD1      LEU  31  -2.944  -7.269  -0.669
  240   1HD2  LEU  31          1HD2      LEU  31  -4.964  -6.089  -0.078
  241   2HD2  LEU  31          2HD2      LEU  31  -5.179  -6.611   1.592
  242   3HD2  LEU  31          3HD2      LEU  31  -6.417  -6.973   0.391
  243    H    SER  32           H        SER  32  -8.520  -9.585   0.130
  244    HA   SER  32           HA       SER  32  -9.851  -9.423  -2.535
  245   1HB   SER  32          2HB       SER  32 -10.524 -10.917  -0.346
  246   2HB   SER  32          1HB       SER  32 -11.514  -9.486  -0.085
  247    HG   SER  32           HG       SER  32 -12.506 -11.134  -1.406
  248    H    VAL  33           H        VAL  33 -10.275  -7.399  -3.254
  249    HA   VAL  33           HA       VAL  33 -11.106  -5.325  -1.276
  250    HB   VAL  33           HB       VAL  33  -9.771  -3.637  -2.575
  251   1HG1  VAL  33          1HG1      VAL  33  -7.857  -5.740  -1.625
  252   2HG1  VAL  33          2HG1      VAL  33  -8.995  -5.040  -0.477
  253   3HG1  VAL  33          3HG1      VAL  33  -7.848  -4.003  -1.323
  254   1HG2  VAL  33          1HG2      VAL  33  -8.395  -6.059  -3.771
  255   2HG2  VAL  33          2HG2      VAL  33  -8.094  -4.362  -4.142
  256   3HG2  VAL  33          3HG2      VAL  33  -9.608  -5.116  -4.637
  257    HA   PRO  34           HA       PRO  34 -14.281  -4.514  -4.208
  258   1HB   PRO  34          2HB       PRO  34 -14.848  -1.908  -3.536
  259   2HB   PRO  34          1HB       PRO  34 -15.334  -3.303  -2.557
  260   1HG   PRO  34          2HG       PRO  34 -13.149  -1.333  -2.062
  261   2HG   PRO  34          1HG       PRO  34 -14.086  -2.286  -0.900
  262   1HD   PRO  34          2HD       PRO  34 -11.457  -2.860  -1.755
  263   2HD   PRO  34          1HD       PRO  34 -12.539  -3.979  -0.898
  264    H    GLU  35           H        GLU  35 -14.672  -3.424  -6.214
  265    HA   GLU  35           HA       GLU  35 -12.349  -2.515  -7.649
  266   1HB   GLU  35          2HB       GLU  35 -15.300  -2.617  -8.252
  267   2HB   GLU  35          1HB       GLU  35 -14.206  -1.770  -9.346
  268   1HG   GLU  35          2HG       GLU  35 -13.962  -3.835 -10.290
  269   2HG   GLU  35          1HG       GLU  35 -12.820  -4.082  -8.969
  270    H    SER  36           H        SER  36 -11.613  -0.809  -6.261
  271    HA   SER  36           HA       SER  36 -12.260   1.830  -7.096
  272   1HB   SER  36          2HB       SER  36 -14.071   0.808  -5.138
  273   2HB   SER  36          1HB       SER  36 -13.053   2.002  -4.341
  274    HG   SER  36           HG       SER  36 -14.935   2.880  -5.397
  275    H    THR  37           H        THR  37 -11.100  -0.211  -4.417
  276    HA   THR  37           HA       THR  37  -9.307   1.700  -3.258
  277    HB   THR  37           HB       THR  37  -8.101  -0.385  -2.403
  278    HG1  THR  37           HG1      THR  37  -8.507  -2.034  -3.649
  279   1HG2  THR  37          1HG2      THR  37 -10.670  -1.120  -1.510
  280   2HG2  THR  37          2HG2      THR  37 -10.759   0.608  -1.846
  281   3HG2  THR  37          3HG2      THR  37  -9.547  -0.011  -0.725
  282    HA   PRO  38           HA       PRO  38  -6.204   1.797  -6.400
  283   1HB   PRO  38          2HB       PRO  38  -4.295   3.114  -4.929
  284   2HB   PRO  38          1HB       PRO  38  -5.707   3.911  -5.641
  285   1HG   PRO  38          2HG       PRO  38  -5.191   3.202  -2.790
  286   2HG   PRO  38          1HG       PRO  38  -6.201   4.494  -3.461
  287   1HD   PRO  38          2HD       PRO  38  -7.135   2.032  -2.430
  288   2HD   PRO  38          1HD       PRO  38  -8.078   3.180  -3.405
  289    H    PHE  39           H        PHE  39  -4.075   0.905  -6.850
  290    HA   PHE  39           HA       PHE  39  -3.513  -1.580  -5.523
  291   1HB   PHE  39          2HB       PHE  39  -2.911  -0.669  -7.959
  292   2HB   PHE  39          1HB       PHE  39  -1.402  -0.236  -7.161
  293    HD1  PHE  39           HD1      PHE  39   0.164  -1.823  -7.938
  294    HD2  PHE  39           HD2      PHE  39  -3.669  -3.152  -6.522
  295    HE1  PHE  39           HE1      PHE  39   0.919  -4.177  -8.101
  296    HE2  PHE  39           HE2      PHE  39  -2.910  -5.506  -6.684
  297    HZ   PHE  39           HZ       PHE  39  -0.617  -6.019  -7.474
  298    H    THR  40           H        THR  40  -2.585   1.679  -4.812
  299    HA   THR  40           HA       THR  40  -0.078   1.226  -3.501
  300    HB   THR  40           HB       THR  40  -1.048   3.269  -2.045
  301    HG1  THR  40           HG1      THR  40  -2.796   4.110  -2.838
  302   1HG2  THR  40          1HG2      THR  40   0.148   4.649  -3.450
  303   2HG2  THR  40          2HG2      THR  40  -0.511   3.913  -4.910
  304   3HG2  THR  40          3HG2      THR  40   0.744   3.081  -3.992
  305    H    ALA  41           H        ALA  41  -3.441   1.182  -2.308
  306    HA   ALA  41           HA       ALA  41  -2.709   0.441   0.402
  307   1HB   ALA  41          1HB       ALA  41  -4.838   1.574  -0.071
  308   2HB   ALA  41          2HB       ALA  41  -5.138   0.004   0.671
  309   3HB   ALA  41          3HB       ALA  41  -5.356   0.214  -1.066
  310    H    VAL  42           H        VAL  42  -3.880  -1.358  -2.462
  311    HA   VAL  42           HA       VAL  42  -4.094  -3.923  -1.230
  312    HB   VAL  42           HB       VAL  42  -3.309  -3.264  -4.091
  313   1HG1  VAL  42          1HG1      VAL  42  -2.953  -5.509  -4.157
  314   2HG1  VAL  42          2HG1      VAL  42  -4.711  -5.623  -4.135
  315   3HG1  VAL  42          3HG1      VAL  42  -3.799  -5.784  -2.634
  316   1HG2  VAL  42          1HG2      VAL  42  -5.913  -3.390  -2.614
  317   2HG2  VAL  42          2HG2      VAL  42  -5.874  -3.954  -4.285
  318   3HG2  VAL  42          3HG2      VAL  42  -5.409  -2.296  -3.903
  319    H    LEU  43           H        LEU  43  -1.344  -2.425  -2.958
  320    HA   LEU  43           HA       LEU  43   0.501  -4.585  -2.527
  321   1HB   LEU  43          2HB       LEU  43   0.723  -2.654  -4.189
  322   2HB   LEU  43          1HB       LEU  43   1.234  -1.661  -2.825
  323    HG   LEU  43           HG       LEU  43   2.617  -4.259  -3.007
  324   1HD1  LEU  43          1HD1      LEU  43   2.698  -4.020  -5.330
  325   2HD1  LEU  43          2HD1      LEU  43   4.146  -3.147  -4.832
  326   3HD1  LEU  43          3HD1      LEU  43   2.682  -2.258  -5.249
  327   1HD2  LEU  43          1HD2      LEU  43   4.519  -2.318  -2.955
  328   2HD2  LEU  43          2HD2      LEU  43   3.694  -2.899  -1.509
  329   3HD2  LEU  43          3HD2      LEU  43   3.146  -1.422  -2.302
  330    H    LYS  44           H        LYS  44  -0.352  -1.715  -0.625
  331    HA   LYS  44           HA       LYS  44   1.758  -1.847   1.296
  332   1HB   LYS  44          2HB       LYS  44  -0.330  -0.144   0.865
  333   2HB   LYS  44          1HB       LYS  44  -0.909  -1.010   2.285
  334   1HG   LYS  44          2HG       LYS  44   1.864  -0.387   2.668
  335   2HG   LYS  44          1HG       LYS  44   1.020   1.081   2.177
  336   1HD   LYS  44          2HD       LYS  44  -0.325  -0.628   4.216
  337   2HD   LYS  44          1HD       LYS  44   1.102   0.266   4.737
  338   1HE   LYS  44          2HE       LYS  44  -0.031   2.211   4.759
  339   2HE   LYS  44          1HE       LYS  44  -0.626   1.946   3.122
  340   1HZ   LYS  44          1HZ       LYS  44  -2.564   1.151   3.868
  341   2HZ   LYS  44          2HZ       LYS  44  -2.164   1.941   5.315
  342   3HZ   LYS  44          3HZ       LYS  44  -1.857   0.281   5.140
  343    H    PHE  45           H        PHE  45  -1.497  -3.315   1.284
  344    HA   PHE  45           HA       PHE  45  -1.224  -4.598   3.850
  345   1HB   PHE  45          2HB       PHE  45  -3.021  -5.230   1.488
  346   2HB   PHE  45          1HB       PHE  45  -3.171  -5.978   3.076
  347    HD1  PHE  45           HD1      PHE  45  -4.959  -3.895   1.291
  348    HD2  PHE  45           HD2      PHE  45  -2.583  -3.670   4.866
  349    HE1  PHE  45           HE1      PHE  45  -6.311  -1.969   2.071
  350    HE2  PHE  45           HE2      PHE  45  -3.937  -1.743   5.641
  351    HZ   PHE  45           HZ       PHE  45  -5.799  -0.894   4.246
  352    H    ALA  46           H        ALA  46  -0.698  -5.749   0.502
  353    HA   ALA  46           HA       ALA  46  -0.056  -8.454   1.204
  354   1HB   ALA  46          1HB       ALA  46   0.768  -6.774  -1.182
  355   2HB   ALA  46          2HB       ALA  46  -0.593  -7.890  -1.094
  356   3HB   ALA  46          3HB       ALA  46   1.057  -8.508  -1.048
  357    H    ALA  47           H        ALA  47   2.037  -5.596   0.675
  358    HA   ALA  47           HA       ALA  47   4.527  -6.933   1.114
  359   1HB   ALA  47          1HB       ALA  47   5.269  -4.889   0.532
  360   2HB   ALA  47          2HB       ALA  47   4.721  -4.254   2.082
  361   3HB   ALA  47          3HB       ALA  47   3.638  -4.240   0.693
  362    H    GLU  48           H        GLU  48   2.407  -5.139   3.375
  363    HA   GLU  48           HA       GLU  48   4.053  -5.592   5.695
  364   1HB   GLU  48          2HB       GLU  48   1.370  -4.511   5.131
  365   2HB   GLU  48          1HB       GLU  48   1.508  -5.299   6.702
  366   1HG   GLU  48          2HG       GLU  48   2.155  -3.067   7.134
  367   2HG   GLU  48          1HG       GLU  48   3.686  -3.929   6.983
  368    H    GLU  49           H        GLU  49   1.402  -7.416   4.202
  369    HA   GLU  49           HA       GLU  49   0.977  -9.297   6.313
  370   1HB   GLU  49          2HB       GLU  49   0.343  -9.127   3.426
  371   2HB   GLU  49          1HB       GLU  49   0.455 -10.766   4.067
  372   1HG   GLU  49          2HG       GLU  49  -1.279 -10.418   5.616
  373   2HG   GLU  49          1HG       GLU  49  -1.119  -8.664   5.545
  374    H    PHE  50           H        PHE  50   3.371  -9.170   3.696
  375    HA   PHE  50           HA       PHE  50   4.445 -11.822   4.365
  376   1HB   PHE  50          2HB       PHE  50   5.027  -9.704   2.328
  377   2HB   PHE  50          1HB       PHE  50   6.326 -10.822   2.740
  378    HD1  PHE  50           HD1      PHE  50   5.638 -13.373   2.828
  379    HD2  PHE  50           HD2      PHE  50   3.459 -10.337   0.709
  380    HE1  PHE  50           HE1      PHE  50   4.581 -15.115   1.419
  381    HE2  PHE  50           HE2      PHE  50   2.402 -12.082  -0.701
  382    HZ   PHE  50           HZ       PHE  50   2.963 -14.471  -0.344
  383    H    LYS  51           H        LYS  51   6.387  -8.875   3.960
  384    HA   LYS  51           HA       LYS  51   7.036  -8.329   6.640
  385   1HB   LYS  51          2HB       LYS  51   8.018 -10.841   6.041
  386   2HB   LYS  51          1HB       LYS  51   9.423  -9.812   5.769
  387   1HG   LYS  51          2HG       LYS  51   9.152  -8.812   7.995
  388   2HG   LYS  51          1HG       LYS  51   7.709  -9.786   8.274
  389   1HD   LYS  51          2HD       LYS  51   9.342 -11.793   7.719
  390   2HD   LYS  51          1HD       LYS  51  10.582 -10.631   8.197
  391   1HE   LYS  51          2HE       LYS  51   8.263 -10.723  10.010
  392   2HE   LYS  51          1HE       LYS  51   9.187 -12.224   9.951
  393   1HZ   LYS  51          1HZ       LYS  51  10.165  -9.508  10.623
  394   2HZ   LYS  51          2HZ       LYS  51  11.215 -10.796  10.261
  395   3HZ   LYS  51          3HZ       LYS  51  10.176 -10.894  11.601
  396    H    VAL  52           H        VAL  52   6.825  -7.026   4.021
  397    HA   VAL  52           HA       VAL  52   9.445  -5.594   4.045
  398    HB   VAL  52           HB       VAL  52   9.101  -5.304   1.512
  399   1HG1  VAL  52          1HG1      VAL  52  10.693  -6.941   2.799
  400   2HG1  VAL  52          2HG1      VAL  52  10.446  -7.160   1.068
  401   3HG1  VAL  52          3HG1      VAL  52   9.587  -8.185   2.217
  402   1HG2  VAL  52          1HG2      VAL  52   7.786  -7.053   0.402
  403   2HG2  VAL  52          2HG2      VAL  52   6.753  -6.121   1.484
  404   3HG2  VAL  52          3HG2      VAL  52   7.318  -7.719   1.966
  405    HA   PRO  53           HA       PRO  53   6.859  -2.030   4.248
  406   1HB   PRO  53          2HB       PRO  53   8.623  -0.154   3.284
  407   2HB   PRO  53          1HB       PRO  53   8.722  -0.854   4.909
  408   1HG   PRO  53          2HG       PRO  53  10.414  -1.414   2.517
  409   2HG   PRO  53          1HG       PRO  53  10.821  -1.551   4.235
  410   1HD   PRO  53          2HD       PRO  53  10.165  -3.700   2.520
  411   2HD   PRO  53          1HD       PRO  53  10.223  -3.765   4.294
  412    H    ALA  54           H        ALA  54   5.342  -1.089   2.916
  413    HA   ALA  54           HA       ALA  54   5.096  -1.795   0.165
  414   1HB   ALA  54          1HB       ALA  54   3.163  -0.444   0.143
  415   2HB   ALA  54          2HB       ALA  54   3.816   0.663   1.351
  416   3HB   ALA  54          3HB       ALA  54   3.296  -0.952   1.826
  417    H    ALA  55           H        ALA  55   6.469   1.089   1.720
  418    HA   ALA  55           HA       ALA  55   6.758   2.715  -0.605
  419   1HB   ALA  55          1HB       ALA  55   7.828   2.671   2.128
  420   2HB   ALA  55          2HB       ALA  55   7.357   4.045   1.130
  421   3HB   ALA  55          3HB       ALA  55   8.962   3.337   0.952
  422    H    THR  56           H        THR  56   8.772   0.101   0.693
  423    HA   THR  56           HA       THR  56  10.575   0.385  -1.679
  424    HB   THR  56           HB       THR  56  11.175  -1.138   0.874
  425    HG1  THR  56           HG1      THR  56  11.653   0.684   1.765
  426   1HG2  THR  56          1HG2      THR  56  12.498  -0.771  -1.667
  427   2HG2  THR  56          2HG2      THR  56  12.973  -1.790  -0.308
  428   3HG2  THR  56          3HG2      THR  56  13.489  -0.105  -0.368
  429    H    SER  57           H        SER  57   8.073  -0.863  -2.034
  430    HA   SER  57           HA       SER  57   8.953  -3.640  -2.622
  431   1HB   SER  57          2HB       SER  57   6.623  -2.849  -0.918
  432   2HB   SER  57          1HB       SER  57   6.499  -4.288  -1.920
  433    HG   SER  57           HG       SER  57   7.800  -3.941   0.400
  434    H    ALA  58           H        ALA  58   7.884  -4.587  -4.372
  435    HA   ALA  58           HA       ALA  58   5.903  -2.949  -5.872
  436   1HB   ALA  58          1HB       ALA  58   8.163  -2.430  -6.788
  437   2HB   ALA  58          2HB       ALA  58   7.148  -3.263  -7.964
  438   3HB   ALA  58          3HB       ALA  58   8.407  -4.148  -7.103
  439    H    ILE  59           H        ILE  59   4.890  -4.331  -7.671
  440    HA   ILE  59           HA       ILE  59   4.939  -7.225  -6.894
  441    HB   ILE  59           HB       ILE  59   2.617  -5.369  -7.348
  442   1HG1  ILE  59          2HG1      ILE  59   2.901  -7.727  -5.474
  443   2HG1  ILE  59          1HG1      ILE  59   3.551  -6.137  -5.073
  444   1HG2  ILE  59          1HG2      ILE  59   2.653  -8.356  -7.873
  445   2HG2  ILE  59          2HG2      ILE  59   2.171  -7.081  -8.991
  446   3HG2  ILE  59          3HG2      ILE  59   1.174  -7.439  -7.582
  447   1HD1  ILE  59          1HD1      ILE  59   1.451  -5.910  -4.150
  448   2HD1  ILE  59          2HD1      ILE  59   0.709  -7.023  -5.300
  449   3HD1  ILE  59          3HD1      ILE  59   1.090  -5.373  -5.791
  450    H    ILE  60           H        ILE  60   5.028  -8.684  -8.587
  451    HA   ILE  60           HA       ILE  60   5.094  -7.507 -11.337
  452    HB   ILE  60           HB       ILE  60   6.648  -9.299 -11.958
  453   1HG1  ILE  60          2HG1      ILE  60   7.249 -10.221  -9.254
  454   2HG1  ILE  60          1HG1      ILE  60   5.591 -10.600  -9.718
  455   1HG2  ILE  60          1HG2      ILE  60   8.118  -8.529  -9.592
  456   2HG2  ILE  60          2HG2      ILE  60   7.192  -7.157 -10.197
  457   3HG2  ILE  60          3HG2      ILE  60   8.333  -7.985 -11.257
  458   1HD1  ILE  60          1HD1      ILE  60   6.783 -11.326 -11.995
  459   2HD1  ILE  60          2HD1      ILE  60   6.657 -12.434 -10.629
  460   3HD1  ILE  60          3HD1      ILE  60   8.157 -11.553 -10.912
  461    H    THR  61           H        THR  61   4.476  -9.146 -13.072
  462    HA   THR  61           HA       THR  61   2.057 -10.624 -12.154
  463    HB   THR  61           HB       THR  61   2.847  -9.904 -14.994
  464    HG1  THR  61           HG1      THR  61   1.965  -8.016 -14.671
  465   1HG2  THR  61          1HG2      THR  61   0.288 -10.113 -15.227
  466   2HG2  THR  61          2HG2      THR  61   0.338 -10.932 -13.666
  467   3HG2  THR  61          3HG2      THR  61   1.201 -11.610 -15.048
  468    H    ASN  62           H        ASN  62   1.618 -12.745 -13.176
  469    HA   ASN  62           HA       ASN  62   3.735 -14.604 -12.886
  470   1HB   ASN  62          2HB       ASN  62   1.099 -14.892 -13.040
  471   2HB   ASN  62          1HB       ASN  62   1.462 -15.235 -14.730
  472   1HD2  ASN  62          1HD2      ASN  62   2.509 -17.242 -15.230
  473   2HD2  ASN  62          2HD2      ASN  62   2.866 -18.411 -14.053
  474    H    ASP  63           H        ASP  63   2.797 -12.707 -15.693
  475    HA   ASP  63           HA       ASP  63   4.276 -14.353 -17.604
  476   1HB   ASP  63          2HB       ASP  63   3.109 -11.559 -17.805
  477   2HB   ASP  63          1HB       ASP  63   3.864 -12.413 -19.150
  478    H    GLY  64           H        GLY  64   4.827 -11.222 -15.964
  479   1HA   GLY  64          2HA       GLY  64   7.336 -11.139 -15.214
  480   2HA   GLY  64          1HA       GLY  64   7.644 -11.260 -16.945
  481    H    VAL  65           H        VAL  65   5.281  -9.372 -15.022
  482    HA   VAL  65           HA       VAL  65   6.386  -6.894 -16.284
  483    HB   VAL  65           HB       VAL  65   3.457  -7.484 -15.739
  484   1HG1  VAL  65          1HG1      VAL  65   3.311  -5.229 -15.786
  485   2HG1  VAL  65          2HG1      VAL  65   3.681  -5.348 -17.505
  486   3HG1  VAL  65          3HG1      VAL  65   4.975  -5.057 -16.343
  487   1HG2  VAL  65          1HG2      VAL  65   5.190  -8.065 -18.017
  488   2HG2  VAL  65          2HG2      VAL  65   3.843  -7.022 -18.470
  489   3HG2  VAL  65          3HG2      VAL  65   3.532  -8.585 -17.715
  490    H    GLY  66           H        GLY  66   7.318  -5.791 -14.631
  491   1HA   GLY  66          2HA       GLY  66   6.525  -6.134 -11.859
  492   2HA   GLY  66          1HA       GLY  66   7.724  -4.990 -12.456
  493    H    VAL  67           H        VAL  67   4.264  -5.510 -12.010
  494    HA   VAL  67           HA       VAL  67   3.508  -2.825 -12.809
  495    HB   VAL  67           HB       VAL  67   1.299  -3.396 -11.796
  496   1HG1  VAL  67          1HG1      VAL  67   2.712  -5.112 -13.787
  497   2HG1  VAL  67          2HG1      VAL  67   1.303  -4.072 -13.997
  498   3HG1  VAL  67          3HG1      VAL  67   1.128  -5.649 -13.228
  499   1HG2  VAL  67          1HG2      VAL  67   2.447  -4.897 -10.003
  500   2HG2  VAL  67          2HG2      VAL  67   2.421  -6.145 -11.248
  501   3HG2  VAL  67          3HG2      VAL  67   0.911  -5.438 -10.675
  502    H    ASN  68           H        ASN  68   3.156  -1.033 -11.538
  503    HA   ASN  68           HA       ASN  68   4.261  -1.150  -8.773
  504   1HB   ASN  68          2HB       ASN  68   4.019   0.982 -10.871
  505   2HB   ASN  68          1HB       ASN  68   4.084   1.466  -9.177
  506   1HD2  ASN  68          1HD2      ASN  68   6.234   2.236  -9.006
  507   2HD2  ASN  68          2HD2      ASN  68   7.603   1.302  -9.373
  508    HA   PRO  69           HA       PRO  69   0.368  -0.245  -6.945
  509   1HB   PRO  69          2HB       PRO  69   1.131   1.408  -4.880
  510   2HB   PRO  69          1HB       PRO  69   1.410  -0.341  -4.892
  511   1HG   PRO  69          2HG       PRO  69   3.357   1.875  -5.326
  512   2HG   PRO  69          1HG       PRO  69   3.641   0.236  -4.718
  513   1HD   PRO  69          2HD       PRO  69   4.178   1.148  -7.342
  514   2HD   PRO  69          1HD       PRO  69   4.143  -0.547  -6.813
  515    H    ALA  70           H        ALA  70   0.189   1.151  -9.137
  516    HA   ALA  70           HA       ALA  70  -0.744   3.851  -8.309
  517   1HB   ALA  70          1HB       ALA  70   0.995   3.354 -10.747
  518   2HB   ALA  70          2HB       ALA  70   1.551   4.106  -9.252
  519   3HB   ALA  70          3HB       ALA  70   0.330   4.907 -10.239
  520    H    GLN  71           H        GLN  71  -2.104   1.308  -9.011
  521    HA   GLN  71           HA       GLN  71  -3.762   2.343 -11.269
  522   1HB   GLN  71          2HB       GLN  71  -2.615  -0.436 -10.933
  523   2HB   GLN  71          1HB       GLN  71  -4.014  -0.122 -11.957
  524   1HG   GLN  71          2HG       GLN  71  -2.783   1.033 -13.525
  525   2HG   GLN  71          1HG       GLN  71  -1.624   1.624 -12.335
  526   1HE2  GLN  71          1HE2      GLN  71   0.169   0.211 -11.741
  527   2HE2  GLN  71          2HE2      GLN  71   0.544  -1.173 -12.648
  528    HA   PRO  72           HA       PRO  72  -7.131   1.291  -8.629
  529   1HB   PRO  72          2HB       PRO  72  -9.070   0.729 -10.498
  530   2HB   PRO  72          1HB       PRO  72  -8.519   2.368 -10.117
  531   1HG   PRO  72          2HG       PRO  72  -7.915   0.694 -12.509
  532   2HG   PRO  72          1HG       PRO  72  -7.951   2.458 -12.355
  533   1HD   PRO  72          2HD       PRO  72  -5.623   0.854 -12.403
  534   2HD   PRO  72          1HD       PRO  72  -5.705   2.557 -11.900
  535    H    ALA  73           H        ALA  73  -8.142  -0.533  -7.691
  536    HA   ALA  73           HA       ALA  73  -7.017  -3.096  -8.053
  537   1HB   ALA  73          1HB       ALA  73  -8.960  -3.932  -6.735
  538   2HB   ALA  73          2HB       ALA  73  -9.739  -2.362  -6.930
  539   3HB   ALA  73          3HB       ALA  73  -8.235  -2.492  -6.020
  540    H    GLY  74           H        GLY  74 -10.024  -1.756  -9.444
  541   1HA   GLY  74          2HA       GLY  74 -10.974  -4.112 -10.708
  542   2HA   GLY  74          1HA       GLY  74 -11.303  -2.474 -11.273
  543    H    ASN  75           H        ASN  75  -8.706  -1.623 -11.921
  544    HA   ASN  75           HA       ASN  75  -8.335  -2.832 -14.511
  545   1HB   ASN  75          2HB       ASN  75  -7.764  -0.457 -13.954
  546   2HB   ASN  75          1HB       ASN  75  -6.405  -1.048 -12.996
  547   1HD2  ASN  75          1HD2      ASN  75  -7.730  -1.128 -16.344
  548   2HD2  ASN  75          2HD2      ASN  75  -6.220  -1.314 -17.096
  549    H    ILE  76           H        ILE  76  -6.595  -3.151 -11.413
  550    HA   ILE  76           HA       ILE  76  -4.413  -4.727 -12.364
  551    HB   ILE  76           HB       ILE  76  -5.775  -4.774  -9.648
  552   1HG1  ILE  76          2HG1      ILE  76  -4.890  -2.548 -10.393
  553   2HG1  ILE  76          1HG1      ILE  76  -4.052  -3.185  -8.981
  554   1HG2  ILE  76          1HG2      ILE  76  -4.236  -6.272  -8.953
  555   2HG2  ILE  76          2HG2      ILE  76  -2.922  -5.389  -9.727
  556   3HG2  ILE  76          3HG2      ILE  76  -3.869  -6.551 -10.655
  557   1HD1  ILE  76          1HD1      ILE  76  -2.972  -3.797 -11.714
  558   2HD1  ILE  76          2HD1      ILE  76  -2.114  -3.665 -10.180
  559   3HD1  ILE  76          3HD1      ILE  76  -2.671  -2.212 -11.006
  560    H    PHE  77           H        PHE  77  -7.667  -5.659 -11.241
  561    HA   PHE  77           HA       PHE  77  -7.186  -8.513 -11.506
  562   1HB   PHE  77          2HB       PHE  77  -8.995  -7.355 -10.083
  563   2HB   PHE  77          1HB       PHE  77  -9.893  -7.168 -11.588
  564    HD1  PHE  77           HD1      PHE  77  -8.557  -9.587  -9.141
  565    HD2  PHE  77           HD2      PHE  77 -10.823  -9.094 -12.758
  566    HE1  PHE  77           HE1      PHE  77  -9.354 -11.927  -8.961
  567    HE2  PHE  77           HE2      PHE  77 -11.619 -11.436 -12.577
  568    HZ   PHE  77           HZ       PHE  77 -10.884 -12.851 -10.679
  569    H    LEU  78           H        LEU  78  -8.623  -6.004 -13.584
  570    HA   LEU  78           HA       LEU  78  -9.540  -7.767 -15.656
  571   1HB   LEU  78          2HB       LEU  78  -8.817  -4.832 -15.600
  572   2HB   LEU  78          1HB       LEU  78  -9.347  -5.627 -17.083
  573    HG   LEU  78           HG       LEU  78 -10.948  -5.840 -14.532
  574   1HD1  LEU  78          1HD1      LEU  78 -11.047  -3.534 -14.756
  575   2HD1  LEU  78          2HD1      LEU  78 -12.357  -4.007 -15.837
  576   3HD1  LEU  78          3HD1      LEU  78 -10.778  -3.586 -16.498
  577   1HD2  LEU  78          1HD2      LEU  78 -12.784  -6.185 -16.226
  578   2HD2  LEU  78          2HD2      LEU  78 -11.533  -7.426 -16.273
  579   3HD2  LEU  78          3HD2      LEU  78 -11.554  -6.150 -17.489
  580    H    LYS  79           H        LYS  79  -6.407  -6.234 -15.030
  581    HA   LYS  79           HA       LYS  79  -5.303  -7.124 -17.609
  582   1HB   LYS  79          2HB       LYS  79  -4.435  -5.390 -15.374
  583   2HB   LYS  79          1HB       LYS  79  -3.144  -6.296 -16.162
  584   1HG   LYS  79          2HG       LYS  79  -3.924  -5.447 -18.363
  585   2HG   LYS  79          1HG       LYS  79  -5.152  -4.487 -17.537
  586   1HD   LYS  79          2HD       LYS  79  -3.654  -2.866 -17.106
  587   2HD   LYS  79          1HD       LYS  79  -2.586  -4.021 -16.308
  588   1HE   LYS  79          2HE       LYS  79  -1.867  -4.740 -18.667
  589   2HE   LYS  79          1HE       LYS  79  -2.673  -3.277 -19.234
  590   1HZ   LYS  79          1HZ       LYS  79  -0.274  -2.983 -18.782
  591   2HZ   LYS  79          2HZ       LYS  79  -0.572  -3.314 -17.142
  592   3HZ   LYS  79          3HZ       LYS  79  -1.262  -1.946 -17.873
  593    H    HIS  80           H        HIS  80  -4.497  -7.751 -14.164
  594    HA   HIS  80           HA       HIS  80  -3.084 -10.226 -15.012
  595   1HB   HIS  80          2HB       HIS  80  -3.182  -9.258 -12.166
  596   2HB   HIS  80          1HB       HIS  80  -1.900 -10.134 -13.000
  597    HD1  HIS  80           HD1      HIS  80  -1.066  -8.535 -15.278
  598    HD2  HIS  80           HD2      HIS  80  -2.381  -6.655 -11.799
  599    HE1  HIS  80           HE1      HIS  80  -0.172  -6.168 -15.361
  600    H    GLY  81           H        GLY  81  -5.408  -9.286 -12.432
  601   1HA   GLY  81          2HA       GLY  81  -7.499 -10.525 -12.105
  602   2HA   GLY  81          1HA       GLY  81  -6.715 -11.946 -12.794
  603    H    SER  82           H        SER  82  -5.652 -13.347 -11.421
  604    HA   SER  82           HA       SER  82  -5.175 -12.456  -8.611
  605   1HB   SER  82          2HB       SER  82  -7.250 -14.146  -9.352
  606   2HB   SER  82          1HB       SER  82  -5.989 -15.264  -8.842
  607    HG   SER  82           HG       SER  82  -7.355 -14.499  -7.119
  608    H    GLU  83           H        GLU  83  -3.226 -12.626 -10.675
  609    HA   GLU  83           HA       GLU  83  -1.519 -14.815  -9.585
  610   1HB   GLU  83          2HB       GLU  83  -2.258 -14.303 -12.441
  611   2HB   GLU  83          1HB       GLU  83  -0.611 -14.830 -12.095
  612   1HG   GLU  83          2HG       GLU  83  -2.831 -16.307 -10.753
  613   2HG   GLU  83          1HG       GLU  83  -2.599 -16.584 -12.479
  614    H    LEU  84           H        LEU  84  -0.505 -13.141  -8.332
  615    HA   LEU  84           HA       LEU  84   1.353 -11.434  -9.933
  616   1HB   LEU  84          2HB       LEU  84  -0.287 -10.589  -7.525
  617   2HB   LEU  84          1HB       LEU  84   1.032  -9.637  -8.204
  618    HG   LEU  84           HG       LEU  84  -1.115 -10.580 -10.061
  619   1HD1  LEU  84          1HD1      LEU  84  -1.405  -8.225  -8.171
  620   2HD1  LEU  84          2HD1      LEU  84  -2.376  -9.696  -8.142
  621   3HD1  LEU  84          3HD1      LEU  84  -2.486  -8.596  -9.514
  622   1HD2  LEU  84          1HD2      LEU  84   0.933  -9.330 -10.802
  623   2HD2  LEU  84          2HD2      LEU  84   0.400  -7.963  -9.825
  624   3HD2  LEU  84          3HD2      LEU  84  -0.572  -8.499 -11.194
  625    H    ARG  85           H        ARG  85   3.205 -10.630  -8.528
  626    HA   ARG  85           HA       ARG  85   3.860 -12.520  -6.309
  627   1HB   ARG  85          2HB       ARG  85   5.283 -12.104  -8.873
  628   2HB   ARG  85          1HB       ARG  85   6.308 -12.116  -7.438
  629   1HG   ARG  85          2HG       ARG  85   5.859 -14.321  -6.966
  630   2HG   ARG  85          1HG       ARG  85   4.229 -14.242  -7.635
  631   1HD   ARG  85          2HD       ARG  85   6.587 -13.959  -9.473
  632   2HD   ARG  85          1HD       ARG  85   6.103 -15.564  -8.929
  633    HE   ARG  85           HE       ARG  85   4.738 -14.016 -10.919
  634   1HH1  ARG  85          2HH1      ARG  85   4.614 -17.001  -9.674
  635   2HH1  ARG  85          1HH1      ARG  85   2.893 -17.133  -9.540
  636   1HH2  ARG  85          1HH2      ARG  85   2.324 -13.752 -10.112
  637   2HH2  ARG  85          2HH2      ARG  85   1.591 -15.286  -9.788
  638    H    LEU  86           H        LEU  86   5.263 -11.620  -4.700
  639    HA   LEU  86           HA       LEU  86   5.380  -8.643  -4.769
  640   1HB   LEU  86          2HB       LEU  86   4.319 -10.123  -2.837
  641   2HB   LEU  86          1HB       LEU  86   5.995 -10.213  -2.297
  642    HG   LEU  86           HG       LEU  86   5.451  -7.506  -3.048
  643   1HD1  LEU  86          1HD1      LEU  86   3.741  -7.247  -1.031
  644   2HD1  LEU  86          2HD1      LEU  86   3.289  -8.885  -1.504
  645   3HD1  LEU  86          3HD1      LEU  86   3.169  -7.566  -2.669
  646   1HD2  LEU  86          1HD2      LEU  86   5.637  -8.490  -0.211
  647   2HD2  LEU  86          2HD2      LEU  86   6.359  -7.055  -0.940
  648   3HD2  LEU  86          3HD2      LEU  86   7.024  -8.651  -1.286
  649    H    ILE  87           H        ILE  87   7.303  -7.610  -4.850
  650    HA   ILE  87           HA       ILE  87   9.797  -9.091  -4.183
  651    HB   ILE  87           HB       ILE  87   9.533  -9.301  -6.613
  652   1HG1  ILE  87          2HG1      ILE  87  11.580  -7.135  -6.052
  653   2HG1  ILE  87          1HG1      ILE  87  11.803  -8.820  -5.584
  654   1HG2  ILE  87          1HG2      ILE  87   8.478  -7.691  -7.770
  655   2HG2  ILE  87          2HG2      ILE  87   9.852  -6.621  -7.501
  656   3HG2  ILE  87          3HG2      ILE  87   8.506  -6.626  -6.365
  657   1HD1  ILE  87          1HD1      ILE  87  12.589  -9.235  -7.650
  658   2HD1  ILE  87          2HD1      ILE  87  12.195  -7.597  -8.171
  659   3HD1  ILE  87          3HD1      ILE  87  10.985  -8.874  -8.287
  660    HA   PRO  88           HA       PRO  88  10.521  -5.227  -2.143
  661   1HB   PRO  88          2HB       PRO  88  13.125  -5.728  -1.405
  662   2HB   PRO  88          1HB       PRO  88  11.717  -6.408  -0.570
  663   1HG   PRO  88          2HG       PRO  88  13.608  -7.744  -2.458
  664   2HG   PRO  88          1HG       PRO  88  12.664  -8.443  -1.131
  665   1HD   PRO  88          2HD       PRO  88  12.015  -8.624  -3.864
  666   2HD   PRO  88          1HD       PRO  88  10.903  -8.949  -2.518
  667    H    ARG  89           H        ARG  89  10.485  -3.780  -3.912
  668    HA   ARG  89           HA       ARG  89  13.157  -3.046  -4.998
  669   1HB   ARG  89          2HB       ARG  89  11.707  -4.520  -6.595
  670   2HB   ARG  89          1HB       ARG  89  10.736  -3.062  -6.796
  671   1HG   ARG  89          2HG       ARG  89  13.191  -1.995  -7.137
  672   2HG   ARG  89          1HG       ARG  89  13.510  -3.633  -7.707
  673   1HD   ARG  89          2HD       ARG  89  12.800  -2.275  -9.594
  674   2HD   ARG  89          1HD       ARG  89  11.528  -3.440  -9.226
  675    HE   ARG  89           HE       ARG  89  10.724  -1.254  -7.787
  676   1HH1  ARG  89          2HH1      ARG  89   9.350  -2.043 -10.336
  677   2HH1  ARG  89          1HH1      ARG  89   9.497  -0.601 -11.286
  678   1HH2  ARG  89          1HH2      ARG  89  12.000   0.768  -9.303
  679   2HH2  ARG  89          2HH2      ARG  89  11.008   0.988 -10.707
  680    H    ASP  90           H        ASP  90  13.445  -0.833  -5.022
  681    HA   ASP  90           HA       ASP  90  11.236   0.829  -3.986
  682   1HB   ASP  90          2HB       ASP  90  13.963   0.857  -3.571
  683   2HB   ASP  90          1HB       ASP  90  13.744   2.189  -4.706
  684    H    ARG  91           H        ARG  91  10.602   2.836  -5.053
  685    HA   ARG  91           HA       ARG  91  10.312   2.525  -7.939
  686   1HB   ARG  91          2HB       ARG  91   9.270   4.343  -5.840
  687   2HB   ARG  91          1HB       ARG  91   9.422   5.053  -7.447
  688   1HG   ARG  91          2HG       ARG  91   7.661   3.881  -8.226
  689   2HG   ARG  91          1HG       ARG  91   8.293   2.370  -7.569
  690   1HD   ARG  91          2HD       ARG  91   7.449   3.919  -5.348
  691   2HD   ARG  91          1HD       ARG  91   6.164   4.023  -6.552
  692    HE   ARG  91           HE       ARG  91   5.931   1.606  -6.444
  693   1HH1  ARG  91          1HH2      ARG  91   5.862   2.394  -3.538
  694   2HH1  ARG  91          2HH2      ARG  91   6.979   1.269  -2.841
  695   1HH2  ARG  91          2HH1      ARG  91   8.408   0.399  -5.883
  696   2HH2  ARG  91          1HH1      ARG  91   8.425   0.137  -4.171
  697    H    VAL  92           H        VAL  92  12.221   2.800  -9.043
  698    HA   VAL  92           HA       VAL  92  13.843   5.241  -8.465
  699    HB   VAL  92           HB       VAL  92  14.610   2.741 -10.008
  700   1HG1  VAL  92          1HG1      VAL  92  16.118   5.225  -9.168
  701   2HG1  VAL  92          2HG1      VAL  92  15.926   4.573 -10.795
  702   3HG1  VAL  92          3HG1      VAL  92  16.937   3.731  -9.622
  703   1HG2  VAL  92          1HG2      VAL  92  14.876   1.822  -7.959
  704   2HG2  VAL  92          2HG2      VAL  92  14.553   3.359  -7.157
  705   3HG2  VAL  92          3HG2      VAL  92  16.185   2.976  -7.706
  706    H    GLY  93           H        GLY  93  13.065   3.230 -11.340
  707   1HA   GLY  93          2HA       GLY  93  12.964   5.732 -12.958
  708   2HA   GLY  93          1HA       GLY  93  13.182   4.107 -13.609
  709    H    HIS  94           HN       HIS  94  11.200   2.620 -12.707
  710    HA   HIS  94           HA       HIS  94   8.726   4.073 -13.548
  711   1HB   HIS  94          2HB       HIS  94   9.744   1.983 -14.830
  712   2HB   HIS  94          1HB       HIS  94   8.910   1.081 -13.567
  713    HD1  HIS  94           HD1      HIS  94   8.303   3.260 -16.546
  714    HD2  HIS  94           HD2      HIS  94   6.051   1.290 -13.649
  715    HE1  HIS  94           HE1      HIS  94   5.902   3.306 -17.352
  Start of MODEL    5
    1   1H    MET   1          1H        MET   1 -17.773  -1.289  -4.158
    2   2H    MET   1          2H        MET   1 -18.432  -0.401  -5.448
    3   3H    MET   1          3H        MET   1 -19.210  -1.807  -4.894
    4    HA   MET   1           HA       MET   1 -19.833  -0.800  -2.859
    5   1HB   MET   1          2HB       MET   1 -17.792   1.213  -3.710
    6   2HB   MET   1          1HB       MET   1 -19.180   1.802  -2.798
    7   1HG   MET   1          2HG       MET   1 -18.683  -0.142  -1.165
    8   2HG   MET   1          1HG       MET   1 -17.108  -0.219  -1.953
    9   1HE   MET   1          1HE       MET   1 -16.451   1.494   1.475
   10   2HE   MET   1          2HE       MET   1 -16.293   0.046   0.482
   11   3HE   MET   1          3HE       MET   1 -17.853   0.448   1.196
   12    H    SER   2           H        SER   2 -19.403   1.828  -5.243
   13    HA   SER   2           HA       SER   2 -22.360   2.035  -5.404
   14   1HB   SER   2          2HB       SER   2 -20.362   3.941  -5.101
   15   2HB   SER   2          1HB       SER   2 -20.820   4.093  -6.794
   16    HG   SER   2           HG       SER   2 -22.079   5.096  -4.788
   17    H    GLY   3           H        GLY   3 -22.922   0.487  -6.909
   18   1HA   GLY   3          2HA       GLY   3 -21.600   0.486  -9.573
   19   2HA   GLY   3          1HA       GLY   3 -22.782  -0.705  -9.005
   20    H    GLY   4           H        GLY   4 -22.657   2.839  -9.326
   21   1HA   GLY   4          2HA       GLY   4 -24.062   4.216 -10.683
   22   2HA   GLY   4          1HA       GLY   4 -25.101   2.820 -10.993
   23    H    THR   5           H        THR   5 -26.200   1.934  -8.941
   24    HA   THR   5           HA       THR   5 -26.715   3.859  -6.777
   25    HB   THR   5           HB       THR   5 -29.221   3.768  -7.182
   26    HG1  THR   5           HG1      THR   5 -29.313   2.072  -8.619
   27   1HG2  THR   5          1HG2      THR   5 -29.211   5.641  -8.649
   28   2HG2  THR   5          2HG2      THR   5 -27.746   5.092  -9.463
   29   3HG2  THR   5          3HG2      THR   5 -27.661   5.695  -7.808
   30    H    ALA   6           H        ALA   6 -25.508   1.435  -6.589
   31    HA   ALA   6           HA       ALA   6 -27.621  -0.407  -5.551
   32   1HB   ALA   6          1HB       ALA   6 -24.786  -1.201  -6.216
   33   2HB   ALA   6          2HB       ALA   6 -26.041  -1.151  -7.456
   34   3HB   ALA   6          3HB       ALA   6 -26.209  -2.233  -6.073
   35    H    ALA   7           H        ALA   7 -27.783   0.239  -3.427
   36    HA   ALA   7           HA       ALA   7 -25.518   0.998  -1.795
   37   1HB   ALA   7          1HB       ALA   7 -27.175   0.753   0.096
   38   2HB   ALA   7          2HB       ALA   7 -28.354   0.194  -1.089
   39   3HB   ALA   7          3HB       ALA   7 -27.707   1.831  -1.194
   40    H    THR   8           H        THR   8 -23.976  -0.603  -1.698
   41    HA   THR   8           HA       THR   8 -24.697  -3.022  -0.155
   42    HB   THR   8           HB       THR   8 -24.867  -3.638  -2.576
   43    HG1  THR   8           HG1      THR   8 -24.242  -5.451  -1.770
   44   1HG2  THR   8          1HG2      THR   8 -21.920  -3.498  -2.895
   45   2HG2  THR   8          2HG2      THR   8 -22.782  -1.962  -2.972
   46   3HG2  THR   8          3HG2      THR   8 -23.197  -3.261  -4.089
   47    H    THR   9           H        THR   9 -22.879  -3.937   0.940
   48    HA   THR   9           HA       THR   9 -20.861  -2.036   1.730
   49    HB   THR   9           HB       THR   9 -20.871  -5.037   2.184
   50    HG1  THR   9           HG1      THR   9 -22.637  -4.551   3.217
   51   1HG2  THR   9          1HG2      THR   9 -19.797  -3.003   4.101
   52   2HG2  THR   9          2HG2      THR   9 -18.821  -3.435   2.697
   53   3HG2  THR   9          3HG2      THR   9 -19.302  -4.678   3.851
   54    H    ALA  10           H        ALA  10 -20.752  -4.975  -0.317
   55    HA   ALA  10           HA       ALA  10 -18.158  -3.968  -1.417
   56   1HB   ALA  10          1HB       ALA  10 -17.162  -6.052  -1.260
   57   2HB   ALA  10          2HB       ALA  10 -18.701  -6.910  -1.327
   58   3HB   ALA  10          3HB       ALA  10 -18.203  -6.109   0.163
   59    H    GLY  11           H        GLY  11 -20.635  -6.485  -2.141
   60   1HA   GLY  11          2HA       GLY  11 -21.887  -6.811  -4.116
   61   2HA   GLY  11          1HA       GLY  11 -21.289  -5.257  -4.702
   62    H    SER  12           H        SER  12 -19.517  -5.224  -6.079
   63    HA   SER  12           HA       SER  12 -18.489  -7.887  -6.948
   64   1HB   SER  12          2HB       SER  12 -19.518  -6.013  -8.530
   65   2HB   SER  12          1HB       SER  12 -17.889  -5.350  -8.434
   66    HG   SER  12           HG       SER  12 -18.553  -7.094 -10.096
   67    H    LYS  13           H        LYS  13 -16.407  -8.444  -6.479
   68    HA   LYS  13           HA       LYS  13 -14.437  -6.299  -5.869
   69   1HB   LYS  13          2HB       LYS  13 -13.634  -7.689  -3.898
   70   2HB   LYS  13          1HB       LYS  13 -15.187  -6.886  -3.670
   71   1HG   LYS  13          2HG       LYS  13 -16.342  -8.851  -3.613
   72   2HG   LYS  13          1HG       LYS  13 -15.338  -9.593  -4.858
   73   1HD   LYS  13          2HD       LYS  13 -13.487  -9.570  -2.997
   74   2HD   LYS  13          1HD       LYS  13 -14.858  -9.425  -1.897
   75   1HE   LYS  13          2HE       LYS  13 -14.995 -11.681  -2.029
   76   2HE   LYS  13          1HE       LYS  13 -15.683 -11.413  -3.630
   77   1HZ   LYS  13          1HZ       LYS  13 -13.106 -11.252  -4.206
   78   2HZ   LYS  13          2HZ       LYS  13 -13.963 -12.718  -4.225
   79   3HZ   LYS  13          3HZ       LYS  13 -13.016 -12.305  -2.877
   80    H    VAL  14           H        VAL  14 -12.220  -7.006  -6.056
   81    HA   VAL  14           HA       VAL  14 -11.901  -9.435  -7.775
   82    HB   VAL  14           HB       VAL  14  -9.746  -8.275  -8.504
   83   1HG1  VAL  14          1HG1      VAL  14 -12.388  -6.885  -9.036
   84   2HG1  VAL  14          2HG1      VAL  14 -11.750  -8.273  -9.917
   85   3HG1  VAL  14          3HG1      VAL  14 -10.937  -6.712 -10.022
   86   1HG2  VAL  14          1HG2      VAL  14 -11.077  -5.944  -7.083
   87   2HG2  VAL  14          2HG2      VAL  14  -9.661  -5.824  -8.126
   88   3HG2  VAL  14          3HG2      VAL  14  -9.565  -6.715  -6.606
   89    H    THR  15           H        THR  15 -10.375 -10.977  -7.193
   90    HA   THR  15           HA       THR  15  -9.127 -10.631  -4.501
   91    HB   THR  15           HB       THR  15  -9.517 -13.204  -6.064
   92    HG1  THR  15           HG1      THR  15 -11.505 -13.097  -5.449
   93   1HG2  THR  15          1HG2      THR  15  -8.446 -12.460  -3.391
   94   2HG2  THR  15          2HG2      THR  15  -8.000 -13.797  -4.452
   95   3HG2  THR  15          3HG2      THR  15  -9.457 -13.904  -3.464
   96    H    PHE  16           H        PHE  16  -6.912 -10.620  -4.310
   97    HA   PHE  16           HA       PHE  16  -5.315 -11.197  -6.782
   98   1HB   PHE  16          2HB       PHE  16  -4.691  -9.203  -4.586
   99   2HB   PHE  16          1HB       PHE  16  -3.706  -9.509  -6.015
  100    HD1  PHE  16           HD1      PHE  16  -6.119  -7.369  -4.667
  101    HD2  PHE  16           HD2      PHE  16  -5.126  -9.414  -8.312
  102    HE1  PHE  16           HE1      PHE  16  -7.468  -5.735  -5.953
  103    HE2  PHE  16           HE2      PHE  16  -6.475  -7.781  -9.597
  104    HZ   PHE  16           HZ       PHE  16  -7.646  -5.942  -8.416
  105    H    LYS  17           H        LYS  17  -3.459 -12.439  -6.529
  106    HA   LYS  17           HA       LYS  17  -2.959 -13.530  -3.791
  107   1HB   LYS  17          2HB       LYS  17  -3.519 -14.884  -6.302
  108   2HB   LYS  17          1HB       LYS  17  -1.947 -15.366  -5.658
  109   1HG   LYS  17          2HG       LYS  17  -3.333 -15.470  -3.374
  110   2HG   LYS  17          1HG       LYS  17  -4.669 -15.728  -4.496
  111   1HD   LYS  17          2HD       LYS  17  -2.143 -17.307  -4.859
  112   2HD   LYS  17          1HD       LYS  17  -3.291 -17.816  -3.617
  113   1HE   LYS  17          2HE       LYS  17  -4.378 -18.904  -5.295
  114   2HE   LYS  17          1HE       LYS  17  -4.903 -17.313  -5.822
  115   1HZ   LYS  17          1HZ       LYS  17  -3.460 -17.314  -7.539
  116   2HZ   LYS  17          2HZ       LYS  17  -3.521 -19.006  -7.337
  117   3HZ   LYS  17          3HZ       LYS  17  -2.233 -18.110  -6.664
  118    H    ILE  18           H        ILE  18  -1.122 -12.538  -3.101
  119    HA   ILE  18           HA       ILE  18   1.059 -12.045  -5.070
  120    HB   ILE  18           HB       ILE  18   0.677 -10.936  -2.267
  121   1HG1  ILE  18          2HG1      ILE  18   0.511  -8.840  -4.049
  122   2HG1  ILE  18          1HG1      ILE  18  -0.321 -10.127  -4.920
  123   1HG2  ILE  18          1HG2      ILE  18   2.987 -11.088  -3.863
  124   2HG2  ILE  18          2HG2      ILE  18   2.745 -10.061  -2.451
  125   3HG2  ILE  18          3HG2      ILE  18   2.397  -9.439  -4.063
  126   1HD1  ILE  18          1HD1      ILE  18  -1.723  -8.652  -3.313
  127   2HD1  ILE  18          2HD1      ILE  18  -0.938  -9.563  -2.022
  128   3HD1  ILE  18          3HD1      ILE  18  -1.932 -10.401  -3.215
  129    H    THR  19           H        THR  19   2.606 -13.577  -5.106
  130    HA   THR  19           HA       THR  19   3.234 -15.065  -2.583
  131    HB   THR  19           HB       THR  19   3.843 -15.927  -5.429
  132    HG1  THR  19           HG1      THR  19   1.682 -16.027  -5.325
  133   1HG2  THR  19          1HG2      THR  19   4.154 -17.116  -2.700
  134   2HG2  THR  19          2HG2      THR  19   5.249 -17.179  -4.081
  135   3HG2  THR  19          3HG2      THR  19   3.805 -18.192  -4.054
  136    H    LEU  20           H        LEU  20   5.309 -14.885  -1.790
  137    HA   LEU  20           HA       LEU  20   7.060 -12.841  -2.744
  138   1HB   LEU  20          2HB       LEU  20   6.920 -14.135  -0.419
  139   2HB   LEU  20          1HB       LEU  20   8.177 -15.122  -1.162
  140    HG   LEU  20           HG       LEU  20   9.319 -12.879  -1.755
  141   1HD1  LEU  20          1HD1      LEU  20   7.858 -11.159  -1.307
  142   2HD1  LEU  20          2HD1      LEU  20   8.636 -11.253   0.273
  143   3HD1  LEU  20          3HD1      LEU  20   7.074 -12.027   0.013
  144   1HD2  LEU  20          1HD2      LEU  20   9.983 -14.552   0.057
  145   2HD2  LEU  20          2HD2      LEU  20   9.115 -13.525   1.197
  146   3HD2  LEU  20          3HD2      LEU  20  10.510 -12.891   0.323
  147    H    THR  21           H        THR  21   8.982 -12.948  -3.947
  148    HA   THR  21           HA       THR  21   9.100 -14.983  -5.997
  149    HB   THR  21           HB       THR  21  11.359 -13.813  -6.501
  150    HG1  THR  21           HG1      THR  21  11.961 -12.423  -5.074
  151   1HG2  THR  21          1HG2      THR  21  10.207 -11.915  -7.522
  152   2HG2  THR  21          2HG2      THR  21   8.817 -12.163  -6.466
  153   3HG2  THR  21          3HG2      THR  21   9.222 -13.368  -7.688
  154    H    SER  22           H        SER  22  10.662 -14.593  -2.882
  155    HA   SER  22           HA       SER  22  12.896 -16.331  -3.281
  156   1HB   SER  22          2HB       SER  22  11.690 -14.946  -1.092
  157   2HB   SER  22          1HB       SER  22  11.912 -16.624  -0.609
  158    HG   SER  22           HG       SER  22  13.841 -15.730  -0.205
  159    H    ASP  23           H        ASP  23   9.589 -17.011  -2.080
  160    HA   ASP  23           HA       ASP  23  10.142 -19.906  -2.044
  161   1HB   ASP  23          2HB       ASP  23   8.012 -20.154  -1.022
  162   2HB   ASP  23          1HB       ASP  23   8.649 -18.652  -0.360
  163    HA   PRO  24           HA       PRO  24   8.515 -20.776  -6.031
  164   1HB   PRO  24          2HB       PRO  24   7.374 -23.243  -5.585
  165   2HB   PRO  24          1HB       PRO  24   9.121 -22.972  -5.703
  166   1HG   PRO  24          2HG       PRO  24   7.464 -23.505  -3.283
  167   2HG   PRO  24          1HG       PRO  24   9.185 -23.826  -3.559
  168   1HD   PRO  24          2HD       PRO  24   8.113 -21.668  -2.070
  169   2HD   PRO  24          1HD       PRO  24   9.796 -21.830  -2.616
  170    H    LYS  25           H        LYS  25   6.012 -22.194  -3.863
  171    HA   LYS  25           HA       LYS  25   4.034 -20.175  -4.485
  172   1HB   LYS  25          2HB       LYS  25   4.348 -21.799  -6.592
  173   2HB   LYS  25          1HB       LYS  25   3.253 -22.813  -5.652
  174   1HG   LYS  25          2HG       LYS  25   1.596 -21.567  -6.567
  175   2HG   LYS  25          1HG       LYS  25   2.092 -20.320  -5.422
  176   1HD   LYS  25          2HD       LYS  25   3.871 -19.746  -7.286
  177   2HD   LYS  25          1HD       LYS  25   2.720 -20.565  -8.344
  178   1HE   LYS  25          2HE       LYS  25   1.194 -18.890  -8.186
  179   2HE   LYS  25          1HE       LYS  25   1.487 -18.659  -6.463
  180   1HZ   LYS  25          1HZ       LYS  25   2.513 -16.802  -7.098
  181   2HZ   LYS  25          2HZ       LYS  25   2.631 -17.293  -8.718
  182   3HZ   LYS  25          3HZ       LYS  25   3.792 -17.801  -7.588
  183    H    LEU  26           H        LEU  26   4.262 -20.523  -2.074
  184    HA   LEU  26           HA       LEU  26   2.163 -22.407  -1.185
  185   1HB   LEU  26          2HB       LEU  26   5.012 -22.770  -0.645
  186   2HB   LEU  26          1HB       LEU  26   4.056 -22.685   0.836
  187    HG   LEU  26           HG       LEU  26   2.891 -24.331  -1.336
  188   1HD1  LEU  26          1HD1      LEU  26   4.385 -26.223  -0.943
  189   2HD1  LEU  26          2HD1      LEU  26   5.335 -25.270   0.199
  190   3HD1  LEU  26          3HD1      LEU  26   5.326 -24.844  -1.513
  191   1HD2  LEU  26          1HD2      LEU  26   2.681 -23.999   1.489
  192   2HD2  LEU  26          2HD2      LEU  26   3.249 -25.643   1.199
  193   3HD2  LEU  26          3HD2      LEU  26   1.749 -25.093   0.458
  194    HA   PRO  27           HA       PRO  27   2.713 -19.166   2.234
  195   1HB   PRO  27          2HB       PRO  27   5.042 -17.712   2.377
  196   2HB   PRO  27          1HB       PRO  27   4.825 -19.285   3.162
  197   1HG   PRO  27          2HG       PRO  27   6.379 -18.610   0.710
  198   2HG   PRO  27          1HG       PRO  27   6.617 -19.937   1.859
  199   1HD   PRO  27          2HD       PRO  27   5.396 -20.145  -0.685
  200   2HD   PRO  27          1HD       PRO  27   5.362 -21.368   0.598
  201    H    PHE  28           H        PHE  28   1.178 -18.151   0.698
  202    HA   PHE  28           HA       PHE  28   2.234 -15.596  -0.446
  203   1HB   PHE  28          2HB       PHE  28   0.487 -15.850  -2.258
  204   2HB   PHE  28          1HB       PHE  28   1.805 -17.015  -2.338
  205    HD1  PHE  28           HD1      PHE  28   1.372 -19.336  -2.287
  206    HD2  PHE  28           HD2      PHE  28  -1.696 -16.575  -1.088
  207    HE1  PHE  28           HE1      PHE  28  -0.265 -21.196  -2.187
  208    HE2  PHE  28           HE2      PHE  28  -3.329 -18.437  -0.985
  209    HZ   PHE  28           HZ       PHE  28  -2.615 -20.747  -1.535
  210    H    LYS  29           H        LYS  29   0.510 -13.911  -0.687
  211    HA   LYS  29           HA       LYS  29  -1.478 -14.136   1.538
  212   1HB   LYS  29          2HB       LYS  29   0.312 -11.972   0.602
  213   2HB   LYS  29          1HB       LYS  29  -1.324 -11.463   1.021
  214   1HG   LYS  29          2HG       LYS  29  -0.441 -11.362   3.129
  215   2HG   LYS  29          1HG       LYS  29  -0.807 -13.088   3.120
  216   1HD   LYS  29          2HD       LYS  29   1.721 -12.727   1.838
  217   2HD   LYS  29          1HD       LYS  29   1.751 -11.830   3.356
  218   1HE   LYS  29          2HE       LYS  29   0.902 -13.871   4.525
  219   2HE   LYS  29          1HE       LYS  29   1.024 -14.753   3.004
  220   1HZ   LYS  29          1HZ       LYS  29   3.430 -13.338   3.629
  221   2HZ   LYS  29          2HZ       LYS  29   3.205 -14.980   3.254
  222   3HZ   LYS  29          3HZ       LYS  29   3.010 -14.438   4.851
  223    H    VAL  30           H        VAL  30  -3.622 -13.805   1.088
  224    HA   VAL  30           HA       VAL  30  -4.346 -13.205  -1.752
  225    HB   VAL  30           HB       VAL  30  -6.021 -14.542   0.405
  226   1HG1  VAL  30          1HG1      VAL  30  -7.410 -15.205  -1.601
  227   2HG1  VAL  30          2HG1      VAL  30  -6.434 -14.098  -2.567
  228   3HG1  VAL  30          3HG1      VAL  30  -7.427 -13.476  -1.248
  229   1HG2  VAL  30          1HG2      VAL  30  -4.644 -16.304  -0.032
  230   2HG2  VAL  30          2HG2      VAL  30  -4.005 -15.561  -1.498
  231   3HG2  VAL  30          3HG2      VAL  30  -5.543 -16.422  -1.546
  232    H    LEU  31           H        LEU  31  -5.251 -11.231  -2.120
  233    HA   LEU  31           HA       LEU  31  -6.462  -9.787   0.208
  234   1HB   LEU  31          2HB       LEU  31  -4.424  -8.999  -1.709
  235   2HB   LEU  31          1HB       LEU  31  -5.793  -7.888  -1.749
  236    HG   LEU  31           HG       LEU  31  -5.164  -8.560   0.989
  237   1HD1  LEU  31          1HD1      LEU  31  -2.912  -8.596   0.983
  238   2HD1  LEU  31          2HD1      LEU  31  -2.920  -6.956   0.332
  239   3HD1  LEU  31          3HD1      LEU  31  -2.884  -8.339  -0.762
  240   1HD2  LEU  31          1HD2      LEU  31  -4.579  -5.916   0.685
  241   2HD2  LEU  31          2HD2      LEU  31  -6.222  -6.536   0.844
  242   3HD2  LEU  31          3HD2      LEU  31  -5.560  -6.193  -0.754
  243    H    SER  32           H        SER  32  -8.620  -9.561   0.003
  244    HA   SER  32           HA       SER  32  -9.808  -9.510  -2.742
  245   1HB   SER  32          2HB       SER  32 -10.815 -10.502  -0.086
  246   2HB   SER  32          1HB       SER  32 -11.968  -9.988  -1.314
  247    HG   SER  32           HG       SER  32 -11.150 -12.298  -1.243
  248    H    VAL  33           H        VAL  33 -10.230  -7.456  -3.365
  249    HA   VAL  33           HA       VAL  33 -11.468  -5.595  -1.380
  250    HB   VAL  33           HB       VAL  33 -10.162  -3.736  -2.516
  251   1HG1  VAL  33          1HG1      VAL  33  -8.664  -5.905  -1.020
  252   2HG1  VAL  33          2HG1      VAL  33  -9.482  -4.506  -0.324
  253   3HG1  VAL  33          3HG1      VAL  33  -8.030  -4.283  -1.301
  254   1HG2  VAL  33          1HG2      VAL  33  -9.579  -5.108  -4.545
  255   2HG2  VAL  33          2HG2      VAL  33  -8.479  -6.048  -3.536
  256   3HG2  VAL  33          3HG2      VAL  33  -8.184  -4.330  -3.797
  257    HA   PRO  34           HA       PRO  34 -14.400  -4.851  -4.567
  258   1HB   PRO  34          2HB       PRO  34 -15.176  -2.296  -3.904
  259   2HB   PRO  34          1HB       PRO  34 -15.671  -3.740  -3.004
  260   1HG   PRO  34          2HG       PRO  34 -13.650  -1.668  -2.269
  261   2HG   PRO  34          1HG       PRO  34 -14.643  -2.691  -1.217
  262   1HD   PRO  34          2HD       PRO  34 -11.921  -3.115  -1.813
  263   2HD   PRO  34          1HD       PRO  34 -13.023  -4.314  -1.102
  264    H    GLU  35           H        GLU  35 -14.678  -3.735  -6.580
  265    HA   GLU  35           HA       GLU  35 -12.302  -2.694  -7.811
  266   1HB   GLU  35          2HB       GLU  35 -15.191  -2.899  -8.619
  267   2HB   GLU  35          1HB       GLU  35 -14.091  -1.923  -9.592
  268   1HG   GLU  35          2HG       GLU  35 -13.497  -3.844 -10.622
  269   2HG   GLU  35          1HG       GLU  35 -12.652  -4.262  -9.130
  270    H    SER  36           H        SER  36 -11.709  -1.012  -6.342
  271    HA   SER  36           HA       SER  36 -12.419   1.632  -7.133
  272   1HB   SER  36          2HB       SER  36 -13.540   2.364  -4.999
  273   2HB   SER  36          1HB       SER  36 -14.528   1.283  -5.975
  274    HG   SER  36           HG       SER  36 -14.475  -0.103  -4.400
  275    H    THR  37           H        THR  37 -11.261  -0.442  -4.478
  276    HA   THR  37           HA       THR  37  -9.564   1.506  -3.230
  277    HB   THR  37           HB       THR  37  -8.354  -0.522  -2.318
  278    HG1  THR  37           HG1      THR  37  -8.548  -2.181  -3.588
  279   1HG2  THR  37          1HG2      THR  37 -11.252  -1.112  -1.998
  280   2HG2  THR  37          2HG2      THR  37 -10.726   0.523  -1.595
  281   3HG2  THR  37          3HG2      THR  37 -10.010  -0.861  -0.770
  282    HA   PRO  38           HA       PRO  38  -6.359   1.732  -6.261
  283   1HB   PRO  38          2HB       PRO  38  -4.521   3.047  -4.698
  284   2HB   PRO  38          1HB       PRO  38  -5.926   3.836  -5.435
  285   1HG   PRO  38          2HG       PRO  38  -5.485   3.068  -2.587
  286   2HG   PRO  38          1HG       PRO  38  -6.500   4.354  -3.259
  287   1HD   PRO  38          2HD       PRO  38  -7.410   1.846  -2.316
  288   2HD   PRO  38          1HD       PRO  38  -8.349   3.001  -3.286
  289    H    PHE  39           H        PHE  39  -4.257   0.825  -6.704
  290    HA   PHE  39           HA       PHE  39  -3.662  -1.647  -5.369
  291   1HB   PHE  39          2HB       PHE  39  -3.067  -0.820  -7.799
  292   2HB   PHE  39          1HB       PHE  39  -1.604  -0.212  -7.024
  293    HD1  PHE  39           HD1      PHE  39  -3.713  -3.313  -6.694
  294    HD2  PHE  39           HD2      PHE  39   0.211  -1.653  -7.254
  295    HE1  PHE  39           HE1      PHE  39  -2.750  -5.597  -6.718
  296    HE2  PHE  39           HE2      PHE  39   1.172  -3.938  -7.277
  297    HZ   PHE  39           HZ       PHE  39  -0.307  -5.910  -7.009
  298    H    THR  40           H        THR  40  -2.751   1.634  -4.697
  299    HA   THR  40           HA       THR  40  -0.262   1.220  -3.354
  300    HB   THR  40           HB       THR  40  -0.920   3.321  -2.073
  301    HG1  THR  40           HG1      THR  40  -2.926   3.886  -2.129
  302   1HG2  THR  40          1HG2      THR  40  -1.463   4.327  -4.674
  303   2HG2  THR  40          2HG2      THR  40  -0.386   2.945  -4.865
  304   3HG2  THR  40          3HG2      THR  40   0.085   4.290  -3.829
  305    H    ALA  41           H        ALA  41  -3.634   1.107  -2.196
  306    HA   ALA  41           HA       ALA  41  -2.900   0.418   0.533
  307   1HB   ALA  41          1HB       ALA  41  -5.166   0.470   0.975
  308   2HB   ALA  41          2HB       ALA  41  -5.591  -0.281  -0.564
  309   3HB   ALA  41          3HB       ALA  41  -5.151   1.426  -0.507
  310    H    VAL  42           H        VAL  42  -3.917  -1.400  -2.362
  311    HA   VAL  42           HA       VAL  42  -4.169  -3.969  -1.125
  312    HB   VAL  42           HB       VAL  42  -3.322  -3.271  -3.959
  313   1HG1  VAL  42          1HG1      VAL  42  -3.150  -5.738  -2.733
  314   2HG1  VAL  42          2HG1      VAL  42  -3.339  -5.482  -4.467
  315   3HG1  VAL  42          3HG1      VAL  42  -4.755  -5.792  -3.461
  316   1HG2  VAL  42          1HG2      VAL  42  -6.029  -4.305  -3.451
  317   2HG2  VAL  42          2HG2      VAL  42  -5.517  -2.935  -4.436
  318   3HG2  VAL  42          3HG2      VAL  42  -5.724  -2.741  -2.696
  319    H    LEU  43           H        LEU  43  -1.382  -2.466  -2.795
  320    HA   LEU  43           HA       LEU  43   0.476  -4.590  -2.308
  321   1HB   LEU  43          2HB       LEU  43   0.706  -2.591  -3.919
  322   2HB   LEU  43          1HB       LEU  43   1.219  -1.664  -2.510
  323    HG   LEU  43           HG       LEU  43   2.577  -4.259  -2.746
  324   1HD1  LEU  43          1HD1      LEU  43   3.868  -3.822  -4.685
  325   2HD1  LEU  43          2HD1      LEU  43   3.311  -2.151  -4.781
  326   3HD1  LEU  43          3HD1      LEU  43   2.211  -3.471  -5.176
  327   1HD2  LEU  43          1HD2      LEU  43   3.585  -2.844  -1.216
  328   2HD2  LEU  43          2HD2      LEU  43   3.202  -1.394  -2.146
  329   3HD2  LEU  43          3HD2      LEU  43   4.530  -2.440  -2.649
  330    H    LYS  44           H        LYS  44  -0.481  -1.764  -0.402
  331    HA   LYS  44           HA       LYS  44   1.565  -1.886   1.587
  332   1HB   LYS  44          2HB       LYS  44  -0.402  -0.140   1.094
  333   2HB   LYS  44          1HB       LYS  44  -1.200  -1.065   2.366
  334   1HG   LYS  44          2HG       LYS  44   0.442  -0.527   3.960
  335   2HG   LYS  44          1HG       LYS  44   1.624  -0.086   2.727
  336   1HD   LYS  44          2HD       LYS  44  -0.462   1.656   2.214
  337   2HD   LYS  44          1HD       LYS  44  -0.468   1.550   3.975
  338   1HE   LYS  44          2HE       LYS  44   2.176   1.787   3.605
  339   2HE   LYS  44          1HE       LYS  44   1.633   2.621   2.149
  340   1HZ   LYS  44          1HZ       LYS  44   0.771   3.246   4.922
  341   2HZ   LYS  44          2HZ       LYS  44   0.256   4.053   3.517
  342   3HZ   LYS  44          3HZ       LYS  44   1.880   4.145   4.007
  343    H    PHE  45           H        PHE  45  -1.695  -3.355   1.498
  344    HA   PHE  45           HA       PHE  45  -1.488  -4.650   4.056
  345   1HB   PHE  45          2HB       PHE  45  -3.501  -4.277   2.243
  346   2HB   PHE  45          1HB       PHE  45  -3.139  -5.986   1.998
  347    HD1  PHE  45           HD1      PHE  45  -4.155  -7.544   3.397
  348    HD2  PHE  45           HD2      PHE  45  -3.605  -3.521   4.795
  349    HE1  PHE  45           HE1      PHE  45  -5.368  -8.104   5.485
  350    HE2  PHE  45           HE2      PHE  45  -4.819  -4.080   6.883
  351    HZ   PHE  45           HZ       PHE  45  -5.700  -6.372   7.228
  352    H    ALA  46           H        ALA  46  -0.848  -5.794   0.728
  353    HA   ALA  46           HA       ALA  46  -0.153  -8.481   1.407
  354   1HB   ALA  46          1HB       ALA  46   0.696  -8.658  -0.789
  355   2HB   ALA  46          2HB       ALA  46   1.162  -6.958  -0.842
  356   3HB   ALA  46          3HB       ALA  46  -0.541  -7.409  -0.929
  357    H    ALA  47           H        ALA  47   1.891  -5.560   1.048
  358    HA   ALA  47           HA       ALA  47   4.372  -6.861   1.697
  359   1HB   ALA  47          1HB       ALA  47   5.141  -4.496   2.202
  360   2HB   ALA  47          2HB       ALA  47   3.491  -3.968   1.875
  361   3HB   ALA  47          3HB       ALA  47   4.445  -4.721   0.598
  362    H    GLU  48           H        GLU  48   1.884  -5.279   3.673
  363    HA   GLU  48           HA       GLU  48   3.283  -5.188   6.152
  364   1HB   GLU  48          2HB       GLU  48   1.101  -4.069   5.737
  365   2HB   GLU  48          1HB       GLU  48   0.317  -5.647   5.687
  366   1HG   GLU  48          2HG       GLU  48   1.930  -5.418   8.080
  367   2HG   GLU  48          1HG       GLU  48   0.808  -4.061   7.971
  368    H    GLU  49           H        GLU  49   1.232  -7.760   4.745
  369    HA   GLU  49           HA       GLU  49   1.623  -9.575   6.977
  370   1HB   GLU  49          2HB       GLU  49   0.451  -9.783   4.222
  371   2HB   GLU  49          1HB       GLU  49   0.827 -11.263   5.103
  372   1HG   GLU  49          2HG       GLU  49  -1.236 -10.987   6.019
  373   2HG   GLU  49          1HG       GLU  49  -0.437  -9.794   7.042
  374    H    PHE  50           H        PHE  50   3.362  -8.903   3.990
  375    HA   PHE  50           HA       PHE  50   4.977 -11.346   4.136
  376   1HB   PHE  50          2HB       PHE  50   4.730  -9.025   2.299
  377   2HB   PHE  50          1HB       PHE  50   6.315  -9.794   2.370
  378    HD1  PHE  50           HD1      PHE  50   6.091 -12.529   2.514
  379    HD2  PHE  50           HD2      PHE  50   3.302  -9.844   0.647
  380    HE1  PHE  50           HE1      PHE  50   5.259 -14.380   1.090
  381    HE2  PHE  50           HE2      PHE  50   2.472 -11.698  -0.775
  382    HZ   PHE  50           HZ       PHE  50   3.450 -13.966  -0.553
  383    H    LYS  51           H        LYS  51   5.032  -8.587   5.991
  384    HA   LYS  51           HA       LYS  51   6.620  -7.711   7.466
  385   1HB   LYS  51          2HB       LYS  51   7.526 -10.408   6.887
  386   2HB   LYS  51          1HB       LYS  51   8.900  -9.334   7.132
  387   1HG   LYS  51          2HG       LYS  51   8.551  -9.500   9.349
  388   2HG   LYS  51          1HG       LYS  51   7.033  -8.629   9.123
  389   1HD   LYS  51          2HD       LYS  51   6.189 -11.051   8.372
  390   2HD   LYS  51          1HD       LYS  51   7.511 -11.564   9.420
  391   1HE   LYS  51          2HE       LYS  51   6.535 -10.648  11.329
  392   2HE   LYS  51          1HE       LYS  51   5.587  -9.482  10.407
  393   1HZ   LYS  51          1HZ       LYS  51   4.100 -11.137  11.153
  394   2HZ   LYS  51          2HZ       LYS  51   5.125 -12.399  10.661
  395   3HZ   LYS  51          3HZ       LYS  51   4.338 -11.437   9.501
  396    H    VAL  52           H        VAL  52   6.478  -6.768   4.724
  397    HA   VAL  52           HA       VAL  52   9.272  -5.746   4.450
  398    HB   VAL  52           HB       VAL  52   8.861  -5.697   1.944
  399   1HG1  VAL  52          1HG1      VAL  52   8.732  -8.519   2.992
  400   2HG1  VAL  52          2HG1      VAL  52  10.132  -7.499   3.325
  401   3HG1  VAL  52          3HG1      VAL  52   9.693  -7.877   1.660
  402   1HG2  VAL  52          1HG2      VAL  52   6.320  -6.046   2.304
  403   2HG2  VAL  52          2HG2      VAL  52   6.718  -7.749   2.516
  404   3HG2  VAL  52          3HG2      VAL  52   7.083  -6.942   0.992
  405    HA   PRO  53           HA       PRO  53   7.355  -1.794   4.368
  406   1HB   PRO  53          2HB       PRO  53   9.280  -0.394   2.989
  407   2HB   PRO  53          1HB       PRO  53   9.450  -0.899   4.678
  408   1HG   PRO  53          2HG       PRO  53  10.739  -2.036   2.240
  409   2HG   PRO  53          1HG       PRO  53  11.312  -2.040   3.917
  410   1HD   PRO  53          2HD       PRO  53  10.112  -4.222   2.578
  411   2HD   PRO  53          1HD       PRO  53  10.367  -4.089   4.331
  412    H    ALA  54           H        ALA  54   5.736  -1.017   3.093
  413    HA   ALA  54           HA       ALA  54   5.305  -1.902   0.395
  414   1HB   ALA  54          1HB       ALA  54   3.748   0.377   0.678
  415   2HB   ALA  54          2HB       ALA  54   3.943  -0.185   2.339
  416   3HB   ALA  54          3HB       ALA  54   3.260  -1.259   1.120
  417    H    ALA  55           H        ALA  55   6.751   1.032   1.752
  418    HA   ALA  55           HA       ALA  55   6.838   2.606  -0.625
  419   1HB   ALA  55          1HB       ALA  55   8.664   3.834   0.492
  420   2HB   ALA  55          2HB       ALA  55   8.815   2.535   1.676
  421   3HB   ALA  55          3HB       ALA  55   7.346   3.509   1.619
  422    H    THR  56           H        THR  56   9.061   0.112   0.617
  423    HA   THR  56           HA       THR  56  10.644   0.351  -1.908
  424    HB   THR  56           HB       THR  56  11.505  -1.224   0.522
  425    HG1  THR  56           HG1      THR  56  11.696   0.577   1.554
  426   1HG2  THR  56          1HG2      THR  56  12.910   0.135  -1.789
  427   2HG2  THR  56          2HG2      THR  56  12.838  -1.593  -1.442
  428   3HG2  THR  56          3HG2      THR  56  13.762  -0.520  -0.390
  429    H    SER  57           H        SER  57   8.085  -0.966  -1.907
  430    HA   SER  57           HA       SER  57   8.975  -3.739  -2.560
  431   1HB   SER  57          2HB       SER  57   6.768  -2.888  -0.740
  432   2HB   SER  57          1HB       SER  57   6.492  -4.294  -1.760
  433    HG   SER  57           HG       SER  57   7.629  -4.424   0.464
  434    H    ALA  58           H        ALA  58   7.693  -4.773  -4.184
  435    HA   ALA  58           HA       ALA  58   5.700  -3.142  -5.647
  436   1HB   ALA  58          1HB       ALA  58   8.407  -3.920  -6.675
  437   2HB   ALA  58          2HB       ALA  58   7.493  -2.437  -6.947
  438   3HB   ALA  58          3HB       ALA  58   7.045  -3.916  -7.797
  439    H    ILE  59           H        ILE  59   4.725  -4.548  -7.482
  440    HA   ILE  59           HA       ILE  59   4.843  -7.443  -6.735
  441    HB   ILE  59           HB       ILE  59   2.435  -5.654  -7.028
  442   1HG1  ILE  59          2HG1      ILE  59   2.923  -7.916  -5.086
  443   2HG1  ILE  59          1HG1      ILE  59   3.594  -6.309  -4.808
  444   1HG2  ILE  59          1HG2      ILE  59   2.597  -8.098  -8.353
  445   2HG2  ILE  59          2HG2      ILE  59   1.110  -7.284  -7.873
  446   3HG2  ILE  59          3HG2      ILE  59   1.821  -8.511  -6.826
  447   1HD1  ILE  59          1HD1      ILE  59   0.653  -6.907  -5.253
  448   2HD1  ILE  59          2HD1      ILE  59   1.350  -5.328  -4.893
  449   3HD1  ILE  59          3HD1      ILE  59   1.397  -6.608  -3.682
  450    H    ILE  60           H        ILE  60   5.292  -8.691  -8.475
  451    HA   ILE  60           HA       ILE  60   4.861  -7.530 -11.192
  452    HB   ILE  60           HB       ILE  60   6.513  -9.186 -11.976
  453   1HG1  ILE  60          2HG1      ILE  60   7.466  -9.978  -9.329
  454   2HG1  ILE  60          1HG1      ILE  60   5.829 -10.552  -9.637
  455   1HG2  ILE  60          1HG2      ILE  60   7.886  -8.045  -9.600
  456   2HG2  ILE  60          2HG2      ILE  60   7.043  -6.899 -10.640
  457   3HG2  ILE  60          3HG2      ILE  60   8.309  -7.930 -11.308
  458   1HD1  ILE  60          1HD1      ILE  60   6.729 -11.328 -11.928
  459   2HD1  ILE  60          2HD1      ILE  60   7.217 -12.259 -10.513
  460   3HD1  ILE  60          3HD1      ILE  60   8.332 -11.098 -11.231
  461    H    THR  61           H        THR  61   4.353  -9.331 -12.897
  462    HA   THR  61           HA       THR  61   2.107 -10.957 -11.801
  463    HB   THR  61           HB       THR  61   1.338 -11.112 -14.146
  464    HG1  THR  61           HG1      THR  61   2.585 -10.525 -15.733
  465   1HG2  THR  61          1HG2      THR  61   1.993  -8.215 -13.759
  466   2HG2  THR  61          2HG2      THR  61   1.006  -9.031 -12.549
  467   3HG2  THR  61          3HG2      THR  61   0.467  -8.966 -14.226
  468    H    ASN  62           H        ASN  62   1.780 -13.118 -13.015
  469    HA   ASN  62           HA       ASN  62   4.114 -14.767 -12.618
  470   1HB   ASN  62          2HB       ASN  62   1.382 -15.214 -12.842
  471   2HB   ASN  62          1HB       ASN  62   2.033 -15.951 -14.307
  472   1HD2  ASN  62          1HD2      ASN  62   2.794 -15.816 -10.769
  473   2HD2  ASN  62          2HD2      ASN  62   3.278 -17.439 -10.671
  474    H    ASP  63           H        ASP  63   2.841 -13.055 -15.390
  475    HA   ASP  63           HA       ASP  63   4.328 -14.609 -17.372
  476   1HB   ASP  63          2HB       ASP  63   2.409 -12.398 -17.367
  477   2HB   ASP  63          1HB       ASP  63   3.714 -12.145 -18.524
  478    H    GLY  64           H        GLY  64   4.631 -11.309 -16.008
  479   1HA   GLY  64          2HA       GLY  64   7.200 -11.031 -15.348
  480   2HA   GLY  64          1HA       GLY  64   7.383 -11.116 -17.100
  481    H    VAL  65           H        VAL  65   4.958  -9.504 -15.016
  482    HA   VAL  65           HA       VAL  65   5.663  -6.925 -16.366
  483    HB   VAL  65           HB       VAL  65   2.920  -7.830 -15.424
  484   1HG1  VAL  65          1HG1      VAL  65   2.110  -5.754 -16.045
  485   2HG1  VAL  65          2HG1      VAL  65   3.397  -5.486 -17.220
  486   3HG1  VAL  65          3HG1      VAL  65   3.720  -5.288 -15.498
  487   1HG2  VAL  65          1HG2      VAL  65   2.463  -7.690 -17.949
  488   2HG2  VAL  65          2HG2      VAL  65   3.424  -9.065 -17.402
  489   3HG2  VAL  65          3HG2      VAL  65   4.215  -7.680 -18.155
  490    H    GLY  66           H        GLY  66   6.541  -5.557 -14.901
  491   1HA   GLY  66          2HA       GLY  66   6.321  -6.012 -12.041
  492   2HA   GLY  66          1HA       GLY  66   7.176  -4.680 -12.815
  493    H    VAL  67           H        VAL  67   4.058  -5.787 -11.658
  494    HA   VAL  67           HA       VAL  67   2.564  -3.413 -12.358
  495    HB   VAL  67           HB       VAL  67   1.972  -5.340 -10.088
  496   1HG1  VAL  67          1HG1      VAL  67  -0.270  -4.308 -11.613
  497   2HG1  VAL  67          2HG1      VAL  67   0.701  -2.990 -10.960
  498   3HG1  VAL  67          3HG1      VAL  67   0.034  -4.213  -9.879
  499   1HG2  VAL  67          1HG2      VAL  67   0.606  -6.567 -11.774
  500   2HG2  VAL  67          2HG2      VAL  67   2.327  -6.612 -12.156
  501   3HG2  VAL  67          3HG2      VAL  67   1.259  -5.519 -13.033
  502    H    ASN  68           H        ASN  68   2.504  -1.476 -11.338
  503    HA   ASN  68           HA       ASN  68   3.926  -1.225  -8.719
  504   1HB   ASN  68          2HB       ASN  68   3.689   0.558 -11.118
  505   2HB   ASN  68          1HB       ASN  68   3.891   1.303  -9.533
  506   1HD2  ASN  68          1HD2      ASN  68   6.035   1.504  -8.840
  507   2HD2  ASN  68          2HD2      ASN  68   7.337   0.593  -9.438
  508    HA   PRO  69           HA       PRO  69   0.216   0.217  -6.850
  509   1HB   PRO  69          2HB       PRO  69   1.242   2.004  -5.027
  510   2HB   PRO  69          1HB       PRO  69   1.377   0.245  -4.858
  511   1HG   PRO  69          2HG       PRO  69   3.469   2.222  -5.631
  512   2HG   PRO  69          1HG       PRO  69   3.653   0.635  -4.867
  513   1HD   PRO  69          2HD       PRO  69   4.091   1.230  -7.604
  514   2HD   PRO  69          1HD       PRO  69   3.977  -0.392  -6.889
  515    H    ALA  70           H        ALA  70   0.006   1.375  -9.163
  516    HA   ALA  70           HA       ALA  70  -0.646   4.217  -8.600
  517   1HB   ALA  70          1HB       ALA  70   0.994   5.034  -9.909
  518   2HB   ALA  70          2HB       ALA  70   0.409   4.069 -11.264
  519   3HB   ALA  70          3HB       ALA  70   1.602   3.398 -10.154
  520    H    GLN  71           H        GLN  71  -2.297   1.815  -8.929
  521    HA   GLN  71           HA       GLN  71  -4.098   2.837 -11.013
  522   1HB   GLN  71          2HB       GLN  71  -4.241   0.287 -11.836
  523   2HB   GLN  71          1HB       GLN  71  -3.133   1.443 -12.570
  524   1HG   GLN  71          2HG       GLN  71  -1.374   0.668 -10.925
  525   2HG   GLN  71          1HG       GLN  71  -2.485  -0.611 -10.439
  526   1HE2  GLN  71          1HE2      GLN  71   0.187  -0.386 -12.183
  527   2HE2  GLN  71          2HE2      GLN  71  -0.161  -1.412 -13.488
  528    HA   PRO  72           HA       PRO  72  -7.142   1.207  -8.297
  529   1HB   PRO  72          2HB       PRO  72  -9.170   0.611 -10.058
  530   2HB   PRO  72          1HB       PRO  72  -8.737   2.260  -9.577
  531   1HG   PRO  72          2HG       PRO  72  -8.183   0.847 -12.145
  532   2HG   PRO  72          1HG       PRO  72  -8.369   2.581 -11.835
  533   1HD   PRO  72          2HD       PRO  72  -5.916   1.226 -12.197
  534   2HD   PRO  72          1HD       PRO  72  -6.111   2.864 -11.536
  535    H    ALA  73           H        ALA  73  -8.143  -0.746  -7.546
  536    HA   ALA  73           HA       ALA  73  -6.792  -3.187  -8.115
  537   1HB   ALA  73          1HB       ALA  73  -8.521  -2.343  -6.164
  538   2HB   ALA  73          2HB       ALA  73  -8.018  -4.018  -6.386
  539   3HB   ALA  73          3HB       ALA  73  -9.542  -3.456  -7.072
  540    H    GLY  74           H        GLY  74  -9.891  -1.906  -9.321
  541   1HA   GLY  74          2HA       GLY  74 -10.817  -4.203 -10.695
  542   2HA   GLY  74          1HA       GLY  74 -11.182  -2.544 -11.172
  543    H    ASN  75           H        ASN  75  -8.633  -1.603 -11.824
  544    HA   ASN  75           HA       ASN  75  -8.259  -2.724 -14.460
  545   1HB   ASN  75          2HB       ASN  75  -7.793  -0.316 -13.716
  546   2HB   ASN  75          1HB       ASN  75  -6.302  -0.933 -13.005
  547   1HD2  ASN  75          1HD2      ASN  75  -4.535  -1.274 -14.411
  548   2HD2  ASN  75          2HD2      ASN  75  -4.626  -1.132 -16.100
  549    H    ILE  76           H        ILE  76  -6.580  -3.124 -11.360
  550    HA   ILE  76           HA       ILE  76  -4.255  -4.476 -12.309
  551    HB   ILE  76           HB       ILE  76  -5.762  -4.729  -9.686
  552   1HG1  ILE  76          2HG1      ILE  76  -4.710  -2.498 -10.368
  553   2HG1  ILE  76          1HG1      ILE  76  -4.169  -3.164  -8.830
  554   1HG2  ILE  76          1HG2      ILE  76  -4.408  -6.437  -9.136
  555   2HG2  ILE  76          2HG2      ILE  76  -3.003  -5.411  -9.417
  556   3HG2  ILE  76          3HG2      ILE  76  -3.663  -6.380 -10.733
  557   1HD1  ILE  76          1HD1      ILE  76  -2.299  -2.307 -10.284
  558   2HD1  ILE  76          2HD1      ILE  76  -2.698  -3.567 -11.450
  559   3HD1  ILE  76          3HD1      ILE  76  -2.133  -4.004  -9.838
  560    H    PHE  77           H        PHE  77  -7.453  -5.740 -11.336
  561    HA   PHE  77           HA       PHE  77  -6.747  -8.509 -11.892
  562   1HB   PHE  77          2HB       PHE  77  -8.601  -7.590 -10.318
  563   2HB   PHE  77          1HB       PHE  77  -9.566  -7.442 -11.786
  564    HD1  PHE  77           HD1      PHE  77 -10.134  -9.454 -13.131
  565    HD2  PHE  77           HD2      PHE  77  -8.065  -9.747  -9.376
  566    HE1  PHE  77           HE1      PHE  77 -10.657 -11.876 -13.030
  567    HE2  PHE  77           HE2      PHE  77  -8.591 -12.169  -9.278
  568    HZ   PHE  77           HZ       PHE  77  -9.886 -13.232 -11.104
  569    H    LEU  78           H        LEU  78  -8.452  -5.933 -13.660
  570    HA   LEU  78           HA       LEU  78  -9.350  -7.545 -15.855
  571   1HB   LEU  78          2HB       LEU  78  -8.819  -4.596 -15.512
  572   2HB   LEU  78          1HB       LEU  78  -9.328  -5.255 -17.067
  573    HG   LEU  78           HG       LEU  78 -10.834  -5.805 -14.503
  574   1HD1  LEU  78          1HD1      LEU  78 -11.705  -3.767 -16.535
  575   2HD1  LEU  78          2HD1      LEU  78 -10.595  -3.305 -15.244
  576   3HD1  LEU  78          3HD1      LEU  78 -12.194  -3.934 -14.849
  577   1HD2  LEU  78          1HD2      LEU  78 -12.200  -5.705 -17.121
  578   2HD2  LEU  78          2HD2      LEU  78 -12.331  -6.898 -15.829
  579   3HD2  LEU  78          3HD2      LEU  78 -10.997  -6.987 -16.978
  580    H    LYS  79           H        LYS  79  -6.303  -5.813 -15.272
  581    HA   LYS  79           HA       LYS  79  -5.319  -6.569 -17.963
  582   1HB   LYS  79          2HB       LYS  79  -4.911  -4.341 -16.375
  583   2HB   LYS  79          1HB       LYS  79  -3.420  -5.257 -16.151
  584   1HG   LYS  79          2HG       LYS  79  -3.198  -5.449 -18.623
  585   2HG   LYS  79          1HG       LYS  79  -4.639  -4.449 -18.808
  586   1HD   LYS  79          2HD       LYS  79  -3.411  -2.581 -18.564
  587   2HD   LYS  79          1HD       LYS  79  -2.822  -3.145 -16.999
  588   1HE   LYS  79          2HE       LYS  79  -1.229  -4.654 -18.400
  589   2HE   LYS  79          1HE       LYS  79  -1.611  -3.558 -19.727
  590   1HZ   LYS  79          1HZ       LYS  79   0.300  -3.160 -17.840
  591   2HZ   LYS  79          2HZ       LYS  79  -0.976  -2.185 -17.287
  592   3HZ   LYS  79          3HZ       LYS  79  -0.351  -1.965 -18.851
  593    H    HIS  80           H        HIS  80  -4.118  -6.876 -14.589
  594    HA   HIS  80           HA       HIS  80  -2.257  -8.991 -15.431
  595   1HB   HIS  80          2HB       HIS  80  -2.806  -8.107 -12.591
  596   2HB   HIS  80          1HB       HIS  80  -1.344  -8.854 -13.235
  597    HD1  HIS  80           HD1      HIS  80  -0.341  -7.275 -15.407
  598    HD2  HIS  80           HD2      HIS  80  -2.456  -5.388 -12.350
  599    HE1  HIS  80           HE1      HIS  80   0.252  -4.817 -15.538
  600    H    GLY  81           H        GLY  81  -4.858  -8.823 -12.949
  601   1HA   GLY  81          2HA       GLY  81  -6.620 -10.626 -13.097
  602   2HA   GLY  81          1HA       GLY  81  -5.299 -11.750 -13.417
  603    H    SER  82           H        SER  82  -5.168 -13.037 -11.635
  604    HA   SER  82           HA       SER  82  -5.176 -11.710  -8.952
  605   1HB   SER  82          2HB       SER  82  -5.880 -13.938  -8.064
  606   2HB   SER  82          1HB       SER  82  -7.048 -13.242  -9.180
  607    HG   SER  82           HG       SER  82  -6.763 -15.310  -9.848
  608    H    GLU  83           H        GLU  83  -3.650 -14.333 -10.855
  609    HA   GLU  83           HA       GLU  83  -1.699 -15.044  -8.895
  610   1HB   GLU  83          2HB       GLU  83  -2.360 -16.255 -11.105
  611   2HB   GLU  83          1HB       GLU  83  -1.155 -15.210 -11.856
  612   1HG   GLU  83          2HG       GLU  83  -0.097 -17.314 -11.215
  613   2HG   GLU  83          1HG       GLU  83   0.526 -16.020 -10.192
  614    H    LEU  84           H        LEU  84  -0.371 -13.558  -8.015
  615    HA   LEU  84           HA       LEU  84   1.312 -11.901  -9.836
  616   1HB   LEU  84          2HB       LEU  84  -0.275 -10.933  -7.444
  617   2HB   LEU  84          1HB       LEU  84   1.076 -10.025  -8.120
  618    HG   LEU  84           HG       LEU  84  -0.877 -10.939 -10.129
  619   1HD1  LEU  84          1HD1      LEU  84  -2.731  -9.739  -9.470
  620   2HD1  LEU  84          2HD1      LEU  84  -1.786  -8.595  -8.518
  621   3HD1  LEU  84          3HD1      LEU  84  -2.126 -10.204  -7.881
  622   1HD2  LEU  84          1HD2      LEU  84   1.137  -9.235 -10.222
  623   2HD2  LEU  84          2HD2      LEU  84  -0.058  -8.099  -9.595
  624   3HD2  LEU  84          3HD2      LEU  84  -0.335  -8.908 -11.138
  625    H    ARG  85           H        ARG  85   3.210 -10.948  -8.537
  626    HA   ARG  85           HA       ARG  85   4.019 -12.742  -6.288
  627   1HB   ARG  85          2HB       ARG  85   5.394 -12.251  -8.889
  628   2HB   ARG  85          1HB       ARG  85   6.407 -12.356  -7.449
  629   1HG   ARG  85          2HG       ARG  85   5.421 -14.534  -6.889
  630   2HG   ARG  85          1HG       ARG  85   4.363 -14.429  -8.296
  631   1HD   ARG  85          2HD       ARG  85   5.988 -15.400  -9.515
  632   2HD   ARG  85          1HD       ARG  85   6.965 -13.954  -9.270
  633    HE   ARG  85           HE       ARG  85   8.163 -15.094  -7.546
  634   1HH1  ARG  85          2HH1      ARG  85   6.000 -16.476  -6.101
  635   2HH1  ARG  85          1HH1      ARG  85   6.242 -18.137  -6.524
  636   1HH2  ARG  85          1HH2      ARG  85   8.283 -17.420  -9.245
  637   2HH2  ARG  85          2HH2      ARG  85   7.540 -18.674  -8.310
  638    H    LEU  86           H        LEU  86   5.739 -11.771  -4.920
  639    HA   LEU  86           HA       LEU  86   5.566  -8.785  -4.943
  640   1HB   LEU  86          2HB       LEU  86   4.757 -10.235  -2.924
  641   2HB   LEU  86          1HB       LEU  86   6.477 -10.404  -2.574
  642    HG   LEU  86           HG       LEU  86   5.917  -7.649  -3.181
  643   1HD1  LEU  86          1HD1      LEU  86   3.772  -7.536  -2.405
  644   2HD1  LEU  86          2HD1      LEU  86   4.557  -7.565  -0.826
  645   3HD1  LEU  86          3HD1      LEU  86   3.908  -9.052  -1.515
  646   1HD2  LEU  86          1HD2      LEU  86   7.816  -8.408  -1.858
  647   2HD2  LEU  86          2HD2      LEU  86   6.737  -9.121  -0.658
  648   3HD2  LEU  86          3HD2      LEU  86   6.803  -7.369  -0.853
  649    H    ILE  87           H        ILE  87   7.398  -7.642  -5.286
  650    HA   ILE  87           HA       ILE  87  10.035  -9.023  -4.980
  651    HB   ILE  87           HB       ILE  87  10.811  -7.690  -6.973
  652   1HG1  ILE  87          2HG1      ILE  87   7.982  -7.337  -7.843
  653   2HG1  ILE  87          1HG1      ILE  87   8.579  -6.202  -6.633
  654   1HG2  ILE  87          1HG2      ILE  87   9.821 -10.121  -6.954
  655   2HG2  ILE  87          2HG2      ILE  87  10.106  -9.311  -8.494
  656   3HG2  ILE  87          3HG2      ILE  87   8.477  -9.379  -7.821
  657   1HD1  ILE  87          1HD1      ILE  87   9.436  -5.055  -8.391
  658   2HD1  ILE  87          2HD1      ILE  87   9.271  -6.432  -9.479
  659   3HD1  ILE  87          3HD1      ILE  87  10.676  -6.308  -8.423
  660    HA   PRO  88           HA       PRO  88  11.220  -5.449  -2.713
  661   1HB   PRO  88          2HB       PRO  88  13.929  -5.447  -3.203
  662   2HB   PRO  88          1HB       PRO  88  13.128  -6.593  -2.114
  663   1HG   PRO  88          2HG       PRO  88  14.204  -7.050  -4.857
  664   2HG   PRO  88          1HG       PRO  88  13.989  -8.203  -3.529
  665   1HD   PRO  88          2HD       PRO  88  12.291  -7.928  -5.776
  666   2HD   PRO  88          1HD       PRO  88  11.920  -8.829  -4.291
  667    H    ARG  89           H        ARG  89  10.106  -3.882  -4.096
  668    HA   ARG  89           HA       ARG  89  10.076  -1.854  -5.262
  669   1HB   ARG  89          2HB       ARG  89  12.429  -1.666  -4.129
  670   2HB   ARG  89          1HB       ARG  89  13.042  -2.036  -5.741
  671   1HG   ARG  89          2HG       ARG  89  12.935   0.328  -5.694
  672   2HG   ARG  89          1HG       ARG  89  11.480  -0.152  -6.566
  673   1HD   ARG  89          2HD       ARG  89  10.513  -0.188  -4.043
  674   2HD   ARG  89          1HD       ARG  89  11.756   1.050  -3.861
  675    HE   ARG  89           HE       ARG  89  10.541   2.448  -5.382
  676   1HH1  ARG  89          1HH2      ARG  89   8.247   1.134  -3.816
  677   2HH1  ARG  89          2HH2      ARG  89   7.167   0.722  -5.106
  678   1HH2  ARG  89          2HH1      ARG  89   9.559   1.126  -7.593
  679   2HH2  ARG  89          1HH1      ARG  89   7.912   0.716  -7.248
  680    H    ASP  90           H        ASP  90   9.805  -1.276  -7.420
  681    HA   ASP  90           HA       ASP  90  10.401  -3.412  -9.405
  682   1HB   ASP  90          2HB       ASP  90   8.100  -1.948  -8.919
  683   2HB   ASP  90          1HB       ASP  90   8.798  -1.119 -10.310
  684    H    ARG  91           H        ARG  91  10.699  -2.283 -11.745
  685    HA   ARG  91           HA       ARG  91  12.153  -1.107 -13.150
  686   1HB   ARG  91          2HB       ARG  91  11.510   0.810 -10.974
  687   2HB   ARG  91          1HB       ARG  91  12.941   1.186 -11.933
  688   1HG   ARG  91          2HG       ARG  91  11.709   1.749 -13.740
  689   2HG   ARG  91          1HG       ARG  91  10.688   0.318 -13.587
  690   1HD   ARG  91          2HD       ARG  91  10.373   2.629 -11.676
  691   2HD   ARG  91          1HD       ARG  91   9.596   2.663 -13.259
  692    HE   ARG  91           HE       ARG  91   8.935   0.800 -11.050
  693   1HH1  ARG  91          2HH1      ARG  91   8.818  -0.692 -13.615
  694   2HH1  ARG  91          1HH1      ARG  91   7.207  -0.380 -14.169
  695   1HH2  ARG  91          1HH2      ARG  91   6.703   2.307 -12.020
  696   2HH2  ARG  91          2HH2      ARG  91   5.997   1.311 -13.249
  697    H    VAL  92           H        VAL  92  13.196  -2.944 -10.915
  698    HA   VAL  92           HA       VAL  92  16.043  -2.099 -11.167
  699    HB   VAL  92           HB       VAL  92  16.419  -2.903  -8.798
  700   1HG1  VAL  92          1HG1      VAL  92  14.573  -0.748  -8.241
  701   2HG1  VAL  92          2HG1      VAL  92  15.444  -0.428  -9.741
  702   3HG1  VAL  92          3HG1      VAL  92  16.337  -0.724  -8.249
  703   1HG2  VAL  92          1HG2      VAL  92  14.614  -4.186  -8.127
  704   2HG2  VAL  92          2HG2      VAL  92  13.445  -3.188  -8.991
  705   3HG2  VAL  92          3HG2      VAL  92  14.120  -2.630  -7.461
  706    H    GLY  93           H        GLY  93  15.052  -3.894 -12.888
  707   1HA   GLY  93          2HA       GLY  93  16.088  -5.994 -13.602
  708   2HA   GLY  93          1HA       GLY  93  16.146  -6.497 -11.912
  709    H    HIS  94           HN       HIS  94  13.487  -5.806 -11.164
  710    HA   HIS  94           HA       HIS  94  11.862  -7.632 -12.896
  711   1HB   HIS  94          2HB       HIS  94  12.558  -7.878 -10.101
  712   2HB   HIS  94          1HB       HIS  94  10.811  -7.707 -10.269
  713    HD1  HIS  94           HD1      HIS  94  13.201 -10.285 -10.133
  714    HD2  HIS  94           HD2      HIS  94   9.993  -9.538 -12.689
  715    HE1  HIS  94           HE1      HIS  94  12.624 -12.495 -11.226
  Start of MODEL    6
    1   1H    MET   1          1H        MET   1 -20.088  -4.610 -12.713
    2   2H    MET   1          2H        MET   1 -21.454  -4.801 -11.720
    3   3H    MET   1          3H        MET   1 -20.644  -3.308 -11.780
    4    HA   MET   1           HA       MET   1 -22.800  -3.504 -13.086
    5   1HB   MET   1          2HB       MET   1 -20.189  -2.358 -13.862
    6   2HB   MET   1          1HB       MET   1 -21.337  -2.536 -15.192
    7   1HG   MET   1          2HG       MET   1 -23.063  -1.399 -13.720
    8   2HG   MET   1          1HG       MET   1 -21.754  -1.031 -12.595
    9   1HE   MET   1          1HE       MET   1 -23.727   0.716 -13.774
   10   2HE   MET   1          2HE       MET   1 -23.111   2.032 -14.770
   11   3HE   MET   1          3HE       MET   1 -22.504   1.821 -13.128
   12    H    SER   2           H        SER   2 -23.633  -4.168 -15.203
   13    HA   SER   2           HA       SER   2 -23.933  -5.691 -16.968
   14   1HB   SER   2          2HB       SER   2 -21.241  -5.117 -17.021
   15   2HB   SER   2          1HB       SER   2 -21.226  -6.864 -16.822
   16    HG   SER   2           HG       SER   2 -21.690  -5.465 -19.009
   17    H    GLY   3           H        GLY   3 -25.344  -7.076 -15.877
   18   1HA   GLY   3          2HA       GLY   3 -26.013  -9.185 -15.033
   19   2HA   GLY   3          1HA       GLY   3 -24.319  -9.695 -15.055
   20    H    GLY   4           H        GLY   4 -25.909  -6.935 -13.487
   21   1HA   GLY   4          2HA       GLY   4 -26.362  -7.180 -10.972
   22   2HA   GLY   4          1HA       GLY   4 -24.697  -7.776 -10.893
   23    H    THR   5           H        THR   5 -26.415  -5.002 -12.389
   24    HA   THR   5           HA       THR   5 -24.252  -3.213 -12.520
   25    HB   THR   5           HB       THR   5 -27.200  -2.666 -12.090
   26    HG1  THR   5           HG1      THR   5 -26.653  -3.670 -14.040
   27   1HG2  THR   5          1HG2      THR   5 -26.329  -0.615 -11.459
   28   2HG2  THR   5          2HG2      THR   5 -26.385  -0.402 -13.208
   29   3HG2  THR   5          3HG2      THR   5 -24.864  -0.819 -12.418
   30    H    ALA   6           H        ALA   6 -22.914  -2.719 -10.858
   31    HA   ALA   6           HA       ALA   6 -23.981  -2.541  -8.099
   32   1HB   ALA   6          1HB       ALA   6 -21.714  -3.681  -8.965
   33   2HB   ALA   6          2HB       ALA   6 -21.828  -2.941  -7.370
   34   3HB   ALA   6          3HB       ALA   6 -21.095  -2.050  -8.704
   35    H    ALA   7           H        ALA   7 -25.124  -0.532  -8.209
   36    HA   ALA   7           HA       ALA   7 -23.594   1.906  -8.915
   37   1HB   ALA   7          1HB       ALA   7 -25.756   3.069  -8.492
   38   2HB   ALA   7          2HB       ALA   7 -26.470   1.526  -8.020
   39   3HB   ALA   7          3HB       ALA   7 -25.916   1.774  -9.676
   40    H    THR   8           H        THR   8 -25.285   0.515  -6.080
   41    HA   THR   8           HA       THR   8 -23.960   2.527  -4.337
   42    HB   THR   8           HB       THR   8 -25.361   1.488  -2.515
   43    HG1  THR   8           HG1      THR   8 -26.082  -0.411  -3.024
   44   1HG2  THR   8          1HG2      THR   8 -27.436   2.521  -3.229
   45   2HG2  THR   8          2HG2      THR   8 -26.950   2.412  -4.921
   46   3HG2  THR   8          3HG2      THR   8 -26.086   3.489  -3.824
   47    H    THR   9           H        THR   9 -24.419  -1.039  -4.411
   48    HA   THR   9           HA       THR   9 -22.098  -1.417  -2.645
   49    HB   THR   9           HB       THR   9 -22.573  -3.856  -3.023
   50    HG1  THR   9           HG1      THR   9 -23.679  -4.303  -4.733
   51   1HG2  THR   9          1HG2      THR   9 -24.774  -3.853  -1.881
   52   2HG2  THR   9          2HG2      THR   9 -24.946  -2.138  -2.250
   53   3HG2  THR   9          3HG2      THR   9 -23.661  -2.683  -1.171
   54    H    ALA  10           H        ALA  10 -20.500  -3.216  -3.453
   55    HA   ALA  10           HA       ALA  10 -19.328  -2.247  -5.979
   56   1HB   ALA  10          1HB       ALA  10 -17.932  -4.509  -4.895
   57   2HB   ALA  10          2HB       ALA  10 -18.338  -3.417  -3.573
   58   3HB   ALA  10          3HB       ALA  10 -17.408  -2.827  -4.949
   59    H    GLY  11           H        GLY  11 -21.156  -4.971  -4.757
   60   1HA   GLY  11          2HA       GLY  11 -22.197  -6.736  -5.896
   61   2HA   GLY  11          1HA       GLY  11 -21.729  -5.957  -7.407
   62    H    SER  12           H        SER  12 -19.604  -6.373  -8.247
   63    HA   SER  12           HA       SER  12 -18.564  -9.038  -7.451
   64   1HB   SER  12          2HB       SER  12 -17.327  -8.891  -9.629
   65   2HB   SER  12          1HB       SER  12 -19.074  -8.785  -9.818
   66    HG   SER  12           HG       SER  12 -17.896  -7.173 -11.002
   67    H    LYS  13           H        LYS  13 -16.488  -9.293  -6.658
   68    HA   LYS  13           HA       LYS  13 -14.852  -6.807  -6.327
   69   1HB   LYS  13          2HB       LYS  13 -15.021  -9.157  -4.411
   70   2HB   LYS  13          1HB       LYS  13 -14.079  -7.683  -4.178
   71   1HG   LYS  13          2HG       LYS  13 -16.578  -6.661  -4.684
   72   2HG   LYS  13          1HG       LYS  13 -16.970  -8.142  -3.810
   73   1HD   LYS  13          2HD       LYS  13 -14.763  -6.459  -2.708
   74   2HD   LYS  13          1HD       LYS  13 -16.408  -5.844  -2.531
   75   1HE   LYS  13          2HE       LYS  13 -16.804  -7.295  -0.855
   76   2HE   LYS  13          1HE       LYS  13 -16.386  -8.652  -1.900
   77   1HZ   LYS  13          1HZ       LYS  13 -14.366  -6.970  -0.523
   78   2HZ   LYS  13          2HZ       LYS  13 -14.108  -8.443  -1.333
   79   3HZ   LYS  13          3HZ       LYS  13 -14.978  -8.411   0.127
   80    H    VAL  14           H        VAL  14 -12.608  -7.035  -6.637
   81    HA   VAL  14           HA       VAL  14 -11.809  -9.491  -8.114
   82    HB   VAL  14           HB       VAL  14  -9.759  -8.048  -8.693
   83   1HG1  VAL  14          1HG1      VAL  14 -12.441  -8.074  -9.715
   84   2HG1  VAL  14          2HG1      VAL  14 -10.932  -7.851 -10.598
   85   3HG1  VAL  14          3HG1      VAL  14 -11.770  -6.455  -9.920
   86   1HG2  VAL  14          1HG2      VAL  14 -10.253  -6.413  -6.784
   87   2HG2  VAL  14          2HG2      VAL  14 -11.567  -5.794  -7.784
   88   3HG2  VAL  14          3HG2      VAL  14  -9.901  -5.683  -8.349
   89    H    THR  15           H        THR  15 -10.523 -10.972  -7.170
   90    HA   THR  15           HA       THR  15  -9.149 -10.250  -4.614
   91    HB   THR  15           HB       THR  15  -9.801 -13.024  -5.655
   92    HG1  THR  15           HG1      THR  15 -11.225 -11.357  -3.850
   93   1HG2  THR  15          1HG2      THR  15  -9.519 -13.592  -3.226
   94   2HG2  THR  15          2HG2      THR  15  -8.968 -11.940  -2.953
   95   3HG2  THR  15          3HG2      THR  15  -8.040 -13.019  -3.995
   96    H    PHE  16           H        PHE  16  -6.934 -10.328  -4.546
   97    HA   PHE  16           HA       PHE  16  -5.514 -11.547  -6.890
   98   1HB   PHE  16          2HB       PHE  16  -4.334  -9.318  -5.242
   99   2HB   PHE  16          1HB       PHE  16  -3.933  -9.807  -6.885
  100    HD1  PHE  16           HD1      PHE  16  -5.603  -9.368  -8.742
  101    HD2  PHE  16           HD2      PHE  16  -6.010  -7.692  -4.809
  102    HE1  PHE  16           HE1      PHE  16  -7.169  -7.663  -9.629
  103    HE2  PHE  16           HE2      PHE  16  -7.577  -5.990  -5.698
  104    HZ   PHE  16           HZ       PHE  16  -8.153  -5.975  -8.107
  105    H    LYS  17           H        LYS  17  -3.986 -13.068  -6.396
  106    HA   LYS  17           HA       LYS  17  -3.307 -13.435  -3.509
  107   1HB   LYS  17          2HB       LYS  17  -2.727 -15.773  -4.114
  108   2HB   LYS  17          1HB       LYS  17  -4.406 -15.396  -4.488
  109   1HG   LYS  17          2HG       LYS  17  -3.488 -14.801  -6.863
  110   2HG   LYS  17          1HG       LYS  17  -2.086 -15.751  -6.374
  111   1HD   LYS  17          2HD       LYS  17  -3.204 -17.635  -6.855
  112   2HD   LYS  17          1HD       LYS  17  -4.403 -17.226  -5.628
  113   1HE   LYS  17          2HE       LYS  17  -5.914 -16.511  -7.168
  114   2HE   LYS  17          1HE       LYS  17  -4.683 -15.707  -8.139
  115   1HZ   LYS  17          1HZ       LYS  17  -4.833 -17.394  -9.548
  116   2HZ   LYS  17          2HZ       LYS  17  -5.867 -18.256  -8.509
  117   3HZ   LYS  17          3HZ       LYS  17  -4.182 -18.416  -8.362
  118    H    ILE  18           H        ILE  18  -1.504 -12.177  -3.245
  119    HA   ILE  18           HA       ILE  18   0.651 -12.240  -5.266
  120    HB   ILE  18           HB       ILE  18   0.510 -10.711  -2.647
  121   1HG1  ILE  18          2HG1      ILE  18   0.217  -8.986  -4.863
  122   2HG1  ILE  18          1HG1      ILE  18  -0.875 -10.336  -5.167
  123   1HG2  ILE  18          1HG2      ILE  18   2.297  -9.373  -3.572
  124   2HG2  ILE  18          2HG2      ILE  18   2.195 -10.215  -5.119
  125   3HG2  ILE  18          3HG2      ILE  18   2.783 -11.064  -3.688
  126   1HD1  ILE  18          1HD1      ILE  18  -1.400  -9.931  -2.549
  127   2HD1  ILE  18          2HD1      ILE  18  -2.280  -9.107  -3.837
  128   3HD1  ILE  18          3HD1      ILE  18  -0.952  -8.289  -3.014
  129    H    THR  19           H        THR  19   2.534 -13.369  -5.006
  130    HA   THR  19           HA       THR  19   2.990 -14.733  -2.377
  131    HB   THR  19           HB       THR  19   3.724 -15.792  -5.128
  132    HG1  THR  19           HG1      THR  19   1.737 -16.419  -5.186
  133   1HG2  THR  19          1HG2      THR  19   4.153 -16.686  -2.322
  134   2HG2  THR  19          2HG2      THR  19   5.166 -16.923  -3.746
  135   3HG2  THR  19          3HG2      THR  19   3.738 -17.930  -3.502
  136    H    LEU  20           H        LEU  20   4.717 -13.715  -1.441
  137    HA   LEU  20           HA       LEU  20   6.628 -12.160  -2.908
  138   1HB   LEU  20          2HB       LEU  20   7.617 -11.678  -0.856
  139   2HB   LEU  20          1HB       LEU  20   5.984 -12.107  -0.359
  140    HG   LEU  20           HG       LEU  20   8.237 -14.130  -0.444
  141   1HD1  LEU  20          1HD1      LEU  20   7.366 -12.263   1.770
  142   2HD1  LEU  20          2HD1      LEU  20   8.987 -12.486   1.115
  143   3HD1  LEU  20          3HD1      LEU  20   8.246 -13.758   2.084
  144   1HD2  LEU  20          1HD2      LEU  20   5.496 -14.014   0.849
  145   2HD2  LEU  20          2HD2      LEU  20   6.700 -15.237   1.253
  146   3HD2  LEU  20          3HD2      LEU  20   6.050 -15.147  -0.384
  147    H    THR  21           H        THR  21   8.670 -12.655  -3.671
  148    HA   THR  21           HA       THR  21   9.361 -15.559  -3.732
  149    HB   THR  21           HB       THR  21   8.942 -14.469  -5.927
  150    HG1  THR  21           HG1      THR  21  10.390 -15.796  -6.606
  151   1HG2  THR  21          1HG2      THR  21  10.722 -12.847  -6.724
  152   2HG2  THR  21          2HG2      THR  21  11.246 -12.713  -5.047
  153   3HG2  THR  21          3HG2      THR  21   9.620 -12.206  -5.506
  154    H    SER  22           H        SER  22  10.274 -12.790  -2.095
  155    HA   SER  22           HA       SER  22  13.175 -13.217  -2.186
  156   1HB   SER  22          2HB       SER  22  11.417 -11.142  -1.304
  157   2HB   SER  22          1HB       SER  22  12.411 -11.629   0.065
  158    HG   SER  22           HG       SER  22  13.439 -10.043  -1.222
  159    H    ASP  23           H        ASP  23  10.558 -13.731   0.203
  160    HA   ASP  23           HA       ASP  23  12.440 -15.470   1.745
  161   1HB   ASP  23          2HB       ASP  23  11.267 -13.375   2.793
  162   2HB   ASP  23          1HB       ASP  23   9.852 -14.424   2.859
  163    HA   PRO  24           HA       PRO  24   9.758 -18.706   0.225
  164   1HB   PRO  24          2HB       PRO  24  11.337 -20.749   1.169
  165   2HB   PRO  24          1HB       PRO  24  11.663 -19.868  -0.333
  166   1HG   PRO  24          2HG       PRO  24  13.051 -19.668   2.298
  167   2HG   PRO  24          1HG       PRO  24  13.670 -19.327   0.674
  168   1HD   PRO  24          2HD       PRO  24  12.834 -17.399   2.571
  169   2HD   PRO  24          1HD       PRO  24  13.147 -17.104   0.846
  170    H    LYS  25           H        LYS  25  10.962 -18.416   3.557
  171    HA   LYS  25           HA       LYS  25   9.281 -20.420   4.736
  172   1HB   LYS  25          2HB       LYS  25  10.697 -17.989   5.830
  173   2HB   LYS  25          1HB       LYS  25   9.671 -18.990   6.857
  174   1HG   LYS  25          2HG       LYS  25  11.052 -20.873   6.626
  175   2HG   LYS  25          1HG       LYS  25  11.801 -20.261   5.151
  176   1HD   LYS  25          2HD       LYS  25  12.157 -18.560   7.554
  177   2HD   LYS  25          1HD       LYS  25  12.979 -20.121   7.602
  178   1HE   LYS  25          2HE       LYS  25  14.520 -19.452   6.092
  179   2HE   LYS  25          1HE       LYS  25  13.280 -18.831   5.004
  180   1HZ   LYS  25          1HZ       LYS  25  14.794 -17.099   5.843
  181   2HZ   LYS  25          2HZ       LYS  25  14.259 -17.412   7.424
  182   3HZ   LYS  25          3HZ       LYS  25  13.177 -16.809   6.262
  183    H    LEU  26           H        LEU  26   8.814 -16.905   4.255
  184    HA   LEU  26           HA       LEU  26   6.232 -16.842   5.564
  185   1HB   LEU  26          2HB       LEU  26   7.799 -14.967   3.832
  186   2HB   LEU  26          1HB       LEU  26   6.078 -14.656   4.067
  187    HG   LEU  26           HG       LEU  26   7.522 -15.340   6.545
  188   1HD1  LEU  26          1HD1      LEU  26   8.161 -12.809   5.002
  189   2HD1  LEU  26          2HD1      LEU  26   9.301 -14.062   5.492
  190   3HD1  LEU  26          3HD1      LEU  26   8.529 -13.048   6.711
  191   1HD2  LEU  26          1HD2      LEU  26   6.243 -13.288   7.291
  192   2HD2  LEU  26          2HD2      LEU  26   5.231 -14.566   6.616
  193   3HD2  LEU  26          3HD2      LEU  26   5.627 -13.149   5.643
  194    HA   PRO  27           HA       PRO  27   3.866 -18.576   2.241
  195   1HB   PRO  27          2HB       PRO  27   1.401 -18.061   3.338
  196   2HB   PRO  27          1HB       PRO  27   2.455 -19.381   3.871
  197   1HG   PRO  27          2HG       PRO  27   1.868 -16.789   5.219
  198   2HG   PRO  27          1HG       PRO  27   2.361 -18.336   5.928
  199   1HD   PRO  27          2HD       PRO  27   4.043 -16.100   5.484
  200   2HD   PRO  27          1HD       PRO  27   4.574 -17.747   5.888
  201    H    PHE  28           H        PHE  28   1.983 -17.866   0.803
  202    HA   PHE  28           HA       PHE  28   2.428 -15.137  -0.125
  203   1HB   PHE  28          2HB       PHE  28   0.954 -15.700  -1.954
  204   2HB   PHE  28          1HB       PHE  28   1.993 -17.089  -1.658
  205    HD1  PHE  28           HD1      PHE  28   1.098 -19.093  -0.456
  206    HD2  PHE  28           HD2      PHE  28  -1.423 -15.807  -1.596
  207    HE1  PHE  28           HE1      PHE  28  -0.904 -20.516  -0.133
  208    HE2  PHE  28           HE2      PHE  28  -3.423 -17.235  -1.272
  209    HZ   PHE  28           HZ       PHE  28  -3.165 -19.587  -0.539
  210    H    LYS  29           H        LYS  29   0.569 -13.610  -0.494
  211    HA   LYS  29           HA       LYS  29  -1.407 -13.785   1.750
  212   1HB   LYS  29          2HB       LYS  29   0.556 -11.920   1.534
  213   2HB   LYS  29          1HB       LYS  29  -0.735 -11.117   0.641
  214   1HG   LYS  29          2HG       LYS  29  -1.701 -12.361   3.105
  215   2HG   LYS  29          1HG       LYS  29  -0.450 -11.156   3.408
  216   1HD   LYS  29          2HD       LYS  29  -1.767  -9.618   1.831
  217   2HD   LYS  29          1HD       LYS  29  -3.084 -10.781   1.977
  218   1HE   LYS  29          2HE       LYS  29  -2.680 -10.528   4.550
  219   2HE   LYS  29          1HE       LYS  29  -1.868  -9.030   4.099
  220   1HZ   LYS  29          1HZ       LYS  29  -3.893  -8.137   4.110
  221   2HZ   LYS  29          2HZ       LYS  29  -4.665  -9.649   4.145
  222   3HZ   LYS  29          3HZ       LYS  29  -4.182  -8.974   2.664
  223    H    VAL  30           H        VAL  30  -3.543 -13.444   1.253
  224    HA   VAL  30           HA       VAL  30  -4.207 -12.934  -1.618
  225    HB   VAL  30           HB       VAL  30  -5.970 -14.144   0.540
  226   1HG1  VAL  30          1HG1      VAL  30  -7.035 -15.000  -1.748
  227   2HG1  VAL  30          2HG1      VAL  30  -6.270 -13.541  -2.379
  228   3HG1  VAL  30          3HG1      VAL  30  -7.460 -13.423  -1.082
  229   1HG2  VAL  30          1HG2      VAL  30  -4.090 -15.633   0.119
  230   2HG2  VAL  30          2HG2      VAL  30  -4.290 -15.452  -1.623
  231   3HG2  VAL  30          3HG2      VAL  30  -5.519 -16.293  -0.678
  232    H    LEU  31           H        LEU  31  -5.398 -11.123  -2.130
  233    HA   LEU  31           HA       LEU  31  -6.496  -9.516   0.144
  234   1HB   LEU  31          2HB       LEU  31  -4.632  -8.764  -2.028
  235   2HB   LEU  31          1HB       LEU  31  -5.951  -7.626  -1.752
  236    HG   LEU  31           HG       LEU  31  -4.776  -8.576   0.750
  237   1HD1  LEU  31          1HD1      LEU  31  -2.636  -7.425   0.536
  238   2HD1  LEU  31          2HD1      LEU  31  -3.016  -6.966  -1.123
  239   3HD1  LEU  31          3HD1      LEU  31  -2.754  -8.661  -0.717
  240   1HD2  LEU  31          1HD2      LEU  31  -4.995  -6.300   1.345
  241   2HD2  LEU  31          2HD2      LEU  31  -6.314  -6.554   0.204
  242   3HD2  LEU  31          3HD2      LEU  31  -4.834  -5.755  -0.324
  243    H    SER  32           H        SER  32  -8.673  -9.584  -0.031
  244    HA   SER  32           HA       SER  32  -9.912  -9.664  -2.744
  245   1HB   SER  32          2HB       SER  32 -12.008 -10.256  -1.441
  246   2HB   SER  32          1HB       SER  32 -10.712 -11.442  -1.332
  247    HG   SER  32           HG       SER  32 -11.685 -10.870   0.709
  248    H    VAL  33           H        VAL  33 -10.354  -7.652  -3.496
  249    HA   VAL  33           HA       VAL  33 -11.735  -5.739  -1.674
  250    HB   VAL  33           HB       VAL  33 -10.363  -3.894  -2.813
  251   1HG1  VAL  33          1HG1      VAL  33  -9.978  -4.472  -0.492
  252   2HG1  VAL  33          2HG1      VAL  33  -8.411  -4.276  -1.279
  253   3HG1  VAL  33          3HG1      VAL  33  -9.040  -5.892  -0.958
  254   1HG2  VAL  33          1HG2      VAL  33  -9.503  -5.544  -4.587
  255   2HG2  VAL  33          2HG2      VAL  33  -8.419  -6.154  -3.337
  256   3HG2  VAL  33          3HG2      VAL  33  -8.302  -4.476  -3.863
  257    HA   PRO  34           HA       PRO  34 -14.368  -5.088  -5.134
  258   1HB   PRO  34          2HB       PRO  34 -15.243  -2.544  -4.564
  259   2HB   PRO  34          1HB       PRO  34 -15.790  -3.987  -3.695
  260   1HG   PRO  34          2HG       PRO  34 -13.886  -1.869  -2.806
  261   2HG   PRO  34          1HG       PRO  34 -14.938  -2.913  -1.835
  262   1HD   PRO  34          2HD       PRO  34 -12.162  -3.268  -2.213
  263   2HD   PRO  34          1HD       PRO  34 -13.286  -4.479  -1.559
  264    H    GLU  35           H        GLU  35 -14.552  -3.888  -7.138
  265    HA   GLU  35           HA       GLU  35 -12.084  -2.884  -8.209
  266   1HB   GLU  35          2HB       GLU  35 -14.938  -2.902  -9.198
  267   2HB   GLU  35          1HB       GLU  35 -13.668  -2.089 -10.111
  268   1HG   GLU  35          2HG       GLU  35 -13.336  -4.134 -11.052
  269   2HG   GLU  35          1HG       GLU  35 -12.471  -4.490  -9.558
  270    H    SER  36           H        SER  36 -11.538  -1.239  -6.674
  271    HA   SER  36           HA       SER  36 -12.145   1.432  -7.457
  272   1HB   SER  36          2HB       SER  36 -13.382   2.147  -5.375
  273   2HB   SER  36          1HB       SER  36 -14.329   1.126  -6.452
  274    HG   SER  36           HG       SER  36 -14.593   0.114  -4.581
  275    H    THR  37           H        THR  37 -11.163  -0.725  -4.798
  276    HA   THR  37           HA       THR  37  -9.579   1.153  -3.341
  277    HB   THR  37           HB       THR  37  -8.350  -0.904  -2.519
  278    HG1  THR  37           HG1      THR  37  -8.429  -2.403  -4.016
  279   1HG2  THR  37          1HG2      THR  37 -11.183  -1.687  -2.329
  280   2HG2  THR  37          2HG2      THR  37 -10.871   0.006  -1.946
  281   3HG2  THR  37          3HG2      THR  37 -10.040  -1.268  -1.052
  282    HA   PRO  38           HA       PRO  38  -6.198   1.713  -6.126
  283   1HB   PRO  38          2HB       PRO  38  -4.497   2.929  -4.341
  284   2HB   PRO  38          1HB       PRO  38  -5.875   3.746  -5.096
  285   1HG   PRO  38          2HG       PRO  38  -5.588   2.740  -2.303
  286   2HG   PRO  38          1HG       PRO  38  -6.597   4.058  -2.922
  287   1HD   PRO  38          2HD       PRO  38  -7.494   1.457  -2.261
  288   2HD   PRO  38          1HD       PRO  38  -8.402   2.671  -3.189
  289    H    PHE  39           H        PHE  39  -4.128   0.801  -6.575
  290    HA   PHE  39           HA       PHE  39  -3.521  -1.708  -5.305
  291   1HB   PHE  39          2HB       PHE  39  -2.933  -0.811  -7.718
  292   2HB   PHE  39          1HB       PHE  39  -1.468  -0.236  -6.925
  293    HD1  PHE  39           HD1      PHE  39   0.353  -1.686  -6.993
  294    HD2  PHE  39           HD2      PHE  39  -3.615  -3.326  -6.878
  295    HE1  PHE  39           HE1      PHE  39   1.297  -3.976  -7.073
  296    HE2  PHE  39           HE2      PHE  39  -2.670  -5.617  -6.960
  297    HZ   PHE  39           HZ       PHE  39  -0.214  -5.941  -7.057
  298    H    THR  40           H        THR  40  -2.657   1.557  -4.532
  299    HA   THR  40           HA       THR  40  -0.149   1.140  -3.223
  300    HB   THR  40           HB       THR  40  -0.847   3.178  -1.853
  301    HG1  THR  40           HG1      THR  40  -2.868   3.679  -1.890
  302   1HG2  THR  40          1HG2      THR  40   0.414   3.469  -3.897
  303   2HG2  THR  40          2HG2      THR  40  -0.860   4.688  -3.855
  304   3HG2  THR  40          3HG2      THR  40  -1.041   3.259  -4.872
  305    H    ALA  41           H        ALA  41  -3.510   0.951  -2.040
  306    HA   ALA  41           HA       ALA  41  -2.740   0.164   0.655
  307   1HB   ALA  41          1HB       ALA  41  -5.400  -0.092  -0.786
  308   2HB   ALA  41          2HB       ALA  41  -4.897   1.278   0.203
  309   3HB   ALA  41          3HB       ALA  41  -5.151  -0.301   0.947
  310    H    VAL  42           H        VAL  42  -3.787  -1.546  -2.296
  311    HA   VAL  42           HA       VAL  42  -4.015  -4.161  -1.160
  312    HB   VAL  42           HB       VAL  42  -3.192  -3.339  -3.966
  313   1HG1  VAL  42          1HG1      VAL  42  -3.236  -5.913  -2.707
  314   2HG1  VAL  42          2HG1      VAL  42  -2.902  -5.530  -4.395
  315   3HG1  VAL  42          3HG1      VAL  42  -4.556  -5.847  -3.874
  316   1HG2  VAL  42          1HG2      VAL  42  -5.431  -3.204  -4.490
  317   2HG2  VAL  42          2HG2      VAL  42  -5.545  -2.770  -2.785
  318   3HG2  VAL  42          3HG2      VAL  42  -5.891  -4.421  -3.299
  319    H    LEU  43           H        LEU  43  -1.246  -2.602  -2.812
  320    HA   LEU  43           HA       LEU  43   0.627  -4.720  -2.404
  321   1HB   LEU  43          2HB       LEU  43   0.819  -2.644  -3.931
  322   2HB   LEU  43          1HB       LEU  43   1.368  -1.790  -2.489
  323    HG   LEU  43           HG       LEU  43   2.706  -4.376  -2.880
  324   1HD1  LEU  43          1HD1      LEU  43   2.554  -3.908  -5.224
  325   2HD1  LEU  43          2HD1      LEU  43   4.170  -3.404  -4.730
  326   3HD1  LEU  43          3HD1      LEU  43   2.905  -2.199  -4.974
  327   1HD2  LEU  43          1HD2      LEU  43   4.702  -2.731  -2.644
  328   2HD2  LEU  43          2HD2      LEU  43   3.619  -2.909  -1.263
  329   3HD2  LEU  43          3HD2      LEU  43   3.471  -1.508  -2.324
  330    H    LYS  44           H        LYS  44  -0.335  -1.977  -0.374
  331    HA   LYS  44           HA       LYS  44   1.732  -2.207   1.594
  332   1HB   LYS  44          2HB       LYS  44  -0.686  -0.688   1.224
  333   2HB   LYS  44          1HB       LYS  44  -0.657  -1.333   2.865
  334   1HG   LYS  44          2HG       LYS  44   1.886  -0.512   2.735
  335   2HG   LYS  44          1HG       LYS  44   1.198   0.604   1.553
  336   1HD   LYS  44          2HD       LYS  44   0.107   1.796   3.147
  337   2HD   LYS  44          1HD       LYS  44  -0.421   0.342   3.994
  338   1HE   LYS  44          2HE       LYS  44   2.229   0.263   4.550
  339   2HE   LYS  44          1HE       LYS  44   2.001   2.005   4.412
  340   1HZ   LYS  44          1HZ       LYS  44   0.338   0.220   6.107
  341   2HZ   LYS  44          2HZ       LYS  44   0.263   1.919   6.034
  342   3HZ   LYS  44          3HZ       LYS  44   1.636   1.153   6.677
  343    H    PHE  45           H        PHE  45  -1.610  -3.503   1.564
  344    HA   PHE  45           HA       PHE  45  -1.468  -4.909   4.030
  345   1HB   PHE  45          2HB       PHE  45  -3.178  -5.011   1.605
  346   2HB   PHE  45          1HB       PHE  45  -3.177  -6.462   2.608
  347    HD1  PHE  45           HD1      PHE  45  -3.617  -6.206   5.117
  348    HD2  PHE  45           HD2      PHE  45  -4.373  -3.078   2.273
  349    HE1  PHE  45           HE1      PHE  45  -5.109  -5.082   6.748
  350    HE2  PHE  45           HE2      PHE  45  -5.864  -1.955   3.904
  351    HZ   PHE  45           HZ       PHE  45  -6.232  -2.958   6.143
  352    H    ALA  46           H        ALA  46  -0.653  -5.999   0.721
  353    HA   ALA  46           HA       ALA  46  -0.003  -8.702   1.455
  354   1HB   ALA  46          1HB       ALA  46   0.424  -6.944  -0.900
  355   2HB   ALA  46          2HB       ALA  46  -0.158  -8.607  -0.829
  356   3HB   ALA  46          3HB       ALA  46   1.570  -8.273  -0.720
  357    H    ALA  47           H        ALA  47   2.009  -5.773   1.070
  358    HA   ALA  47           HA       ALA  47   4.514  -6.994   1.727
  359   1HB   ALA  47          1HB       ALA  47   3.564  -4.382   1.122
  360   2HB   ALA  47          2HB       ALA  47   5.237  -4.926   1.211
  361   3HB   ALA  47          3HB       ALA  47   4.445  -4.271   2.644
  362    H    GLU  48           H        GLU  48   1.895  -5.744   3.740
  363    HA   GLU  48           HA       GLU  48   3.282  -5.523   6.217
  364   1HB   GLU  48          2HB       GLU  48   0.516  -5.580   5.315
  365   2HB   GLU  48          1HB       GLU  48   0.703  -6.446   6.840
  366   1HG   GLU  48          2HG       GLU  48   1.051  -4.532   7.990
  367   2HG   GLU  48          1HG       GLU  48   2.226  -3.952   6.810
  368    H    GLU  49           H        GLU  49   1.476  -8.307   4.850
  369    HA   GLU  49           HA       GLU  49   2.156 -10.104   7.010
  370   1HB   GLU  49          2HB       GLU  49   0.226 -10.434   5.439
  371   2HB   GLU  49          1HB       GLU  49   1.382 -10.801   4.158
  372   1HG   GLU  49          2HG       GLU  49   1.937 -12.351   6.563
  373   2HG   GLU  49          1HG       GLU  49   0.293 -12.625   5.987
  374    H    PHE  50           H        PHE  50   3.591  -9.424   3.827
  375    HA   PHE  50           HA       PHE  50   5.567 -11.516   3.900
  376   1HB   PHE  50          2HB       PHE  50   5.550  -8.864   2.434
  377   2HB   PHE  50          1HB       PHE  50   6.699 -10.163   2.135
  378    HD1  PHE  50           HD1      PHE  50   4.597 -12.441   2.624
  379    HD2  PHE  50           HD2      PHE  50   4.587  -8.885   0.215
  380    HE1  PHE  50           HE1      PHE  50   2.962 -13.486   1.082
  381    HE2  PHE  50           HE2      PHE  50   2.954  -9.933  -1.325
  382    HZ   PHE  50           HZ       PHE  50   2.143 -12.231  -0.890
  383    H    LYS  51           H        LYS  51   5.360  -8.479   5.541
  384    HA   LYS  51           HA       LYS  51   6.757  -7.569   7.185
  385   1HB   LYS  51          2HB       LYS  51   7.635 -10.220   7.055
  386   2HB   LYS  51          1HB       LYS  51   9.103  -9.269   6.833
  387   1HG   LYS  51          2HG       LYS  51   7.961  -7.871   8.849
  388   2HG   LYS  51          1HG       LYS  51   7.317  -9.476   9.199
  389   1HD   LYS  51          2HD       LYS  51   9.293 -10.070  10.090
  390   2HD   LYS  51          1HD       LYS  51  10.074  -9.787   8.535
  391   1HE   LYS  51          2HE       LYS  51   9.585  -7.231   9.672
  392   2HE   LYS  51          1HE       LYS  51  10.268  -8.235  10.952
  393   1HZ   LYS  51          1HZ       LYS  51  12.011  -8.902   9.304
  394   2HZ   LYS  51          2HZ       LYS  51  12.070  -7.277   9.795
  395   3HZ   LYS  51          3HZ       LYS  51  11.422  -7.685   8.278
  396    H    VAL  52           H        VAL  52   6.760  -6.791   4.373
  397    HA   VAL  52           HA       VAL  52   9.537  -5.679   4.188
  398    HB   VAL  52           HB       VAL  52   9.102  -5.551   1.687
  399   1HG1  VAL  52          1HG1      VAL  52  10.367  -7.401   1.629
  400   2HG1  VAL  52          2HG1      VAL  52   8.969  -8.405   2.013
  401   3HG1  VAL  52          3HG1      VAL  52   9.940  -7.711   3.311
  402   1HG2  VAL  52          1HG2      VAL  52   6.994  -7.651   2.149
  403   2HG2  VAL  52          2HG2      VAL  52   7.285  -6.669   0.713
  404   3HG2  VAL  52          3HG2      VAL  52   6.550  -5.944   2.143
  405    HA   PRO  53           HA       PRO  53   7.616  -1.719   4.154
  406   1HB   PRO  53          2HB       PRO  53   9.529  -0.307   2.772
  407   2HB   PRO  53          1HB       PRO  53   9.705  -0.818   4.458
  408   1HG   PRO  53          2HG       PRO  53  10.993  -1.940   2.012
  409   2HG   PRO  53          1HG       PRO  53  11.570  -1.954   3.687
  410   1HD   PRO  53          2HD       PRO  53  10.368  -4.127   2.334
  411   2HD   PRO  53          1HD       PRO  53  10.633  -4.008   4.087
  412    H    ALA  54           H        ALA  54   5.936  -1.093   2.895
  413    HA   ALA  54           HA       ALA  54   5.619  -1.907   0.148
  414   1HB   ALA  54          1HB       ALA  54   3.667  -1.547   1.554
  415   2HB   ALA  54          2HB       ALA  54   3.610  -0.414   0.204
  416   3HB   ALA  54          3HB       ALA  54   4.112   0.141   1.801
  417    H    ALA  55           H        ALA  55   6.874   1.015   1.662
  418    HA   ALA  55           HA       ALA  55   6.706   2.816  -0.527
  419   1HB   ALA  55          1HB       ALA  55   8.868   2.608   1.590
  420   2HB   ALA  55          2HB       ALA  55   7.364   3.515   1.742
  421   3HB   ALA  55          3HB       ALA  55   8.576   4.010   0.560
  422    H    THR  56           H        THR  56   9.186   0.366   0.250
  423    HA   THR  56           HA       THR  56  10.411   0.901  -2.429
  424    HB   THR  56           HB       THR  56  12.459  -0.229  -1.440
  425    HG1  THR  56           HG1      THR  56  12.202  -1.104   0.430
  426   1HG2  THR  56          1HG2      THR  56  12.217   2.238  -1.609
  427   2HG2  THR  56          2HG2      THR  56  13.169   1.755  -0.205
  428   3HG2  THR  56          3HG2      THR  56  11.490   2.256  -0.002
  429    H    SER  57           H        SER  57   8.135  -0.679  -2.381
  430    HA   SER  57           HA       SER  57   9.278  -3.368  -2.999
  431   1HB   SER  57          2HB       SER  57   7.393  -2.764  -0.930
  432   2HB   SER  57          1HB       SER  57   6.581  -3.720  -2.160
  433    HG   SER  57           HG       SER  57   7.605  -5.087  -0.704
  434    H    ALA  58           H        ALA  58   7.952  -4.599  -4.517
  435    HA   ALA  58           HA       ALA  58   5.972  -3.053  -6.099
  436   1HB   ALA  58          1HB       ALA  58   8.676  -3.371  -6.914
  437   2HB   ALA  58          2HB       ALA  58   7.336  -2.727  -7.862
  438   3HB   ALA  58          3HB       ALA  58   7.710  -4.450  -7.922
  439    H    ILE  59           H        ILE  59   4.796  -4.513  -7.650
  440    HA   ILE  59           HA       ILE  59   4.959  -7.387  -6.837
  441    HB   ILE  59           HB       ILE  59   2.563  -5.564  -6.886
  442   1HG1  ILE  59          2HG1      ILE  59   3.343  -7.816  -5.011
  443   2HG1  ILE  59          1HG1      ILE  59   3.856  -6.144  -4.781
  444   1HG2  ILE  59          1HG2      ILE  59   2.671  -8.469  -7.608
  445   2HG2  ILE  59          2HG2      ILE  59   1.601  -7.205  -8.212
  446   3HG2  ILE  59          3HG2      ILE  59   1.325  -7.906  -6.619
  447   1HD1  ILE  59          1HD1      ILE  59   1.912  -6.247  -3.479
  448   2HD1  ILE  59          2HD1      ILE  59   1.086  -7.304  -4.623
  449   3HD1  ILE  59          3HD1      ILE  59   1.307  -5.597  -5.003
  450    H    ILE  60           H        ILE  60   5.300  -8.627  -8.607
  451    HA   ILE  60           HA       ILE  60   4.573  -7.544 -11.282
  452    HB   ILE  60           HB       ILE  60   6.073  -9.243 -12.194
  453   1HG1  ILE  60          2HG1      ILE  60   7.227 -10.241  -9.736
  454   2HG1  ILE  60          1HG1      ILE  60   5.499 -10.592  -9.768
  455   1HG2  ILE  60          1HG2      ILE  60   7.690  -8.293  -9.885
  456   2HG2  ILE  60          2HG2      ILE  60   6.867  -7.054 -10.833
  457   3HG2  ILE  60          3HG2      ILE  60   8.004  -8.153 -11.616
  458   1HD1  ILE  60          1HD1      ILE  60   7.462 -11.244 -11.989
  459   2HD1  ILE  60          2HD1      ILE  60   5.735 -11.606 -12.002
  460   3HD1  ILE  60          3HD1      ILE  60   6.793 -12.403 -10.838
  461    H    THR  61           H        THR  61   3.722  -9.287 -12.870
  462    HA   THR  61           HA       THR  61   1.708 -10.969 -11.429
  463    HB   THR  61           HB       THR  61   0.732  -9.151 -12.801
  464    HG1  THR  61           HG1      THR  61  -0.663 -10.743 -12.826
  465   1HG2  THR  61          1HG2      THR  61   2.223  -8.739 -14.550
  466   2HG2  THR  61          2HG2      THR  61   0.923  -9.604 -15.368
  467   3HG2  THR  61          3HG2      THR  61   2.406 -10.449 -14.931
  468    H    ASN  62           H        ASN  62   0.987 -12.918 -12.819
  469    HA   ASN  62           HA       ASN  62   3.238 -14.637 -13.270
  470   1HB   ASN  62          2HB       ASN  62   0.743 -15.202 -12.707
  471   2HB   ASN  62          1HB       ASN  62   0.526 -15.180 -14.457
  472   1HD2  ASN  62          1HD2      ASN  62   1.417 -16.934 -15.685
  473   2HD2  ASN  62          2HD2      ASN  62   2.187 -18.264 -14.964
  474    H    ASP  63           H        ASP  63   1.632 -12.373 -15.362
  475    HA   ASP  63           HA       ASP  63   2.422 -13.657 -17.865
  476   1HB   ASP  63          2HB       ASP  63   1.577 -10.780 -17.401
  477   2HB   ASP  63          1HB       ASP  63   1.569 -11.651 -18.934
  478    H    GLY  64           H        GLY  64   3.881 -11.392 -15.622
  479   1HA   GLY  64          2HA       GLY  64   6.328 -11.133 -15.666
  480   2HA   GLY  64          1HA       GLY  64   6.256 -11.221 -17.426
  481    H    VAL  65           H        VAL  65   4.351  -9.298 -15.087
  482    HA   VAL  65           HA       VAL  65   5.383  -6.818 -16.402
  483    HB   VAL  65           HB       VAL  65   2.511  -7.269 -15.526
  484   1HG1  VAL  65          1HG1      VAL  65   2.068  -5.134 -16.495
  485   2HG1  VAL  65          2HG1      VAL  65   3.654  -5.073 -17.262
  486   3HG1  VAL  65          3HG1      VAL  65   3.515  -4.914 -15.511
  487   1HG2  VAL  65          1HG2      VAL  65   2.639  -8.591 -17.448
  488   2HG2  VAL  65          2HG2      VAL  65   3.903  -7.595 -18.170
  489   3HG2  VAL  65          3HG2      VAL  65   2.237  -7.019 -18.140
  490    H    GLY  66           H        GLY  66   6.195  -5.411 -14.926
  491   1HA   GLY  66          2HA       GLY  66   6.031  -5.997 -12.080
  492   2HA   GLY  66          1HA       GLY  66   6.892  -4.644 -12.810
  493    H    VAL  67           H        VAL  67   3.776  -5.758 -11.649
  494    HA   VAL  67           HA       VAL  67   2.253  -3.401 -12.260
  495    HB   VAL  67           HB       VAL  67   1.777  -5.213  -9.879
  496   1HG1  VAL  67          1HG1      VAL  67   0.061  -3.743  -9.691
  497   2HG1  VAL  67          2HG1      VAL  67  -0.630  -4.609 -11.063
  498   3HG1  VAL  67          3HG1      VAL  67   0.289  -3.127 -11.328
  499   1HG2  VAL  67          1HG2      VAL  67   1.913  -6.833 -11.540
  500   2HG2  VAL  67          2HG2      VAL  67   1.446  -5.709 -12.817
  501   3HG2  VAL  67          3HG2      VAL  67   0.226  -6.347 -11.714
  502    H    ASN  68           H        ASN  68   2.276  -1.437 -11.313
  503    HA   ASN  68           HA       ASN  68   3.901  -1.081  -8.833
  504   1HB   ASN  68          2HB       ASN  68   3.094   0.816 -11.051
  505   2HB   ASN  68          1HB       ASN  68   3.811   1.377  -9.541
  506   1HD2  ASN  68          1HD2      ASN  68   4.573   0.254 -12.668
  507   2HD2  ASN  68          2HD2      ASN  68   6.210  -0.106 -12.402
  508    HA   PRO  69           HA       PRO  69   0.336   0.087  -6.535
  509   1HB   PRO  69          2HB       PRO  69   1.455   1.911  -4.802
  510   2HB   PRO  69          1HB       PRO  69   1.698   0.161  -4.675
  511   1HG   PRO  69          2HG       PRO  69   3.590   2.253  -5.640
  512   2HG   PRO  69          1HG       PRO  69   3.936   0.673  -4.917
  513   1HD   PRO  69          2HD       PRO  69   4.061   1.301  -7.676
  514   2HD   PRO  69          1HD       PRO  69   4.087  -0.329  -6.972
  515    H    ALA  70           H        ALA  70  -0.141   1.256  -8.817
  516    HA   ALA  70           HA       ALA  70  -1.073   3.969  -8.143
  517   1HB   ALA  70          1HB       ALA  70   0.253   3.947 -10.769
  518   2HB   ALA  70          2HB       ALA  70   1.369   3.736  -9.420
  519   3HB   ALA  70          3HB       ALA  70   0.323   5.154  -9.485
  520    H    GLN  71           H        GLN  71  -2.293   1.338  -8.799
  521    HA   GLN  71           HA       GLN  71  -3.969   2.243 -11.095
  522   1HB   GLN  71          2HB       GLN  71  -2.655  -0.460 -10.737
  523   2HB   GLN  71          1HB       GLN  71  -4.057  -0.231 -11.782
  524   1HG   GLN  71          2HG       GLN  71  -2.885   1.159 -13.267
  525   2HG   GLN  71          1HG       GLN  71  -1.647   1.549 -12.073
  526   1HE2  GLN  71          1HE2      GLN  71  -0.016  -0.148 -11.586
  527   2HE2  GLN  71          2HE2      GLN  71   0.269  -1.400 -12.696
  528    HA   PRO  72           HA       PRO  72  -7.284   1.022  -8.459
  529   1HB   PRO  72          2HB       PRO  72  -9.213   0.543 -10.361
  530   2HB   PRO  72          1HB       PRO  72  -8.690   2.165  -9.880
  531   1HG   PRO  72          2HG       PRO  72  -8.058   0.651 -12.370
  532   2HG   PRO  72          1HG       PRO  72  -8.124   2.401 -12.108
  533   1HD   PRO  72          2HD       PRO  72  -5.770   0.842 -12.250
  534   2HD   PRO  72          1HD       PRO  72  -5.880   2.509 -11.647
  535    H    ALA  73           H        ALA  73  -8.263  -0.873  -7.639
  536    HA   ALA  73           HA       ALA  73  -7.098  -3.385  -8.109
  537   1HB   ALA  73          1HB       ALA  73  -9.535  -2.410  -6.738
  538   2HB   ALA  73          2HB       ALA  73  -8.271  -3.492  -6.156
  539   3HB   ALA  73          3HB       ALA  73  -9.554  -4.113  -7.193
  540    H    GLY  74           H        GLY  74 -10.052  -2.022  -9.582
  541   1HA   GLY  74          2HA       GLY  74 -10.890  -4.339 -11.002
  542   2HA   GLY  74          1HA       GLY  74 -11.247  -2.683 -11.490
  543    H    ASN  75           H        ASN  75  -8.712  -1.685 -12.024
  544    HA   ASN  75           HA       ASN  75  -8.162  -2.792 -14.629
  545   1HB   ASN  75          2HB       ASN  75  -7.768  -0.390 -13.885
  546   2HB   ASN  75          1HB       ASN  75  -6.334  -0.975 -13.040
  547   1HD2  ASN  75          1HD2      ASN  75  -7.806  -0.714 -16.298
  548   2HD2  ASN  75          2HD2      ASN  75  -6.339  -0.837 -17.142
  549    H    ILE  76           H        ILE  76  -6.637  -3.191 -11.448
  550    HA   ILE  76           HA       ILE  76  -4.246  -4.495 -12.278
  551    HB   ILE  76           HB       ILE  76  -5.895  -4.850  -9.753
  552   1HG1  ILE  76          2HG1      ILE  76  -4.985  -2.561 -10.205
  553   2HG1  ILE  76          1HG1      ILE  76  -4.287  -3.302  -8.769
  554   1HG2  ILE  76          1HG2      ILE  76  -3.244  -5.977 -10.610
  555   2HG2  ILE  76          2HG2      ILE  76  -4.549  -6.755  -9.715
  556   3HG2  ILE  76          3HG2      ILE  76  -3.508  -5.580  -8.912
  557   1HD1  ILE  76          1HD1      ILE  76  -2.960  -2.399 -11.178
  558   2HD1  ILE  76          2HD1      ILE  76  -2.643  -4.114 -10.913
  559   3HD1  ILE  76          3HD1      ILE  76  -2.249  -2.939  -9.657
  560    H    PHE  77           H        PHE  77  -7.492  -5.807 -11.599
  561    HA   PHE  77           HA       PHE  77  -6.696  -8.566 -12.106
  562   1HB   PHE  77          2HB       PHE  77  -8.709  -7.629 -10.702
  563   2HB   PHE  77          1HB       PHE  77  -9.539  -7.594 -12.256
  564    HD1  PHE  77           HD1      PHE  77  -8.381  -9.673  -9.531
  565    HD2  PHE  77           HD2      PHE  77  -9.674  -9.731 -13.627
  566    HE1  PHE  77           HE1      PHE  77  -8.809 -12.109  -9.364
  567    HE2  PHE  77           HE2      PHE  77 -10.100 -12.167 -13.458
  568    HZ   PHE  77           HZ       PHE  77  -9.667 -13.356 -11.326
  569    H    LEU  78           H        LEU  78  -8.322  -6.006 -13.977
  570    HA   LEU  78           HA       LEU  78  -8.953  -7.641 -16.259
  571   1HB   LEU  78          2HB       LEU  78  -8.598  -4.652 -15.928
  572   2HB   LEU  78          1HB       LEU  78  -9.103  -5.395 -17.445
  573    HG   LEU  78           HG       LEU  78 -10.549  -5.960 -14.853
  574   1HD1  LEU  78          1HD1      LEU  78 -12.038  -4.148 -16.468
  575   2HD1  LEU  78          2HD1      LEU  78 -10.430  -3.457 -16.257
  576   3HD1  LEU  78          3HD1      LEU  78 -11.401  -3.878 -14.847
  577   1HD2  LEU  78          1HD2      LEU  78 -10.734  -7.231 -17.206
  578   2HD2  LEU  78          2HD2      LEU  78 -11.819  -5.886 -17.559
  579   3HD2  LEU  78          3HD2      LEU  78 -12.150  -6.951 -16.194
  580    H    LYS  79           H        LYS  79  -6.117  -5.631 -15.463
  581    HA   LYS  79           HA       LYS  79  -4.868  -6.221 -18.065
  582   1HB   LYS  79          2HB       LYS  79  -4.583  -4.208 -16.079
  583   2HB   LYS  79          1HB       LYS  79  -3.034  -5.044 -16.193
  584   1HG   LYS  79          2HG       LYS  79  -3.184  -4.785 -18.703
  585   2HG   LYS  79          1HG       LYS  79  -4.587  -3.748 -18.446
  586   1HD   LYS  79          2HD       LYS  79  -3.267  -1.994 -17.949
  587   2HD   LYS  79          1HD       LYS  79  -2.432  -2.925 -16.707
  588   1HE   LYS  79          2HE       LYS  79  -1.596  -3.855 -19.299
  589   2HE   LYS  79          1HE       LYS  79  -1.422  -2.103 -19.233
  590   1HZ   LYS  79          1HZ       LYS  79   0.210  -4.046 -18.058
  591   2HZ   LYS  79          2HZ       LYS  79  -0.531  -3.179 -16.799
  592   3HZ   LYS  79          3HZ       LYS  79   0.370  -2.360 -17.985
  593    H    HIS  80           H        HIS  80  -4.023  -6.851 -14.629
  594    HA   HIS  80           HA       HIS  80  -2.033  -8.854 -15.525
  595   1HB   HIS  80          2HB       HIS  80  -2.667  -8.095 -12.666
  596   2HB   HIS  80          1HB       HIS  80  -1.182  -8.802 -13.300
  597    HD1  HIS  80           HD1      HIS  80   0.038  -7.169 -15.210
  598    HD2  HIS  80           HD2      HIS  80  -2.518  -5.348 -12.467
  599    HE1  HIS  80           HE1      HIS  80   0.575  -4.694 -15.263
  600    H    GLY  81           H        GLY  81  -4.604  -8.857 -13.003
  601   1HA   GLY  81          2HA       GLY  81  -6.369 -10.695 -13.428
  602   2HA   GLY  81          1HA       GLY  81  -4.979 -11.770 -13.575
  603    H    SER  82           H        SER  82  -5.108 -13.040 -11.763
  604    HA   SER  82           HA       SER  82  -5.409 -11.665  -9.122
  605   1HB   SER  82          2HB       SER  82  -6.136 -13.931  -8.290
  606   2HB   SER  82          1HB       SER  82  -7.225 -13.216  -9.471
  607    HG   SER  82           HG       SER  82  -6.890 -15.259 -10.175
  608    H    GLU  83           H        GLU  83  -3.691 -14.361 -10.751
  609    HA   GLU  83           HA       GLU  83  -1.905 -14.904  -8.574
  610   1HB   GLU  83          2HB       GLU  83  -2.421 -16.170 -10.901
  611   2HB   GLU  83          1HB       GLU  83  -0.928 -15.348 -11.351
  612   1HG   GLU  83          2HG       GLU  83  -1.253 -17.061  -8.868
  613   2HG   GLU  83          1HG       GLU  83  -0.538 -17.625 -10.378
  614    H    LEU  84           H        LEU  84  -0.524 -13.432  -7.753
  615    HA   LEU  84           HA       LEU  84   1.147 -11.834  -9.640
  616   1HB   LEU  84          2HB       LEU  84  -0.399 -10.823  -7.242
  617   2HB   LEU  84          1HB       LEU  84   0.958  -9.935  -7.933
  618    HG   LEU  84           HG       LEU  84  -1.019 -10.848  -9.923
  619   1HD1  LEU  84          1HD1      LEU  84  -1.776  -9.047  -7.634
  620   2HD1  LEU  84          2HD1      LEU  84  -2.719 -10.329  -8.394
  621   3HD1  LEU  84          3HD1      LEU  84  -2.484  -8.794  -9.229
  622   1HD2  LEU  84          1HD2      LEU  84   1.004  -9.189 -10.087
  623   2HD2  LEU  84          2HD2      LEU  84  -0.122  -8.021  -9.396
  624   3HD2  LEU  84          3HD2      LEU  84  -0.490  -8.798 -10.936
  625    H    ARG  85           H        ARG  85   3.162 -11.054  -8.606
  626    HA   ARG  85           HA       ARG  85   4.018 -12.739  -6.278
  627   1HB   ARG  85          2HB       ARG  85   5.161 -12.467  -8.976
  628   2HB   ARG  85          1HB       ARG  85   6.338 -12.191  -7.694
  629   1HG   ARG  85          2HG       ARG  85   6.415 -14.531  -8.090
  630   2HG   ARG  85          1HG       ARG  85   5.443 -14.355  -6.631
  631   1HD   ARG  85          2HD       ARG  85   4.372 -15.934  -8.183
  632   2HD   ARG  85          1HD       ARG  85   3.380 -14.490  -7.996
  633    HE   ARG  85           HE       ARG  85   3.901 -13.880 -10.247
  634   1HH1  ARG  85          1HH2      ARG  85   3.564 -16.755 -10.842
  635   2HH1  ARG  85          2HH2      ARG  85   5.037 -17.157 -11.658
  636   1HH2  ARG  85          2HH1      ARG  85   6.725 -14.331 -10.563
  637   2HH2  ARG  85          1HH1      ARG  85   6.830 -15.782 -11.500
  638    H    LEU  86           H        LEU  86   5.382 -11.662  -4.754
  639    HA   LEU  86           HA       LEU  86   5.479  -8.697  -5.110
  640   1HB   LEU  86          2HB       LEU  86   4.288  -9.695  -3.088
  641   2HB   LEU  86          1HB       LEU  86   5.877 -10.206  -2.517
  642    HG   LEU  86           HG       LEU  86   5.970  -7.442  -3.368
  643   1HD1  LEU  86          1HD1      LEU  86   4.305  -7.564  -0.938
  644   2HD1  LEU  86          2HD1      LEU  86   3.462  -8.028  -2.416
  645   3HD1  LEU  86          3HD1      LEU  86   4.232  -6.445  -2.298
  646   1HD2  LEU  86          1HD2      LEU  86   7.219  -9.060  -1.547
  647   2HD2  LEU  86          2HD2      LEU  86   6.167  -8.114  -0.495
  648   3HD2  LEU  86          3HD2      LEU  86   7.327  -7.300  -1.543
  649    H    ILE  87           H        ILE  87   7.407  -7.720  -5.355
  650    HA   ILE  87           HA       ILE  87   9.876  -9.161  -4.505
  651    HB   ILE  87           HB       ILE  87   9.768  -9.480  -6.899
  652   1HG1  ILE  87          2HG1      ILE  87  11.597  -7.105  -6.472
  653   2HG1  ILE  87          1HG1      ILE  87  11.948  -8.700  -5.809
  654   1HG2  ILE  87          1HG2      ILE  87   9.881  -6.787  -7.877
  655   2HG2  ILE  87          2HG2      ILE  87   8.454  -6.947  -6.856
  656   3HG2  ILE  87          3HG2      ILE  87   8.681  -8.029  -8.229
  657   1HD1  ILE  87          1HD1      ILE  87  12.015  -7.766  -8.630
  658   2HD1  ILE  87          2HD1      ILE  87  11.402  -9.397  -8.360
  659   3HD1  ILE  87          3HD1      ILE  87  13.022  -8.962  -7.817
  660    HA   PRO  88           HA       PRO  88  10.431  -5.191  -2.578
  661   1HB   PRO  88          2HB       PRO  88  12.752  -5.877  -1.284
  662   2HB   PRO  88          1HB       PRO  88  11.140  -6.342  -0.715
  663   1HG   PRO  88          2HG       PRO  88  13.220  -8.011  -2.050
  664   2HG   PRO  88          1HG       PRO  88  11.936  -8.500  -0.932
  665   1HD   PRO  88          2HD       PRO  88  11.893  -8.826  -3.739
  666   2HD   PRO  88          1HD       PRO  88  10.498  -8.982  -2.649
  667    H    ARG  89           H        ARG  89  11.422  -3.387  -3.407
  668    HA   ARG  89           HA       ARG  89  13.419  -3.629  -5.518
  669   1HB   ARG  89          2HB       ARG  89  12.135  -1.269  -4.121
  670   2HB   ARG  89          1HB       ARG  89  13.371  -1.073  -5.364
  671   1HG   ARG  89          2HG       ARG  89  11.985  -2.310  -6.970
  672   2HG   ARG  89          1HG       ARG  89  10.758  -2.571  -5.728
  673   1HD   ARG  89          2HD       ARG  89  11.311   0.217  -5.764
  674   2HD   ARG  89          1HD       ARG  89  11.115  -0.288  -7.442
  675    HE   ARG  89           HE       ARG  89   8.990  -1.464  -6.015
  676   1HH1  ARG  89          2HH1      ARG  89   8.694   0.468  -8.328
  677   2HH1  ARG  89          1HH1      ARG  89   7.833   1.775  -7.589
  678   1HH2  ARG  89          1HH2      ARG  89   8.529   0.740  -4.344
  679   2HH2  ARG  89          2HH2      ARG  89   7.737   1.931  -5.322
  680    H    ASP  90           H        ASP  90  13.439  -1.961  -2.333
  681    HA   ASP  90           HA       ASP  90  16.402  -2.395  -2.258
  682   1HB   ASP  90          2HB       ASP  90  14.675  -0.118  -1.294
  683   2HB   ASP  90          1HB       ASP  90  16.253  -0.413  -0.563
  684    H    ARG  91           H        ARG  91  15.847  -4.535  -1.330
  685    HA   ARG  91           HA       ARG  91  15.645  -4.371   1.612
  686   1HB   ARG  91          2HB       ARG  91  13.410  -5.085  -0.028
  687   2HB   ARG  91          1HB       ARG  91  13.936  -6.526   0.841
  688   1HG   ARG  91          2HG       ARG  91  14.020  -4.287   2.637
  689   2HG   ARG  91          1HG       ARG  91  12.443  -4.318   1.848
  690   1HD   ARG  91          2HD       ARG  91  11.871  -5.907   3.351
  691   2HD   ARG  91          1HD       ARG  91  12.919  -6.995   2.442
  692    HE   ARG  91           HE       ARG  91  14.547  -6.799   4.154
  693   1HH1  ARG  91          1HH2      ARG  91  12.063  -6.497   5.901
  694   2HH1  ARG  91          2HH2      ARG  91  12.497  -5.126   6.866
  695   1HH2  ARG  91          2HH1      ARG  91  15.105  -4.163   4.790
  696   2HH2  ARG  91          1HH1      ARG  91  14.222  -3.804   6.236
  697    H    VAL  92           H        VAL  92  16.357  -6.368   2.648
  698    HA   VAL  92           HA       VAL  92  18.429  -7.737   1.114
  699    HB   VAL  92           HB       VAL  92  18.841  -8.987   3.232
  700   1HG1  VAL  92          1HG1      VAL  92  18.915  -6.590   4.599
  701   2HG1  VAL  92          2HG1      VAL  92  18.865  -6.064   2.916
  702   3HG1  VAL  92          3HG1      VAL  92  20.143  -7.149   3.463
  703   1HG2  VAL  92          1HG2      VAL  92  16.569  -7.306   4.344
  704   2HG2  VAL  92          2HG2      VAL  92  17.538  -8.488   5.222
  705   3HG2  VAL  92          3HG2      VAL  92  16.431  -9.021   3.958
  706    H    GLY  93           H        GLY  93  15.134  -8.483   2.105
  707   1HA   GLY  93          2HA       GLY  93  13.989 -10.157   0.615
  708   2HA   GLY  93          1HA       GLY  93  15.417 -11.174   0.815
  709    H    HIS  94           HN       HIS  94  12.764  -9.646   2.627
  710    HA   HIS  94           HA       HIS  94  12.753 -12.009   4.439
  711   1HB   HIS  94          2HB       HIS  94  13.883  -9.710   5.291
  712   2HB   HIS  94          1HB       HIS  94  12.200  -9.370   5.696
  713    HD1  HIS  94           HD1      HIS  94  15.084 -11.546   6.629
  714    HD2  HIS  94           HD2      HIS  94  11.054 -11.175   7.621
  715    HE1  HIS  94           HE1      HIS  94  14.733 -12.934   8.715
  Start of MODEL    7
    1   1H    MET   1          1H        MET   1 -23.365  -4.497  -3.449
    2   2H    MET   1          2H        MET   1 -24.587  -3.663  -4.284
    3   3H    MET   1          3H        MET   1 -23.996  -3.061  -2.806
    4    HA   MET   1           HA       MET   1 -22.429  -3.320  -5.311
    5   1HB   MET   1          2HB       MET   1 -24.043  -1.120  -4.110
    6   2HB   MET   1          1HB       MET   1 -22.498  -0.680  -4.854
    7   1HG   MET   1          2HG       MET   1 -24.291  -2.542  -6.356
    8   2HG   MET   1          1HG       MET   1 -24.752  -0.840  -6.294
    9   1HE   MET   1          1HE       MET   1 -21.651  -2.916  -8.725
   10   2HE   MET   1          2HE       MET   1 -23.402  -2.948  -8.891
   11   3HE   MET   1          3HE       MET   1 -22.658  -3.550  -7.415
   12    H    SER   2           H        SER   2 -20.457  -3.969  -4.545
   13    HA   SER   2           HA       SER   2 -19.429  -2.987  -1.962
   14   1HB   SER   2          2HB       SER   2 -17.341  -4.300  -2.767
   15   2HB   SER   2          1HB       SER   2 -18.788  -5.223  -2.376
   16    HG   SER   2           HG       SER   2 -17.499  -4.873  -4.764
   17    H    GLY   3           H        GLY   3 -18.342  -2.818  -5.379
   18   1HA   GLY   3          2HA       GLY   3 -16.785  -0.370  -4.650
   19   2HA   GLY   3          1HA       GLY   3 -16.381  -1.440  -5.993
   20    H    GLY   4           H        GLY   4 -17.422   1.546  -5.551
   21   1HA   GLY   4          2HA       GLY   4 -18.245   2.280  -8.003
   22   2HA   GLY   4          1HA       GLY   4 -19.719   1.509  -7.417
   23    H    THR   5           H        THR   5 -20.996   2.591  -5.916
   24    HA   THR   5           HA       THR   5 -20.241   5.426  -5.389
   25    HB   THR   5           HB       THR   5 -22.924   4.007  -5.202
   26    HG1  THR   5           HG1      THR   5 -23.148   4.617  -7.190
   27   1HG2  THR   5          1HG2      THR   5 -23.046   6.891  -5.317
   28   2HG2  THR   5          2HG2      THR   5 -22.061   6.389  -3.943
   29   3HG2  THR   5          3HG2      THR   5 -23.717   5.803  -4.101
   30    H    ALA   6           H        ALA   6 -21.905   2.753  -3.662
   31    HA   ALA   6           HA       ALA   6 -20.718   3.793  -1.117
   32   1HB   ALA   6          1HB       ALA   6 -22.593   2.853   0.045
   33   2HB   ALA   6          2HB       ALA   6 -23.114   1.961  -1.381
   34   3HB   ALA   6          3HB       ALA   6 -23.258   3.716  -1.340
   35    H    ALA   7           H        ALA   7 -19.727   2.300   0.293
   36    HA   ALA   7           HA       ALA   7 -18.826  -0.226  -0.984
   37   1HB   ALA   7          1HB       ALA   7 -17.716   0.169   1.639
   38   2HB   ALA   7          2HB       ALA   7 -17.618   1.688   0.753
   39   3HB   ALA   7          3HB       ALA   7 -16.888   0.231   0.083
   40    H    THR   8           H        THR   8 -21.590   0.001  -0.034
   41    HA   THR   8           HA       THR   8 -21.589  -1.769   2.367
   42    HB   THR   8           HB       THR   8 -24.227  -0.969   1.415
   43    HG1  THR   8           HG1      THR   8 -23.882   1.051   1.066
   44   1HG2  THR   8          1HG2      THR   8 -23.603  -1.835   3.683
   45   2HG2  THR   8          2HG2      THR   8 -24.497  -0.315   3.731
   46   3HG2  THR   8          3HG2      THR   8 -22.751  -0.317   3.980
   47    H    THR   9           H        THR   9 -22.361  -3.850   2.241
   48    HA   THR   9           HA       THR   9 -23.268  -5.811   1.339
   49    HB   THR   9           HB       THR   9 -24.234  -4.113  -0.981
   50    HG1  THR   9           HG1      THR   9 -25.253  -4.533   1.613
   51   1HG2  THR   9          1HG2      THR   9 -25.839  -5.855  -1.324
   52   2HG2  THR   9          2HG2      THR   9 -25.407  -6.642   0.195
   53   3HG2  THR   9          3HG2      THR   9 -24.271  -6.647  -1.157
   54    H    ALA  10           H        ALA  10 -22.243  -7.402   0.220
   55    HA   ALA  10           HA       ALA  10 -19.901  -6.676  -1.388
   56   1HB   ALA  10          1HB       ALA  10 -19.425  -8.495  -0.017
   57   2HB   ALA  10          2HB       ALA  10 -19.829  -9.316  -1.525
   58   3HB   ALA  10          3HB       ALA  10 -21.024  -9.207  -0.232
   59    H    GLY  11           H        GLY  11 -20.349  -6.040  -3.454
   60   1HA   GLY  11          2HA       GLY  11 -22.398  -7.530  -5.021
   61   2HA   GLY  11          1HA       GLY  11 -21.777  -5.930  -5.423
   62    H    SER  12           H        SER  12 -19.439  -5.835  -6.105
   63    HA   SER  12           HA       SER  12 -18.445  -8.407  -7.243
   64   1HB   SER  12          2HB       SER  12 -19.253  -5.944  -8.711
   65   2HB   SER  12          1HB       SER  12 -17.795  -6.761  -9.266
   66    HG   SER  12           HG       SER  12 -20.362  -7.445  -9.619
   67    H    LYS  13           H        LYS  13 -16.530  -8.622  -6.179
   68    HA   LYS  13           HA       LYS  13 -14.698  -6.248  -6.073
   69   1HB   LYS  13          2HB       LYS  13 -14.818  -8.609  -4.168
   70   2HB   LYS  13          1HB       LYS  13 -13.707  -7.247  -4.053
   71   1HG   LYS  13          2HG       LYS  13 -15.398  -5.746  -3.443
   72   2HG   LYS  13          1HG       LYS  13 -16.674  -6.754  -4.126
   73   1HD   LYS  13          2HD       LYS  13 -16.839  -8.051  -2.258
   74   2HD   LYS  13          1HD       LYS  13 -15.102  -8.018  -1.962
   75   1HE   LYS  13          2HE       LYS  13 -16.160  -5.367  -1.607
   76   2HE   LYS  13          1HE       LYS  13 -17.105  -6.501  -0.644
   77   1HZ   LYS  13          1HZ       LYS  13 -14.988  -7.382   0.233
   78   2HZ   LYS  13          2HZ       LYS  13 -15.246  -5.755   0.637
   79   3HZ   LYS  13          3HZ       LYS  13 -14.155  -6.163  -0.602
   80    H    VAL  14           H        VAL  14 -12.373  -6.797  -6.246
   81    HA   VAL  14           HA       VAL  14 -11.948  -9.163  -8.019
   82    HB   VAL  14           HB       VAL  14  -9.863  -7.995  -8.732
   83   1HG1  VAL  14          1HG1      VAL  14 -12.126  -7.660  -9.847
   84   2HG1  VAL  14          2HG1      VAL  14 -10.954  -6.369 -10.113
   85   3HG1  VAL  14          3HG1      VAL  14 -12.255  -6.151  -8.942
   86   1HG2  VAL  14          1HG2      VAL  14  -9.456  -5.694  -8.045
   87   2HG2  VAL  14          2HG2      VAL  14  -9.551  -6.703  -6.602
   88   3HG2  VAL  14          3HG2      VAL  14 -10.919  -5.689  -7.061
   89    H    THR  15           H        THR  15 -10.497 -10.759  -7.433
   90    HA   THR  15           HA       THR  15  -9.394 -10.593  -4.671
   91    HB   THR  15           HB       THR  15  -9.020 -13.080  -5.002
   92    HG1  THR  15           HG1      THR  15  -9.414 -13.901  -6.881
   93   1HG2  THR  15          1HG2      THR  15 -11.785 -13.218  -5.392
   94   2HG2  THR  15          2HG2      THR  15 -11.515 -11.616  -4.704
   95   3HG2  THR  15          3HG2      THR  15 -10.952 -13.051  -3.847
   96    H    PHE  16           H        PHE  16  -7.187 -10.934  -4.244
   97    HA   PHE  16           HA       PHE  16  -5.379 -11.069  -6.624
   98   1HB   PHE  16          2HB       PHE  16  -5.129  -9.253  -4.209
   99   2HB   PHE  16          1HB       PHE  16  -3.848  -9.497  -5.394
  100    HD1  PHE  16           HD1      PHE  16  -4.696  -9.264  -7.946
  101    HD2  PHE  16           HD2      PHE  16  -6.535  -7.426  -4.525
  102    HE1  PHE  16           HE1      PHE  16  -5.729  -7.558  -9.417
  103    HE2  PHE  16           HE2      PHE  16  -7.567  -5.722  -5.998
  104    HZ   PHE  16           HZ       PHE  16  -7.165  -5.788  -8.442
  105    H    LYS  17           H        LYS  17  -3.474 -12.245  -6.315
  106    HA   LYS  17           HA       LYS  17  -3.107 -13.562  -3.657
  107   1HB   LYS  17          2HB       LYS  17  -4.212 -15.037  -5.467
  108   2HB   LYS  17          1HB       LYS  17  -2.645 -15.001  -6.277
  109   1HG   LYS  17          2HG       LYS  17  -2.392 -15.588  -3.425
  110   2HG   LYS  17          1HG       LYS  17  -3.400 -16.769  -4.259
  111   1HD   LYS  17          2HD       LYS  17  -0.903 -15.973  -5.657
  112   2HD   LYS  17          1HD       LYS  17  -0.698 -16.929  -4.190
  113   1HE   LYS  17          2HE       LYS  17  -2.316 -18.599  -5.092
  114   2HE   LYS  17          1HE       LYS  17  -2.405 -17.667  -6.584
  115   1HZ   LYS  17          1HZ       LYS  17  -0.061 -18.003  -6.929
  116   2HZ   LYS  17          2HZ       LYS  17  -0.818 -19.510  -6.715
  117   3HZ   LYS  17          3HZ       LYS  17   0.084 -18.822  -5.451
  118    H    ILE  18           H        ILE  18  -1.248 -12.542  -3.006
  119    HA   ILE  18           HA       ILE  18   0.956 -12.192  -4.981
  120    HB   ILE  18           HB       ILE  18   0.637 -11.041  -2.188
  121   1HG1  ILE  18          2HG1      ILE  18   0.545  -8.946  -3.954
  122   2HG1  ILE  18          1HG1      ILE  18  -0.287 -10.201  -4.871
  123   1HG2  ILE  18          1HG2      ILE  18   2.765 -10.903  -4.285
  124   2HG2  ILE  18          2HG2      ILE  18   2.920 -10.909  -2.528
  125   3HG2  ILE  18          3HG2      ILE  18   2.421  -9.439  -3.364
  126   1HD1  ILE  18          1HD1      ILE  18  -1.423  -8.605  -2.897
  127   2HD1  ILE  18          2HD1      ILE  18  -1.128 -10.135  -2.071
  128   3HD1  ILE  18          3HD1      ILE  18  -2.108 -10.100  -3.536
  129    H    THR  19           H        THR  19   2.815 -13.353  -4.824
  130    HA   THR  19           HA       THR  19   3.315 -14.952  -2.347
  131    HB   THR  19           HB       THR  19   3.622 -15.960  -5.197
  132    HG1  THR  19           HG1      THR  19   1.635 -16.537  -4.970
  133   1HG2  THR  19          1HG2      THR  19   4.075 -17.255  -2.496
  134   2HG2  THR  19          2HG2      THR  19   5.287 -16.943  -3.740
  135   3HG2  THR  19          3HG2      THR  19   4.025 -18.144  -4.019
  136    H    LEU  20           H        LEU  20   5.508 -15.079  -1.774
  137    HA   LEU  20           HA       LEU  20   7.289 -13.069  -2.730
  138   1HB   LEU  20          2HB       LEU  20   7.294 -15.006  -0.668
  139   2HB   LEU  20          1HB       LEU  20   8.745 -15.311  -1.619
  140    HG   LEU  20           HG       LEU  20   9.242 -13.691   0.146
  141   1HD1  LEU  20          1HD1      LEU  20  10.279 -13.449  -2.145
  142   2HD1  LEU  20          2HD1      LEU  20  10.229 -11.958  -1.204
  143   3HD1  LEU  20          3HD1      LEU  20   9.059 -12.224  -2.497
  144   1HD2  LEU  20          1HD2      LEU  20   6.868 -12.253  -1.042
  145   2HD2  LEU  20          2HD2      LEU  20   8.083 -11.394  -0.097
  146   3HD2  LEU  20          3HD2      LEU  20   7.153 -12.697   0.640
  147    H    THR  21           H        THR  21   8.202 -12.997  -4.709
  148    HA   THR  21           HA       THR  21   8.399 -15.322  -6.428
  149    HB   THR  21           HB       THR  21   8.063 -12.973  -7.253
  150    HG1  THR  21           HG1      THR  21   8.739 -14.026  -8.929
  151   1HG2  THR  21          1HG2      THR  21   9.728 -11.354  -7.159
  152   2HG2  THR  21          2HG2      THR  21  11.016 -12.541  -6.958
  153   3HG2  THR  21          3HG2      THR  21   9.951 -12.157  -5.606
  154    H    SER  22           H        SER  22  10.671 -13.611  -4.317
  155    HA   SER  22           HA       SER  22  13.034 -14.956  -5.325
  156   1HB   SER  22          2HB       SER  22  12.427 -12.959  -3.337
  157   2HB   SER  22          1HB       SER  22  13.467 -14.192  -2.630
  158    HG   SER  22           HG       SER  22  14.790 -12.731  -3.635
  159    H    ASP  23           H        ASP  23  11.043 -15.416  -2.370
  160    HA   ASP  23           HA       ASP  23  11.530 -18.306  -2.490
  161   1HB   ASP  23          2HB       ASP  23  13.547 -17.291  -1.306
  162   2HB   ASP  23          1HB       ASP  23  12.440 -16.812  -0.018
  163    HA   PRO  24           HA       PRO  24   7.444 -17.497  -0.753
  164   1HB   PRO  24          2HB       PRO  24   6.386 -19.862  -1.681
  165   2HB   PRO  24          1HB       PRO  24   6.510 -18.391  -2.661
  166   1HG   PRO  24          2HG       PRO  24   8.151 -20.876  -2.791
  167   2HG   PRO  24          1HG       PRO  24   7.802 -19.694  -4.063
  168   1HD   PRO  24          2HD       PRO  24  10.209 -19.878  -2.585
  169   2HD   PRO  24          1HD       PRO  24   9.718 -18.519  -3.618
  170    H    LYS  25           H        LYS  25   6.664 -18.166   1.247
  171    HA   LYS  25           HA       LYS  25   8.190 -20.239   2.694
  172   1HB   LYS  25          2HB       LYS  25   6.255 -18.074   3.444
  173   2HB   LYS  25          1HB       LYS  25   6.464 -19.435   4.546
  174   1HG   LYS  25          2HG       LYS  25   8.341 -18.469   5.322
  175   2HG   LYS  25          1HG       LYS  25   9.064 -18.674   3.726
  176   1HD   LYS  25          2HD       LYS  25   7.235 -16.433   3.698
  177   2HD   LYS  25          1HD       LYS  25   8.412 -16.235   4.995
  178   1HE   LYS  25          2HE       LYS  25  10.097 -15.853   3.539
  179   2HE   LYS  25          1HE       LYS  25   9.637 -17.225   2.534
  180   1HZ   LYS  25          1HZ       LYS  25   7.875 -15.864   1.568
  181   2HZ   LYS  25          2HZ       LYS  25   9.409 -15.177   1.316
  182   3HZ   LYS  25          3HZ       LYS  25   8.374 -14.539   2.503
  183    H    LEU  26           H        LEU  26   4.688 -19.527   2.430
  184    HA   LEU  26           HA       LEU  26   3.922 -22.119   1.502
  185   1HB   LEU  26          2HB       LEU  26   4.540 -22.019   4.300
  186   2HB   LEU  26          1HB       LEU  26   2.797 -22.222   4.129
  187    HG   LEU  26           HG       LEU  26   4.541 -23.886   2.368
  188   1HD1  LEU  26          1HD1      LEU  26   4.814 -25.570   4.163
  189   2HD1  LEU  26          2HD1      LEU  26   4.112 -24.440   5.322
  190   3HD1  LEU  26          3HD1      LEU  26   5.657 -24.071   4.556
  191   1HD2  LEU  26          1HD2      LEU  26   1.876 -24.073   3.755
  192   2HD2  LEU  26          2HD2      LEU  26   2.680 -25.545   3.209
  193   3HD2  LEU  26          3HD2      LEU  26   2.256 -24.289   2.046
  194    HA   PRO  27           HA       PRO  27   0.040 -19.697   2.884
  195   1HB   PRO  27          2HB       PRO  27   0.361 -17.558   4.585
  196   2HB   PRO  27          1HB       PRO  27   0.085 -19.218   5.141
  197   1HG   PRO  27          2HG       PRO  27   2.602 -17.623   5.165
  198   2HG   PRO  27          1HG       PRO  27   2.111 -18.962   6.216
  199   1HD   PRO  27          2HD       PRO  27   3.916 -19.133   4.047
  200   2HD   PRO  27          1HD       PRO  27   3.167 -20.502   4.894
  201    H    PHE  28           H        PHE  28  -0.609 -18.470   1.156
  202    HA   PHE  28           HA       PHE  28   1.205 -16.381   0.095
  203   1HB   PHE  28          2HB       PHE  28  -1.405 -17.407  -1.063
  204   2HB   PHE  28          1HB       PHE  28  -0.198 -16.426  -1.892
  205    HD1  PHE  28           HD1      PHE  28  -1.398 -19.648  -1.676
  206    HD2  PHE  28           HD2      PHE  28   2.331 -17.514  -1.535
  207    HE1  PHE  28           HE1      PHE  28  -0.193 -21.705  -2.355
  208    HE2  PHE  28           HE2      PHE  28   3.532 -19.574  -2.214
  209    HZ   PHE  28           HZ       PHE  28   2.270 -21.666  -2.624
  210    H    LYS  29           H        LYS  29   0.479 -14.213  -0.289
  211    HA   LYS  29           HA       LYS  29  -1.434 -13.253   1.723
  212   1HB   LYS  29          2HB       LYS  29   0.728 -12.115   0.121
  213   2HB   LYS  29          1HB       LYS  29  -0.699 -11.079   0.132
  214   1HG   LYS  29          2HG       LYS  29   0.445 -10.373   2.052
  215   2HG   LYS  29          1HG       LYS  29  -0.708 -11.535   2.705
  216   1HD   LYS  29          2HD       LYS  29   1.738 -12.848   1.827
  217   2HD   LYS  29          1HD       LYS  29   2.071 -11.601   3.028
  218   1HE   LYS  29          2HE       LYS  29   0.833 -12.660   4.677
  219   2HE   LYS  29          1HE       LYS  29  -0.221 -13.464   3.515
  220   1HZ   LYS  29          1HZ       LYS  29   1.404 -15.039   3.018
  221   2HZ   LYS  29          2HZ       LYS  29   1.490 -14.882   4.708
  222   3HZ   LYS  29          3HZ       LYS  29   2.652 -14.130   3.720
  223    H    VAL  30           H        VAL  30  -3.518 -13.777   1.092
  224    HA   VAL  30           HA       VAL  30  -4.382 -13.073  -1.669
  225    HB   VAL  30           HB       VAL  30  -5.890 -14.577   0.497
  226   1HG1  VAL  30          1HG1      VAL  30  -6.993 -13.332  -1.617
  227   2HG1  VAL  30          2HG1      VAL  30  -7.590 -14.882  -1.026
  228   3HG1  VAL  30          3HG1      VAL  30  -6.500 -14.828  -2.412
  229   1HG2  VAL  30          1HG2      VAL  30  -4.401 -15.628  -1.933
  230   2HG2  VAL  30          2HG2      VAL  30  -5.302 -16.598  -0.766
  231   3HG2  VAL  30          3HG2      VAL  30  -3.834 -15.759  -0.267
  232    H    LEU  31           H        LEU  31  -5.301 -11.101  -1.938
  233    HA   LEU  31           HA       LEU  31  -6.717  -9.870   0.397
  234   1HB   LEU  31          2HB       LEU  31  -4.760  -8.768  -1.557
  235   2HB   LEU  31          1HB       LEU  31  -6.101  -7.715  -1.105
  236    HG   LEU  31           HG       LEU  31  -5.080  -9.004   1.257
  237   1HD1  LEU  31          1HD1      LEU  31  -3.034  -7.512  -0.414
  238   2HD1  LEU  31          2HD1      LEU  31  -2.977  -9.225   0.003
  239   3HD1  LEU  31          3HD1      LEU  31  -2.813  -8.005   1.265
  240   1HD2  LEU  31          1HD2      LEU  31  -6.331  -6.764   0.859
  241   2HD2  LEU  31          2HD2      LEU  31  -4.737  -6.104   0.490
  242   3HD2  LEU  31          3HD2      LEU  31  -5.061  -6.788   2.083
  243    H    SER  32           H        SER  32  -8.861  -9.659   0.068
  244    HA   SER  32           HA       SER  32  -9.887  -9.595  -2.738
  245   1HB   SER  32          2HB       SER  32 -10.628 -11.281  -0.746
  246   2HB   SER  32          1HB       SER  32 -11.770  -9.969  -0.466
  247    HG   SER  32           HG       SER  32 -12.421 -11.647  -2.013
  248    H    VAL  33           H        VAL  33 -10.069  -7.472  -3.333
  249    HA   VAL  33           HA       VAL  33 -11.628  -5.667  -1.533
  250    HB   VAL  33           HB       VAL  33 -10.121  -3.782  -2.316
  251   1HG1  VAL  33          1HG1      VAL  33  -9.097  -6.052  -0.610
  252   2HG1  VAL  33          2HG1      VAL  33  -9.774  -4.508  -0.092
  253   3HG1  VAL  33          3HG1      VAL  33  -8.169  -4.567  -0.820
  254   1HG2  VAL  33          1HG2      VAL  33  -9.208  -5.197  -4.254
  255   2HG2  VAL  33          2HG2      VAL  33  -8.206  -6.008  -3.052
  256   3HG2  VAL  33          3HG2      VAL  33  -8.019  -4.278  -3.333
  257    HA   PRO  34           HA       PRO  34 -13.898  -4.713  -5.178
  258   1HB   PRO  34          2HB       PRO  34 -14.757  -2.181  -4.527
  259   2HB   PRO  34          1HB       PRO  34 -15.432  -3.659  -3.820
  260   1HG   PRO  34          2HG       PRO  34 -13.556  -1.678  -2.603
  261   2HG   PRO  34          1HG       PRO  34 -14.748  -2.725  -1.816
  262   1HD   PRO  34          2HD       PRO  34 -11.975  -3.195  -1.901
  263   2HD   PRO  34          1HD       PRO  34 -13.212  -4.401  -1.494
  264    H    GLU  35           H        GLU  35 -14.000  -3.124  -7.008
  265    HA   GLU  35           HA       GLU  35 -11.459  -2.411  -8.033
  266   1HB   GLU  35          2HB       GLU  35 -13.438  -2.694  -9.461
  267   2HB   GLU  35          1HB       GLU  35 -14.182  -1.270  -8.738
  268   1HG   GLU  35          2HG       GLU  35 -11.500  -0.679  -9.709
  269   2HG   GLU  35          1HG       GLU  35 -12.523  -1.315 -10.996
  270    H    SER  36           H        SER  36 -13.742  -0.517  -6.090
  271    HA   SER  36           HA       SER  36 -12.688   2.076  -6.428
  272   1HB   SER  36          2HB       SER  36 -14.261   0.678  -4.363
  273   2HB   SER  36          1HB       SER  36 -13.328   2.042  -3.756
  274    HG   SER  36           HG       SER  36 -15.278   2.818  -4.492
  275    H    THR  37           H        THR  37 -11.583  -0.509  -4.212
  276    HA   THR  37           HA       THR  37  -9.528   1.081  -2.961
  277    HB   THR  37           HB       THR  37  -9.853  -1.922  -3.245
  278    HG1  THR  37           HG1      THR  37 -10.891  -1.757  -1.397
  279   1HG2  THR  37          1HG2      THR  37  -7.997  -0.431  -1.371
  280   2HG2  THR  37          2HG2      THR  37  -7.462  -1.176  -2.878
  281   3HG2  THR  37          3HG2      THR  37  -8.123  -2.177  -1.585
  282    HA   PRO  38           HA       PRO  38  -6.774   1.028  -6.462
  283   1HB   PRO  38          2HB       PRO  38  -4.852   2.598  -5.282
  284   2HB   PRO  38          1HB       PRO  38  -6.346   3.237  -5.989
  285   1HG   PRO  38          2HG       PRO  38  -5.622   2.912  -3.117
  286   2HG   PRO  38          1HG       PRO  38  -6.751   4.051  -3.868
  287   1HD   PRO  38          2HD       PRO  38  -7.447   1.672  -2.491
  288   2HD   PRO  38          1HD       PRO  38  -8.529   2.657  -3.498
  289    H    PHE  39           H        PHE  39  -4.478   0.386  -6.873
  290    HA   PHE  39           HA       PHE  39  -3.741  -2.003  -5.447
  291   1HB   PHE  39          2HB       PHE  39  -3.177  -1.174  -7.904
  292   2HB   PHE  39          1HB       PHE  39  -1.741  -0.524  -7.117
  293    HD1  PHE  39           HD1      PHE  39  -3.780  -3.677  -6.835
  294    HD2  PHE  39           HD2      PHE  39   0.115  -1.915  -7.261
  295    HE1  PHE  39           HE1      PHE  39  -2.757  -5.936  -6.836
  296    HE2  PHE  39           HE2      PHE  39   1.136  -4.173  -7.262
  297    HZ   PHE  39           HZ       PHE  39  -0.300  -6.183  -7.050
  298    H    THR  40           H        THR  40  -3.117   1.341  -4.826
  299    HA   THR  40           HA       THR  40  -0.588   1.183  -3.503
  300    HB   THR  40           HB       THR  40  -1.408   3.223  -2.245
  301    HG1  THR  40           HG1      THR  40  -3.463   3.541  -2.194
  302   1HG2  THR  40          1HG2      THR  40  -0.295   3.724  -4.249
  303   2HG2  THR  40          2HG2      THR  40  -1.843   4.549  -4.437
  304   3HG2  THR  40          3HG2      THR  40  -1.563   3.004  -5.242
  305    H    ALA  41           H        ALA  41  -3.923   0.770  -2.301
  306    HA   ALA  41           HA       ALA  41  -3.069   0.138   0.415
  307   1HB   ALA  41          1HB       ALA  41  -5.737  -0.353  -0.946
  308   2HB   ALA  41          2HB       ALA  41  -5.301   1.119  -0.080
  309   3HB   ALA  41          3HB       ALA  41  -5.433  -0.409   0.791
  310    H    VAL  42           H        VAL  42  -4.050  -1.715  -2.468
  311    HA   VAL  42           HA       VAL  42  -4.125  -4.302  -1.245
  312    HB   VAL  42           HB       VAL  42  -3.368  -3.552  -4.092
  313   1HG1  VAL  42          1HG1      VAL  42  -3.915  -6.157  -2.706
  314   2HG1  VAL  42          2HG1      VAL  42  -2.714  -5.781  -3.941
  315   3HG1  VAL  42          3HG1      VAL  42  -4.410  -5.963  -4.386
  316   1HG2  VAL  42          1HG2      VAL  42  -6.024  -4.349  -2.851
  317   2HG2  VAL  42          2HG2      VAL  42  -5.744  -4.073  -4.571
  318   3HG2  VAL  42          3HG2      VAL  42  -5.600  -2.737  -3.430
  319    H    LEU  43           H        LEU  43  -1.452  -2.546  -2.837
  320    HA   LEU  43           HA       LEU  43   0.523  -4.612  -2.437
  321   1HB   LEU  43          2HB       LEU  43   0.610  -2.623  -4.069
  322   2HB   LEU  43          1HB       LEU  43   1.110  -1.656  -2.683
  323    HG   LEU  43           HG       LEU  43   2.598  -4.171  -2.901
  324   1HD1  LEU  43          1HD1      LEU  43   2.031  -3.040  -5.352
  325   2HD1  LEU  43          2HD1      LEU  43   3.445  -4.032  -4.999
  326   3HD1  LEU  43          3HD1      LEU  43   3.564  -2.274  -4.930
  327   1HD2  LEU  43          1HD2      LEU  43   3.224  -2.302  -1.419
  328   2HD2  LEU  43          2HD2      LEU  43   3.398  -1.241  -2.818
  329   3HD2  LEU  43          3HD2      LEU  43   4.498  -2.602  -2.602
  330    H    LYS  44           H        LYS  44  -0.504  -1.798  -0.528
  331    HA   LYS  44           HA       LYS  44   1.596  -1.813   1.399
  332   1HB   LYS  44          2HB       LYS  44  -1.055  -0.613   1.125
  333   2HB   LYS  44          1HB       LYS  44  -0.691  -1.039   2.797
  334   1HG   LYS  44          2HG       LYS  44   1.188   0.355   2.884
  335   2HG   LYS  44          1HG       LYS  44   1.372   0.373   1.130
  336   1HD   LYS  44          2HD       LYS  44  -1.172   1.441   1.549
  337   2HD   LYS  44          1HD       LYS  44  -0.194   2.145   2.837
  338   1HE   LYS  44          2HE       LYS  44   1.221   3.237   1.358
  339   2HE   LYS  44          1HE       LYS  44   0.943   2.068   0.068
  340   1HZ   LYS  44          1HZ       LYS  44  -0.251   3.872  -0.652
  341   2HZ   LYS  44          2HZ       LYS  44  -0.730   4.332   0.913
  342   3HZ   LYS  44          3HZ       LYS  44  -1.455   2.993   0.158
  343    H    PHE  45           H        PHE  45  -1.529  -3.544   1.352
  344    HA   PHE  45           HA       PHE  45  -1.117  -4.819   3.919
  345   1HB   PHE  45          2HB       PHE  45  -3.077  -5.018   1.693
  346   2HB   PHE  45          1HB       PHE  45  -2.902  -6.452   2.704
  347    HD1  PHE  45           HD1      PHE  45  -3.528  -2.773   2.826
  348    HD2  PHE  45           HD2      PHE  45  -3.839  -6.534   4.882
  349    HE1  PHE  45           HE1      PHE  45  -4.889  -1.696   4.595
  350    HE2  PHE  45           HE2      PHE  45  -5.199  -5.454   6.650
  351    HZ   PHE  45           HZ       PHE  45  -5.724  -3.036   6.506
  352    H    ALA  46           H        ALA  46  -0.659  -5.892   0.534
  353    HA   ALA  46           HA       ALA  46   0.156  -8.562   1.117
  354   1HB   ALA  46          1HB       ALA  46   0.485  -8.713  -1.126
  355   2HB   ALA  46          2HB       ALA  46   1.532  -7.294  -1.161
  356   3HB   ALA  46          3HB       ALA  46  -0.220  -7.098  -1.179
  357    H    ALA  47           H        ALA  47   2.119  -5.600   0.695
  358    HA   ALA  47           HA       ALA  47   4.652  -6.888   1.183
  359   1HB   ALA  47          1HB       ALA  47   4.268  -4.627   0.068
  360   2HB   ALA  47          2HB       ALA  47   5.566  -4.673   1.260
  361   3HB   ALA  47          3HB       ALA  47   4.004  -3.974   1.684
  362    H    GLU  48           H        GLU  48   2.430  -5.047   3.290
  363    HA   GLU  48           HA       GLU  48   4.040  -5.152   5.654
  364   1HB   GLU  48          2HB       GLU  48   2.109  -3.629   5.382
  365   2HB   GLU  48          1HB       GLU  48   1.017  -5.013   5.405
  366   1HG   GLU  48          2HG       GLU  48   2.839  -5.036   7.685
  367   2HG   GLU  48          1HG       GLU  48   1.879  -3.558   7.629
  368    H    GLU  49           H        GLU  49   1.435  -7.315   4.491
  369    HA   GLU  49           HA       GLU  49   1.509  -9.081   6.761
  370   1HB   GLU  49          2HB       GLU  49   0.303  -9.116   4.048
  371   2HB   GLU  49          1HB       GLU  49   0.565 -10.689   4.798
  372   1HG   GLU  49          2HG       GLU  49  -1.437 -10.290   5.803
  373   2HG   GLU  49          1HG       GLU  49  -0.484  -9.287   6.897
  374    H    PHE  50           H        PHE  50   3.417  -8.938   3.787
  375    HA   PHE  50           HA       PHE  50   4.534 -11.614   4.164
  376   1HB   PHE  50          2HB       PHE  50   4.723  -9.464   2.158
  377   2HB   PHE  50          1HB       PHE  50   6.240 -10.320   2.423
  378    HD1  PHE  50           HD1      PHE  50   5.652 -13.040   2.886
  379    HD2  PHE  50           HD2      PHE  50   3.551 -10.295   0.331
  380    HE1  PHE  50           HE1      PHE  50   4.818 -14.939   1.529
  381    HE2  PHE  50           HE2      PHE  50   2.717 -12.197  -1.022
  382    HZ   PHE  50           HZ       PHE  50   3.351 -14.518  -0.425
  383    H    LYS  51           H        LYS  51   6.475  -8.664   3.732
  384    HA   LYS  51           HA       LYS  51   7.564  -8.429   6.336
  385   1HB   LYS  51          2HB       LYS  51   9.800  -9.595   5.920
  386   2HB   LYS  51          1HB       LYS  51   8.426 -10.669   6.184
  387   1HG   LYS  51          2HG       LYS  51   8.230 -11.168   3.866
  388   2HG   LYS  51          1HG       LYS  51   9.262  -9.815   3.408
  389   1HD   LYS  51          2HD       LYS  51  11.134 -10.981   4.698
  390   2HD   LYS  51          1HD       LYS  51  10.079 -12.395   4.754
  391   1HE   LYS  51          2HE       LYS  51   9.920 -11.699   2.103
  392   2HE   LYS  51          1HE       LYS  51  11.586 -11.267   2.484
  393   1HZ   LYS  51          1HZ       LYS  51  10.477 -13.866   3.322
  394   2HZ   LYS  51          2HZ       LYS  51  12.101 -13.424   3.082
  395   3HZ   LYS  51          3HZ       LYS  51  11.072 -13.651   1.749
  396    H    VAL  52           H        VAL  52   6.955  -6.759   4.000
  397    HA   VAL  52           HA       VAL  52   9.557  -5.349   3.829
  398    HB   VAL  52           HB       VAL  52   9.082  -4.987   1.315
  399   1HG1  VAL  52          1HG1      VAL  52  10.902  -6.416   2.340
  400   2HG1  VAL  52          2HG1      VAL  52  10.379  -6.924   0.735
  401   3HG1  VAL  52          3HG1      VAL  52   9.821  -7.799   2.161
  402   1HG2  VAL  52          1HG2      VAL  52   7.427  -7.483   1.825
  403   2HG2  VAL  52          2HG2      VAL  52   7.848  -6.844   0.235
  404   3HG2  VAL  52          3HG2      VAL  52   6.800  -5.918   1.309
  405    HA   PRO  53           HA       PRO  53   7.005  -1.790   4.177
  406   1HB   PRO  53          2HB       PRO  53   8.750   0.072   3.151
  407   2HB   PRO  53          1HB       PRO  53   8.922  -0.650   4.760
  408   1HG   PRO  53          2HG       PRO  53  10.484  -1.198   2.280
  409   2HG   PRO  53          1HG       PRO  53  10.971  -1.374   3.975
  410   1HD   PRO  53          2HD       PRO  53  10.187  -3.474   2.248
  411   2HD   PRO  53          1HD       PRO  53  10.353  -3.580   4.014
  412    H    ALA  54           H        ALA  54   5.385  -0.967   2.895
  413    HA   ALA  54           HA       ALA  54   5.079  -1.604   0.150
  414   1HB   ALA  54          1HB       ALA  54   3.691   0.853   0.821
  415   2HB   ALA  54          2HB       ALA  54   3.544  -0.323   2.127
  416   3HB   ALA  54          3HB       ALA  54   3.027  -0.748   0.496
  417    H    ALA  55           H        ALA  55   6.537   1.240   1.684
  418    HA   ALA  55           HA       ALA  55   6.710   2.920  -0.612
  419   1HB   ALA  55          1HB       ALA  55   7.171   3.809   1.597
  420   2HB   ALA  55          2HB       ALA  55   8.624   3.992   0.614
  421   3HB   ALA  55          3HB       ALA  55   8.524   2.696   1.807
  422    H    THR  56           H        THR  56   8.943   0.414   0.614
  423    HA   THR  56           HA       THR  56  10.501   0.678  -1.926
  424    HB   THR  56           HB       THR  56  11.447  -0.777   0.549
  425    HG1  THR  56           HG1      THR  56  11.555   1.086   1.483
  426   1HG2  THR  56          1HG2      THR  56  13.521  -0.748  -0.461
  427   2HG2  THR  56          2HG2      THR  56  13.191   0.746  -1.335
  428   3HG2  THR  56          3HG2      THR  56  12.503  -0.776  -1.900
  429    H    SER  57           H        SER  57   8.045  -0.724  -1.989
  430    HA   SER  57           HA       SER  57   9.033  -3.462  -2.591
  431   1HB   SER  57          2HB       SER  57   7.933  -3.415  -0.300
  432   2HB   SER  57          1HB       SER  57   6.429  -3.006  -1.118
  433    HG   SER  57           HG       SER  57   6.314  -5.128  -1.212
  434    H    ALA  58           H        ALA  58   7.726  -4.577  -4.150
  435    HA   ALA  58           HA       ALA  58   5.560  -3.055  -5.481
  436   1HB   ALA  58          1HB       ALA  58   7.809  -4.163  -7.155
  437   2HB   ALA  58          2HB       ALA  58   7.894  -2.527  -6.504
  438   3HB   ALA  58          3HB       ALA  58   6.586  -2.972  -7.600
  439    H    ILE  59           H        ILE  59   4.603  -4.493  -7.305
  440    HA   ILE  59           HA       ILE  59   4.836  -7.381  -6.554
  441    HB   ILE  59           HB       ILE  59   2.379  -5.664  -6.877
  442   1HG1  ILE  59          2HG1      ILE  59   2.851  -7.930  -4.944
  443   2HG1  ILE  59          1HG1      ILE  59   3.559  -6.342  -4.651
  444   1HG2  ILE  59          1HG2      ILE  59   1.815  -8.525  -6.691
  445   2HG2  ILE  59          2HG2      ILE  59   2.634  -8.115  -8.195
  446   3HG2  ILE  59          3HG2      ILE  59   1.122  -7.316  -7.772
  447   1HD1  ILE  59          1HD1      ILE  59   1.040  -5.579  -5.222
  448   2HD1  ILE  59          2HD1      ILE  59   1.554  -5.997  -3.589
  449   3HD1  ILE  59          3HD1      ILE  59   0.706  -7.186  -4.577
  450    H    ILE  60           H        ILE  60   5.437  -8.570  -8.292
  451    HA   ILE  60           HA       ILE  60   5.005  -7.437 -11.010
  452    HB   ILE  60           HB       ILE  60   6.649  -9.120 -11.764
  453   1HG1  ILE  60          2HG1      ILE  60   7.480  -9.888  -9.047
  454   2HG1  ILE  60          1HG1      ILE  60   5.895 -10.511  -9.499
  455   1HG2  ILE  60          1HG2      ILE  60   8.200  -8.138  -9.516
  456   2HG2  ILE  60          2HG2      ILE  60   7.135  -6.879 -10.143
  457   3HG2  ILE  60          3HG2      ILE  60   8.286  -7.676 -11.216
  458   1HD1  ILE  60          1HD1      ILE  60   7.635 -10.822 -11.746
  459   2HD1  ILE  60          2HD1      ILE  60   6.867 -12.080 -10.780
  460   3HD1  ILE  60          3HD1      ILE  60   8.455 -11.465 -10.323
  461    H    THR  61           H        THR  61   4.628  -9.340 -12.714
  462    HA   THR  61           HA       THR  61   2.287 -10.890 -11.696
  463    HB   THR  61           HB       THR  61   1.600 -11.032 -14.075
  464    HG1  THR  61           HG1      THR  61   2.886 -10.384 -15.612
  465   1HG2  THR  61          1HG2      THR  61   0.681  -9.192 -12.868
  466   2HG2  THR  61          2HG2      THR  61   1.243  -8.530 -14.403
  467   3HG2  THR  61          3HG2      THR  61   2.200  -8.298 -12.940
  468    H    ASN  62           H        ASN  62   1.960 -13.026 -12.965
  469    HA   ASN  62           HA       ASN  62   4.229 -14.735 -12.491
  470   1HB   ASN  62          2HB       ASN  62   2.840 -16.513 -13.466
  471   2HB   ASN  62          1HB       ASN  62   1.886 -15.535 -12.353
  472   1HD2  ASN  62          1HD2      ASN  62   2.172 -16.572 -15.670
  473   2HD2  ASN  62          2HD2      ASN  62   0.854 -15.687 -16.273
  474    H    ASP  63           H        ASP  63   3.138 -12.945 -15.293
  475    HA   ASP  63           HA       ASP  63   4.730 -14.480 -17.211
  476   1HB   ASP  63          2HB       ASP  63   3.458 -11.740 -17.510
  477   2HB   ASP  63          1HB       ASP  63   4.053 -12.762 -18.818
  478    H    GLY  64           H        GLY  64   4.967 -11.220 -15.735
  479   1HA   GLY  64          2HA       GLY  64   7.483 -10.930 -14.958
  480   2HA   GLY  64          1HA       GLY  64   7.775 -11.023 -16.694
  481    H    VAL  65           H        VAL  65   5.296  -9.364 -14.704
  482    HA   VAL  65           HA       VAL  65   6.098  -6.800 -16.025
  483    HB   VAL  65           HB       VAL  65   3.275  -7.677 -15.318
  484   1HG1  VAL  65          1HG1      VAL  65   3.446  -5.293 -15.108
  485   2HG1  VAL  65          2HG1      VAL  65   2.717  -5.601 -16.685
  486   3HG1  VAL  65          3HG1      VAL  65   4.424  -5.171 -16.572
  487   1HG2  VAL  65          1HG2      VAL  65   4.173  -8.882 -17.277
  488   2HG2  VAL  65          2HG2      VAL  65   4.640  -7.347 -18.011
  489   3HG2  VAL  65          3HG2      VAL  65   2.934  -7.728 -17.770
  490    H    GLY  66           H        GLY  66   6.881  -5.460 -14.482
  491   1HA   GLY  66          2HA       GLY  66   6.431  -5.902 -11.653
  492   2HA   GLY  66          1HA       GLY  66   7.332  -4.562 -12.359
  493    H    VAL  67           H        VAL  67   4.136  -5.695 -11.451
  494    HA   VAL  67           HA       VAL  67   2.718  -3.294 -12.252
  495    HB   VAL  67           HB       VAL  67   1.906  -5.318 -10.139
  496   1HG1  VAL  67          1HG1      VAL  67   0.680  -3.060 -10.403
  497   2HG1  VAL  67          2HG1      VAL  67  -0.300  -4.522 -10.459
  498   3HG1  VAL  67          3HG1      VAL  67   0.127  -3.690 -11.954
  499   1HG2  VAL  67          1HG2      VAL  67   0.641  -6.373 -12.049
  500   2HG2  VAL  67          2HG2      VAL  67   2.393  -6.521 -12.186
  501   3HG2  VAL  67          3HG2      VAL  67   1.532  -5.321 -13.150
  502    H    ASN  68           H        ASN  68   2.647  -1.373 -11.201
  503    HA   ASN  68           HA       ASN  68   3.853  -1.213  -8.478
  504   1HB   ASN  68          2HB       ASN  68   3.591   0.698 -10.776
  505   2HB   ASN  68          1HB       ASN  68   3.713   1.350  -9.142
  506   1HD2  ASN  68          1HD2      ASN  68   5.625   0.589 -11.741
  507   2HD2  ASN  68          2HD2      ASN  68   7.071   0.215 -10.935
  508    HA   PRO  69           HA       PRO  69   0.019  -0.061  -6.655
  509   1HB   PRO  69          2HB       PRO  69   0.892   1.712  -4.736
  510   2HB   PRO  69          1HB       PRO  69   1.117  -0.042  -4.625
  511   1HG   PRO  69          2HG       PRO  69   3.121   2.069  -5.263
  512   2HG   PRO  69          1HG       PRO  69   3.367   0.466  -4.550
  513   1HD   PRO  69          2HD       PRO  69   3.856   1.182  -7.248
  514   2HD   PRO  69          1HD       PRO  69   3.798  -0.470  -6.597
  515    H    ALA  70           H        ALA  70  -0.239   1.143  -8.901
  516    HA   ALA  70           HA       ALA  70  -0.787   4.027  -8.322
  517   1HB   ALA  70          1HB       ALA  70   0.317   2.882 -10.906
  518   2HB   ALA  70          2HB       ALA  70   1.219   3.858  -9.745
  519   3HB   ALA  70          3HB       ALA  70  -0.125   4.569 -10.640
  520    H    GLN  71           H        GLN  71  -1.610   1.182 -10.317
  521    HA   GLN  71           HA       GLN  71  -4.051   2.437 -11.348
  522   1HB   GLN  71          2HB       GLN  71  -2.887  -0.350 -11.556
  523   2HB   GLN  71          1HB       GLN  71  -4.442   0.086 -12.262
  524   1HG   GLN  71          2HG       GLN  71  -3.486   1.282 -13.946
  525   2HG   GLN  71          1HG       GLN  71  -2.242   1.954 -12.891
  526   1HE2  GLN  71          1HE2      GLN  71  -0.346   0.516 -12.396
  527   2HE2  GLN  71          2HE2      GLN  71   0.079  -0.706 -13.494
  528    HA   PRO  72           HA       PRO  72  -6.827   1.009  -8.241
  529   1HB   PRO  72          2HB       PRO  72  -9.081   0.584  -9.758
  530   2HB   PRO  72          1HB       PRO  72  -8.479   2.194  -9.327
  531   1HG   PRO  72          2HG       PRO  72  -8.334   0.775 -11.945
  532   2HG   PRO  72          1HG       PRO  72  -8.347   2.514 -11.612
  533   1HD   PRO  72          2HD       PRO  72  -6.068   0.970 -12.256
  534   2HD   PRO  72          1HD       PRO  72  -6.058   2.618 -11.595
  535    H    ALA  73           H        ALA  73  -7.996  -0.909  -7.472
  536    HA   ALA  73           HA       ALA  73  -6.816  -3.405  -8.094
  537   1HB   ALA  73          1HB       ALA  73  -8.618  -4.408  -6.776
  538   2HB   ALA  73          2HB       ALA  73  -9.570  -2.930  -6.916
  539   3HB   ALA  73          3HB       ALA  73  -8.063  -2.926  -5.998
  540    H    GLY  74           H        GLY  74  -9.809  -1.937  -9.356
  541   1HA   GLY  74          2HA       GLY  74 -10.802  -4.177 -10.789
  542   2HA   GLY  74          1HA       GLY  74 -11.112  -2.498 -11.221
  543    H    ASN  75           H        ASN  75  -8.546  -1.604 -11.847
  544    HA   ASN  75           HA       ASN  75  -8.186  -2.706 -14.504
  545   1HB   ASN  75          2HB       ASN  75  -7.697  -0.294 -13.612
  546   2HB   ASN  75          1HB       ASN  75  -6.139  -0.971 -13.136
  547   1HD2  ASN  75          1HD2      ASN  75  -8.229  -0.328 -15.959
  548   2HD2  ASN  75          2HD2      ASN  75  -6.991  -0.465 -17.111
  549    H    ILE  76           H        ILE  76  -6.398  -3.035 -11.432
  550    HA   ILE  76           HA       ILE  76  -4.140  -4.443 -12.482
  551    HB   ILE  76           HB       ILE  76  -5.435  -4.638  -9.742
  552   1HG1  ILE  76          2HG1      ILE  76  -4.653  -2.359 -10.444
  553   2HG1  ILE  76          1HG1      ILE  76  -3.760  -3.001  -9.068
  554   1HG2  ILE  76          1HG2      ILE  76  -2.762  -5.173  -9.413
  555   2HG2  ILE  76          2HG2      ILE  76  -3.091  -5.962 -10.954
  556   3HG2  ILE  76          3HG2      ILE  76  -4.018  -6.404  -9.521
  557   1HD1  ILE  76          1HD1      ILE  76  -2.378  -3.914 -11.348
  558   2HD1  ILE  76          2HD1      ILE  76  -1.864  -2.650 -10.232
  559   3HD1  ILE  76          3HD1      ILE  76  -2.775  -2.227 -11.680
  560    H    PHE  77           H        PHE  77  -7.260  -5.634 -11.208
  561    HA   PHE  77           HA       PHE  77  -6.620  -8.431 -11.675
  562   1HB   PHE  77          2HB       PHE  77  -8.331  -7.568 -10.016
  563   2HB   PHE  77          1HB       PHE  77  -9.368  -7.181 -11.387
  564    HD1  PHE  77           HD1      PHE  77 -10.472  -8.917 -12.664
  565    HD2  PHE  77           HD2      PHE  77  -7.750  -9.920  -9.496
  566    HE1  PHE  77           HE1      PHE  77 -11.255 -11.268 -12.736
  567    HE2  PHE  77           HE2      PHE  77  -8.535 -12.271  -9.568
  568    HZ   PHE  77           HZ       PHE  77 -10.286 -12.945 -11.189
  569    H    LEU  78           H        LEU  78  -8.388  -5.923 -13.469
  570    HA   LEU  78           HA       LEU  78  -9.365  -7.637 -15.561
  571   1HB   LEU  78          2HB       LEU  78 -10.480  -5.580 -15.381
  572   2HB   LEU  78          1HB       LEU  78  -8.982  -4.668 -15.239
  573    HG   LEU  78           HG       LEU  78  -8.474  -5.263 -17.632
  574   1HD1  LEU  78          1HD1      LEU  78  -9.696  -7.084 -18.315
  575   2HD1  LEU  78          2HD1      LEU  78 -10.859  -5.844 -18.782
  576   3HD1  LEU  78          3HD1      LEU  78 -11.051  -6.700 -17.252
  577   1HD2  LEU  78          1HD2      LEU  78 -10.243  -3.716 -18.570
  578   2HD2  LEU  78          2HD2      LEU  78  -9.401  -3.086 -17.154
  579   3HD2  LEU  78          3HD2      LEU  78 -11.024  -3.755 -16.990
  580    H    LYS  79           H        LYS  79  -6.383  -5.699 -15.243
  581    HA   LYS  79           HA       LYS  79  -5.475  -6.462 -17.934
  582   1HB   LYS  79          2HB       LYS  79  -4.738  -4.496 -15.942
  583   2HB   LYS  79          1HB       LYS  79  -3.312  -5.377 -16.481
  584   1HG   LYS  79          2HG       LYS  79  -5.032  -4.736 -18.729
  585   2HG   LYS  79          1HG       LYS  79  -4.603  -3.280 -17.833
  586   1HD   LYS  79          2HD       LYS  79  -2.377  -5.177 -18.276
  587   2HD   LYS  79          1HD       LYS  79  -3.007  -4.409 -19.732
  588   1HE   LYS  79          2HE       LYS  79  -2.743  -2.189 -18.661
  589   2HE   LYS  79          1HE       LYS  79  -2.065  -2.971 -17.234
  590   1HZ   LYS  79          1HZ       LYS  79  -0.321  -3.905 -18.665
  591   2HZ   LYS  79          2HZ       LYS  79  -0.302  -2.205 -18.651
  592   3HZ   LYS  79          3HZ       LYS  79  -0.946  -3.039 -19.983
  593    H    HIS  80           H        HIS  80  -4.180  -6.991 -14.617
  594    HA   HIS  80           HA       HIS  80  -2.514  -9.202 -15.653
  595   1HB   HIS  80          2HB       HIS  80  -2.715  -8.221 -12.792
  596   2HB   HIS  80          1HB       HIS  80  -1.417  -9.172 -13.514
  597    HD1  HIS  80           HD1      HIS  80  -0.268  -7.851 -15.712
  598    HD2  HIS  80           HD2      HIS  80  -2.138  -5.526 -12.802
  599    HE1  HIS  80           HE1      HIS  80   0.592  -5.488 -16.020
  600    H    GLY  81           H        GLY  81  -4.663  -8.911 -12.777
  601   1HA   GLY  81          2HA       GLY  81  -6.635 -10.582 -12.874
  602   2HA   GLY  81          1HA       GLY  81  -5.387 -11.784 -13.195
  603    H    SER  82           H        SER  82  -5.385 -13.006 -11.340
  604    HA   SER  82           HA       SER  82  -5.207 -11.567  -8.727
  605   1HB   SER  82          2HB       SER  82  -5.880 -13.780  -7.739
  606   2HB   SER  82          1HB       SER  82  -7.098 -13.069  -8.791
  607    HG   SER  82           HG       SER  82  -6.884 -15.173  -9.416
  608    H    GLU  83           H        GLU  83  -3.790 -14.330 -10.525
  609    HA   GLU  83           HA       GLU  83  -1.783 -14.976  -8.612
  610   1HB   GLU  83          2HB       GLU  83  -2.527 -16.018 -11.030
  611   2HB   GLU  83          1HB       GLU  83  -0.987 -15.267 -11.445
  612   1HG   GLU  83          2HG       GLU  83  -1.459 -17.255  -9.199
  613   2HG   GLU  83          1HG       GLU  83  -0.616 -17.579 -10.713
  614    H    LEU  84           H        LEU  84  -0.413 -13.483  -7.804
  615    HA   LEU  84           HA       LEU  84   1.200 -11.862  -9.718
  616   1HB   LEU  84          2HB       LEU  84  -0.269 -10.871  -7.262
  617   2HB   LEU  84          1HB       LEU  84   1.052  -9.972  -8.008
  618    HG   LEU  84           HG       LEU  84  -1.120 -10.931  -9.811
  619   1HD1  LEU  84          1HD1      LEU  84  -1.803  -9.567  -7.464
  620   2HD1  LEU  84          2HD1      LEU  84  -2.793  -9.716  -8.916
  621   3HD1  LEU  84          3HD1      LEU  84  -1.745  -8.313  -8.704
  622   1HD2  LEU  84          1HD2      LEU  84   0.713  -8.546  -9.566
  623   2HD2  LEU  84          2HD2      LEU  84  -0.669  -8.521 -10.662
  624   3HD2  LEU  84          3HD2      LEU  84   0.607  -9.720 -10.878
  625    H    ARG  85           H        ARG  85   3.200 -10.984  -8.609
  626    HA   ARG  85           HA       ARG  85   4.145 -12.853  -6.466
  627   1HB   ARG  85          2HB       ARG  85   5.281 -12.157  -9.089
  628   2HB   ARG  85          1HB       ARG  85   6.432 -12.003  -7.762
  629   1HG   ARG  85          2HG       ARG  85   6.682 -14.249  -8.338
  630   2HG   ARG  85          1HG       ARG  85   5.491 -14.350  -7.043
  631   1HD   ARG  85          2HD       ARG  85   3.761 -14.080  -9.016
  632   2HD   ARG  85          1HD       ARG  85   5.105 -14.658 -10.003
  633    HE   ARG  85           HE       ARG  85   3.778 -16.204  -7.832
  634   1HH1  ARG  85          2HH1      ARG  85   6.734 -16.786  -8.127
  635   2HH1  ARG  85          1HH1      ARG  85   6.722 -18.096  -9.261
  636   1HH2  ARG  85          1HH2      ARG  85   3.446 -17.525 -10.289
  637   2HH2  ARG  85          2HH2      ARG  85   4.853 -18.516 -10.489
  638    H    LEU  86           H        LEU  86   5.828 -11.921  -5.040
  639    HA   LEU  86           HA       LEU  86   5.475  -8.970  -4.728
  640   1HB   LEU  86          2HB       LEU  86   4.769 -10.563  -2.849
  641   2HB   LEU  86          1HB       LEU  86   6.487 -10.881  -2.615
  642    HG   LEU  86           HG       LEU  86   6.462  -8.143  -2.713
  643   1HD1  LEU  86          1HD1      LEU  86   3.851  -9.107  -1.536
  644   2HD1  LEU  86          2HD1      LEU  86   4.106  -7.841  -2.737
  645   3HD1  LEU  86          3HD1      LEU  86   4.578  -7.572  -1.059
  646   1HD2  LEU  86          1HD2      LEU  86   6.439  -8.370  -0.133
  647   2HD2  LEU  86          2HD2      LEU  86   7.677  -9.260  -1.018
  648   3HD2  LEU  86          3HD2      LEU  86   6.245 -10.099  -0.422
  649    H    ILE  87           H        ILE  87   7.181  -7.804  -5.392
  650    HA   ILE  87           HA       ILE  87   9.920  -8.984  -5.143
  651    HB   ILE  87           HB       ILE  87   9.024  -8.640  -7.498
  652   1HG1  ILE  87          2HG1      ILE  87  11.406  -6.867  -6.946
  653   2HG1  ILE  87          1HG1      ILE  87  11.493  -8.621  -6.782
  654   1HG2  ILE  87          1HG2      ILE  87   7.860  -6.691  -7.714
  655   2HG2  ILE  87          2HG2      ILE  87   9.452  -6.017  -8.057
  656   3HG2  ILE  87          3HG2      ILE  87   8.769  -5.882  -6.441
  657   1HD1  ILE  87          1HD1      ILE  87  12.190  -7.716  -9.051
  658   2HD1  ILE  87          2HD1      ILE  87  10.504  -7.262  -9.297
  659   3HD1  ILE  87          3HD1      ILE  87  10.940  -8.959  -9.087
  660    HA   PRO  88           HA       PRO  88  10.716  -5.521  -2.505
  661   1HB   PRO  88          2HB       PRO  88  13.469  -5.641  -2.542
  662   2HB   PRO  88          1HB       PRO  88  12.448  -6.739  -1.598
  663   1HG   PRO  88          2HG       PRO  88  13.931  -7.265  -4.133
  664   2HG   PRO  88          1HG       PRO  88  13.461  -8.396  -2.852
  665   1HD   PRO  88          2HD       PRO  88  12.158  -8.092  -5.334
  666   2HD   PRO  88          1HD       PRO  88  11.502  -8.934  -3.916
  667    H    ARG  89           H        ARG  89   9.847  -4.159  -4.365
  668    HA   ARG  89           HA       ARG  89  10.003  -2.197  -5.616
  669   1HB   ARG  89          2HB       ARG  89  12.362  -2.152  -3.954
  670   2HB   ARG  89          1HB       ARG  89  12.746  -1.505  -5.549
  671   1HG   ARG  89          2HG       ARG  89  10.309  -0.642  -3.977
  672   2HG   ARG  89          1HG       ARG  89  11.858   0.191  -3.867
  673   1HD   ARG  89          2HD       ARG  89  11.768   0.933  -6.084
  674   2HD   ARG  89          1HD       ARG  89  10.641  -0.335  -6.566
  675    HE   ARG  89           HE       ARG  89   9.920   2.243  -5.423
  676   1HH1  ARG  89          1HH2      ARG  89   8.543   0.060  -7.316
  677   2HH1  ARG  89          2HH2      ARG  89   7.080  -0.173  -6.417
  678   1HH2  ARG  89          2HH1      ARG  89   8.241   1.466  -3.584
  679   2HH2  ARG  89          1HH1      ARG  89   6.910   0.621  -4.302
  680    H    ASP  90           H        ASP  90   9.875  -2.357  -7.775
  681    HA   ASP  90           HA       ASP  90  11.350  -4.289  -9.315
  682   1HB   ASP  90          2HB       ASP  90   9.603  -1.934 -10.048
  683   2HB   ASP  90          1HB       ASP  90  10.423  -2.885 -11.285
  684    H    ARG  91           H        ARG  91  11.631  -0.733  -9.033
  685    HA   ARG  91           HA       ARG  91  14.157  -0.785 -10.584
  686   1HB   ARG  91          2HB       ARG  91  14.017   1.644 -10.543
  687   2HB   ARG  91          1HB       ARG  91  12.431   1.005 -10.968
  688   1HG   ARG  91          2HG       ARG  91  11.656   1.291  -8.665
  689   2HG   ARG  91          1HG       ARG  91  13.256   1.844  -8.172
  690   1HD   ARG  91          2HD       ARG  91  12.283   3.896  -8.530
  691   2HD   ARG  91          1HD       ARG  91  12.833   3.579 -10.177
  692    HE   ARG  91           HE       ARG  91  10.563   3.134 -10.811
  693   1HH1  ARG  91          1HH2      ARG  91   9.752   1.636  -8.306
  694   2HH1  ARG  91          2HH2      ARG  91   8.611   2.730  -7.598
  695   1HH2  ARG  91          2HH1      ARG  91   9.604   5.445  -9.521
  696   2HH2  ARG  91          1HH1      ARG  91   8.522   4.885  -8.290
  697    H    VAL  92           H        VAL  92  15.318   1.499  -9.090
  698    HA   VAL  92           HA       VAL  92  17.000   0.151  -7.270
  699    HB   VAL  92           HB       VAL  92  17.586   2.400  -6.391
  700   1HG1  VAL  92          1HG1      VAL  92  18.858   2.467  -8.243
  701   2HG1  VAL  92          2HG1      VAL  92  17.542   3.296  -9.075
  702   3HG1  VAL  92          3HG1      VAL  92  17.662   1.537  -9.144
  703   1HG2  VAL  92          1HG2      VAL  92  15.721   3.740  -6.247
  704   2HG2  VAL  92          2HG2      VAL  92  14.988   3.059  -7.699
  705   3HG2  VAL  92          3HG2      VAL  92  16.273   4.259  -7.839
  706    H    GLY  93           H        GLY  93  17.087   0.240  -4.914
  707   1HA   GLY  93          2HA       GLY  93  14.553  -0.357  -3.665
  708   2HA   GLY  93          1HA       GLY  93  16.101  -0.221  -2.832
  709    H    HIS  94           HN       HIS  94  13.273   1.537  -3.923
  710    HA   HIS  94           HA       HIS  94  13.920   3.694  -1.977
  711   1HB   HIS  94          2HB       HIS  94  13.869   3.959  -4.861
  712   2HB   HIS  94          1HB       HIS  94  12.606   4.955  -4.138
  713    HD1  HIS  94           HD1      HIS  94  16.327   4.269  -3.669
  714    HD2  HIS  94           HD2      HIS  94  13.559   7.324  -3.076
  715    HE1  HIS  94           HE1      HIS  94  17.640   6.288  -2.886
  Start of MODEL    8
    1   1H    MET   1          1H        MET   1 -11.427   8.318  -5.360
    2   2H    MET   1          2H        MET   1 -10.035   8.654  -6.280
    3   3H    MET   1          3H        MET   1 -10.618   7.060  -6.161
    4    HA   MET   1           HA       MET   1 -11.152   8.159  -8.313
    5   1HB   MET   1          2HB       MET   1 -13.127   7.001  -6.391
    6   2HB   MET   1          1HB       MET   1 -13.754   7.681  -7.890
    7   1HG   MET   1          2HG       MET   1 -12.924   5.985  -9.133
    8   2HG   MET   1          1HG       MET   1 -11.382   6.007  -8.287
    9   1HE   MET   1          1HE       MET   1 -10.802   3.976  -8.147
   10   2HE   MET   1          2HE       MET   1 -12.064   2.903  -8.752
   11   3HE   MET   1          3HE       MET   1 -11.429   2.680  -7.126
   12    H    SER   2           H        SER   2 -10.509  10.530  -7.485
   13    HA   SER   2           HA       SER   2 -13.021  12.113  -7.142
   14   1HB   SER   2          2HB       SER   2 -11.009  12.246  -5.455
   15   2HB   SER   2          1HB       SER   2 -10.271  13.245  -6.701
   16    HG   SER   2           HG       SER   2 -12.821  13.656  -5.502
   17    H    GLY   3           H        GLY   3 -13.670  12.555  -9.236
   18   1HA   GLY   3          2HA       GLY   3 -13.385  14.426 -10.877
   19   2HA   GLY   3          1HA       GLY   3 -11.681  13.982 -10.960
   20    H    GLY   4           H        GLY   4 -11.138  11.916 -11.946
   21   1HA   GLY   4          2HA       GLY   4 -12.471  11.460 -14.416
   22   2HA   GLY   4          1HA       GLY   4 -11.255  10.395 -13.717
   23    H    THR   5           H        THR   5 -11.933   8.491 -12.688
   24    HA   THR   5           HA       THR   5 -14.772   7.748 -13.136
   25    HB   THR   5           HB       THR   5 -13.034   5.689 -11.971
   26    HG1  THR   5           HG1      THR   5 -11.356   6.255 -13.116
   27   1HG2  THR   5          1HG2      THR   5 -14.785   4.667 -12.978
   28   2HG2  THR   5          2HG2      THR   5 -13.840   4.854 -14.460
   29   3HG2  THR   5          3HG2      THR   5 -15.083   6.034 -14.050
   30    H    ALA   6           H        ALA   6 -16.131   6.977 -11.515
   31    HA   ALA   6           HA       ALA   6 -15.208   7.342  -8.690
   32   1HB   ALA   6          1HB       ALA   6 -17.589   7.964  -8.179
   33   2HB   ALA   6          2HB       ALA   6 -17.922   7.949  -9.910
   34   3HB   ALA   6          3HB       ALA   6 -16.789   9.122  -9.241
   35    H    ALA   7           H        ALA   7 -14.905   4.988 -10.107
   36    HA   ALA   7           HA       ALA   7 -17.144   3.192  -9.829
   37   1HB   ALA   7          1HB       ALA   7 -15.504   2.799 -11.548
   38   2HB   ALA   7          2HB       ALA   7 -15.405   1.460 -10.404
   39   3HB   ALA   7          3HB       ALA   7 -14.199   2.747 -10.363
   40    H    THR   8           H        THR   8 -17.711   3.380  -7.560
   41    HA   THR   8           HA       THR   8 -15.836   2.641  -5.470
   42    HB   THR   8           HB       THR   8 -18.873   2.522  -5.398
   43    HG1  THR   8           HG1      THR   8 -18.466   4.595  -5.817
   44   1HG2  THR   8          1HG2      THR   8 -18.252   3.097  -2.914
   45   2HG2  THR   8          2HG2      THR   8 -16.679   2.424  -3.347
   46   3HG2  THR   8          3HG2      THR   8 -18.128   1.426  -3.471
   47    H    THR   9           H        THR   9 -18.369   0.977  -7.326
   48    HA   THR   9           HA       THR   9 -18.935  -1.296  -7.499
   49    HB   THR   9           HB       THR   9 -15.941  -1.699  -7.474
   50    HG1  THR   9           HG1      THR   9 -17.578  -0.597  -9.513
   51   1HG2  THR   9          1HG2      THR   9 -17.000  -3.054  -9.601
   52   2HG2  THR   9          2HG2      THR   9 -18.323  -3.146  -8.439
   53   3HG2  THR   9          3HG2      THR   9 -16.727  -3.761  -8.008
   54    H    ALA  10           H        ALA  10 -19.606  -1.085  -5.101
   55    HA   ALA  10           HA       ALA  10 -17.861  -2.453  -3.175
   56   1HB   ALA  10          1HB       ALA  10 -19.543  -1.941  -1.556
   57   2HB   ALA  10          2HB       ALA  10 -20.766  -1.697  -2.804
   58   3HB   ALA  10          3HB       ALA  10 -19.449  -0.537  -2.620
   59    H    GLY  11           H        GLY  11 -20.673  -3.225  -5.173
   60   1HA   GLY  11          2HA       GLY  11 -21.406  -5.681  -3.894
   61   2HA   GLY  11          1HA       GLY  11 -21.781  -5.253  -5.563
   62    H    SER  12           H        SER  12 -19.768  -5.382  -7.079
   63    HA   SER  12           HA       SER  12 -18.619  -8.064  -6.763
   64   1HB   SER  12          2HB       SER  12 -17.633  -7.634  -9.008
   65   2HB   SER  12          1HB       SER  12 -19.369  -7.348  -8.982
   66    HG   SER  12           HG       SER  12 -18.356  -5.626  -9.995
   67    H    LYS  13           H        LYS  13 -16.465  -8.548  -6.331
   68    HA   LYS  13           HA       LYS  13 -14.613  -6.249  -5.844
   69   1HB   LYS  13          2HB       LYS  13 -14.958  -8.684  -4.067
   70   2HB   LYS  13          1HB       LYS  13 -13.769  -7.404  -3.834
   71   1HG   LYS  13          2HG       LYS  13 -15.667  -5.757  -3.695
   72   2HG   LYS  13          1HG       LYS  13 -16.786  -7.119  -3.738
   73   1HD   LYS  13          2HD       LYS  13 -16.213  -7.839  -1.620
   74   2HD   LYS  13          1HD       LYS  13 -14.575  -7.193  -1.728
   75   1HE   LYS  13          2HE       LYS  13 -15.209  -5.100  -1.033
   76   2HE   LYS  13          1HE       LYS  13 -16.788  -5.209  -1.811
   77   1HZ   LYS  13          1HZ       LYS  13 -17.141  -5.278   0.513
   78   2HZ   LYS  13          2HZ       LYS  13 -15.941  -6.461   0.742
   79   3HZ   LYS  13          3HZ       LYS  13 -17.390  -6.857  -0.056
   80    H    VAL  14           H        VAL  14 -12.313  -6.872  -5.928
   81    HA   VAL  14           HA       VAL  14 -11.866  -9.247  -7.696
   82    HB   VAL  14           HB       VAL  14  -9.775  -7.984  -8.420
   83   1HG1  VAL  14          1HG1      VAL  14 -11.820  -6.129  -9.284
   84   2HG1  VAL  14          2HG1      VAL  14 -12.461  -7.771  -9.250
   85   3HG1  VAL  14          3HG1      VAL  14 -11.022  -7.406 -10.201
   86   1HG2  VAL  14          1HG2      VAL  14  -9.661  -6.410  -6.530
   87   2HG2  VAL  14          2HG2      VAL  14 -11.214  -5.718  -6.998
   88   3HG2  VAL  14          3HG2      VAL  14  -9.813  -5.530  -8.050
   89    H    THR  15           H        THR  15 -10.480 -10.800  -6.979
   90    HA   THR  15           HA       THR  15  -9.129 -10.354  -4.360
   91    HB   THR  15           HB       THR  15  -9.567 -12.964  -5.846
   92    HG1  THR  15           HG1      THR  15 -11.539 -12.753  -5.203
   93   1HG2  THR  15          1HG2      THR  15  -9.122 -13.970  -3.649
   94   2HG2  THR  15          2HG2      THR  15  -8.894 -12.365  -2.951
   95   3HG2  THR  15          3HG2      THR  15  -7.757 -12.972  -4.154
   96    H    PHE  16           H        PHE  16  -6.889 -10.687  -4.126
   97    HA   PHE  16           HA       PHE  16  -5.357 -11.160  -6.654
   98   1HB   PHE  16          2HB       PHE  16  -4.676  -9.200  -4.444
   99   2HB   PHE  16          1HB       PHE  16  -3.688  -9.523  -5.865
  100    HD1  PHE  16           HD1      PHE  16  -4.802  -9.174  -8.185
  101    HD2  PHE  16           HD2      PHE  16  -6.356  -7.552  -4.524
  102    HE1  PHE  16           HE1      PHE  16  -6.106  -7.506  -9.478
  103    HE2  PHE  16           HE2      PHE  16  -7.659  -5.885  -5.817
  104    HZ   PHE  16           HZ       PHE  16  -7.533  -5.864  -8.292
  105    H    LYS  17           H        LYS  17  -3.609 -12.516  -6.481
  106    HA   LYS  17           HA       LYS  17  -3.008 -13.648  -3.774
  107   1HB   LYS  17          2HB       LYS  17  -4.098 -15.114  -5.696
  108   2HB   LYS  17          1HB       LYS  17  -2.441 -15.169  -6.301
  109   1HG   LYS  17          2HG       LYS  17  -1.828 -15.793  -3.837
  110   2HG   LYS  17          1HG       LYS  17  -3.535 -16.210  -3.697
  111   1HD   LYS  17          2HD       LYS  17  -2.886 -18.234  -4.508
  112   2HD   LYS  17          1HD       LYS  17  -2.875 -17.414  -6.072
  113   1HE   LYS  17          2HE       LYS  17  -0.412 -16.907  -4.613
  114   2HE   LYS  17          1HE       LYS  17  -0.684 -18.637  -4.813
  115   1HZ   LYS  17          1HZ       LYS  17  -0.334 -18.511  -7.001
  116   2HZ   LYS  17          2HZ       LYS  17   0.371 -16.998  -6.684
  117   3HZ   LYS  17          3HZ       LYS  17  -1.251 -17.096  -7.181
  118    H    ILE  18           H        ILE  18  -1.125 -12.649  -3.167
  119    HA   ILE  18           HA       ILE  18   1.016 -12.328  -5.231
  120    HB   ILE  18           HB       ILE  18   0.674 -10.857  -2.599
  121   1HG1  ILE  18          2HG1      ILE  18   0.445  -9.083  -4.764
  122   2HG1  ILE  18          1HG1      ILE  18  -0.531 -10.478  -5.222
  123   1HG2  ILE  18          1HG2      ILE  18   2.930 -11.191  -4.252
  124   2HG2  ILE  18          2HG2      ILE  18   2.728 -10.012  -2.957
  125   3HG2  ILE  18          3HG2      ILE  18   2.313  -9.579  -4.616
  126   1HD1  ILE  18          1HD1      ILE  18  -1.043  -9.958  -2.468
  127   2HD1  ILE  18          2HD1      ILE  18  -2.153  -9.782  -3.827
  128   3HD1  ILE  18          3HD1      ILE  18  -1.153  -8.419  -3.323
  129    H    THR  19           H        THR  19   2.780 -13.597  -5.018
  130    HA   THR  19           HA       THR  19   3.324 -14.876  -2.364
  131    HB   THR  19           HB       THR  19   4.268 -15.886  -5.061
  132    HG1  THR  19           HG1      THR  19   2.332 -16.592  -5.366
  133   1HG2  THR  19          1HG2      THR  19   3.790 -17.521  -2.591
  134   2HG2  THR  19          2HG2      THR  19   5.264 -16.562  -2.727
  135   3HG2  THR  19          3HG2      THR  19   4.911 -17.813  -3.919
  136    H    LEU  20           H        LEU  20   5.328 -14.469  -1.450
  137    HA   LEU  20           HA       LEU  20   6.980 -12.368  -2.527
  138   1HB   LEU  20          2HB       LEU  20   6.746 -13.703  -0.059
  139   2HB   LEU  20          1HB       LEU  20   8.395 -14.013  -0.602
  140    HG   LEU  20           HG       LEU  20   7.162 -11.249  -0.634
  141   1HD1  LEU  20          1HD1      LEU  20   8.153 -12.836   1.617
  142   2HD1  LEU  20          2HD1      LEU  20   7.273 -11.308   1.622
  143   3HD1  LEU  20          3HD1      LEU  20   9.025 -11.314   1.425
  144   1HD2  LEU  20          1HD2      LEU  20   9.515 -12.320  -1.729
  145   2HD2  LEU  20          2HD2      LEU  20  10.041 -11.493  -0.264
  146   3HD2  LEU  20          3HD2      LEU  20   9.151 -10.609  -1.504
  147    H    THR  21           H        THR  21   8.624 -12.491  -3.960
  148    HA   THR  21           HA       THR  21   9.410 -15.115  -5.040
  149    HB   THR  21           HB       THR  21  10.792 -13.703  -6.618
  150    HG1  THR  21           HG1      THR  21  11.035 -11.679  -6.171
  151   1HG2  THR  21          1HG2      THR  21   8.138 -12.450  -6.800
  152   2HG2  THR  21          2HG2      THR  21   8.089 -14.201  -6.596
  153   3HG2  THR  21          3HG2      THR  21   8.972 -13.495  -7.950
  154    H    SER  22           H        SER  22  10.901 -12.450  -3.213
  155    HA   SER  22           HA       SER  22  13.557 -13.600  -3.196
  156   1HB   SER  22          2HB       SER  22  12.178 -11.360  -1.781
  157   2HB   SER  22          1HB       SER  22  13.667 -11.981  -1.076
  158    HG   SER  22           HG       SER  22  14.298 -10.457  -2.516
  159    H    ASP  23           H        ASP  23  10.762 -13.816  -1.004
  160    HA   ASP  23           HA       ASP  23  12.339 -15.637   0.757
  161   1HB   ASP  23          2HB       ASP  23  10.853 -13.521   1.511
  162   2HB   ASP  23          1HB       ASP  23   9.602 -14.764   1.534
  163    HA   PRO  24           HA       PRO  24   9.917 -18.839  -1.241
  164   1HB   PRO  24          2HB       PRO  24  11.425 -20.899  -0.218
  165   2HB   PRO  24          1HB       PRO  24  11.894 -19.951  -1.640
  166   1HG   PRO  24          2HG       PRO  24  12.987 -19.839   1.133
  167   2HG   PRO  24          1HG       PRO  24  13.774 -19.431  -0.402
  168   1HD   PRO  24          2HD       PRO  24  12.711 -17.582   1.460
  169   2HD   PRO  24          1HD       PRO  24  13.197 -17.221  -0.211
  170    H    LYS  25           H        LYS  25  10.872 -18.777   2.195
  171    HA   LYS  25           HA       LYS  25   9.038 -20.758   3.151
  172   1HB   LYS  25          2HB       LYS  25  10.523 -18.464   4.398
  173   2HB   LYS  25          1HB       LYS  25   9.273 -19.284   5.330
  174   1HG   LYS  25          2HG       LYS  25  10.481 -21.221   5.508
  175   2HG   LYS  25          1HG       LYS  25  11.217 -21.034   3.915
  176   1HD   LYS  25          2HD       LYS  25  12.191 -18.873   5.421
  177   2HD   LYS  25          1HD       LYS  25  12.254 -20.256   6.514
  178   1HE   LYS  25          2HE       LYS  25  13.352 -21.538   4.590
  179   2HE   LYS  25          1HE       LYS  25  13.540 -19.978   3.793
  180   1HZ   LYS  25          1HZ       LYS  25  15.276 -21.051   5.573
  181   2HZ   LYS  25          2HZ       LYS  25  14.393 -19.965   6.539
  182   3HZ   LYS  25          3HZ       LYS  25  15.196 -19.410   5.147
  183    H    LEU  26           H        LEU  26   8.761 -17.189   3.021
  184    HA   LEU  26           HA       LEU  26   6.166 -16.931   4.101
  185   1HB   LEU  26          2HB       LEU  26   7.937 -15.301   2.383
  186   2HB   LEU  26          1HB       LEU  26   6.222 -14.932   2.226
  187    HG   LEU  26           HG       LEU  26   7.266 -13.546   3.976
  188   1HD1  LEU  26          1HD1      LEU  26   5.295 -13.631   5.046
  189   2HD1  LEU  26          2HD1      LEU  26   5.755 -15.143   5.829
  190   3HD1  LEU  26          3HD1      LEU  26   4.958 -15.171   4.256
  191   1HD2  LEU  26          1HD2      LEU  26   8.097 -16.247   5.011
  192   2HD2  LEU  26          2HD2      LEU  26   7.872 -14.908   6.134
  193   3HD2  LEU  26          3HD2      LEU  26   9.060 -14.780   4.837
  194    HA   PRO  27           HA       PRO  27   3.922 -19.032   0.840
  195   1HB   PRO  27          2HB       PRO  27   1.517 -18.999   2.172
  196   2HB   PRO  27          1HB       PRO  27   2.800 -20.181   2.485
  197   1HG   PRO  27          2HG       PRO  27   1.981 -17.819   4.118
  198   2HG   PRO  27          1HG       PRO  27   2.732 -19.337   4.639
  199   1HD   PRO  27          2HD       PRO  27   4.070 -16.875   4.313
  200   2HD   PRO  27          1HD       PRO  27   4.847 -18.467   4.456
  201    H    PHE  28           H        PHE  28   1.930 -18.494  -0.460
  202    HA   PHE  28           HA       PHE  28   1.915 -15.762  -1.301
  203   1HB   PHE  28          2HB       PHE  28   0.016 -16.389  -2.725
  204   2HB   PHE  28          1HB       PHE  28   1.263 -17.631  -2.784
  205    HD1  PHE  28           HD1      PHE  28  -2.081 -16.765  -1.456
  206    HD2  PHE  28           HD2      PHE  28   0.893 -19.840  -1.853
  207    HE1  PHE  28           HE1      PHE  28  -3.731 -18.459  -0.714
  208    HE2  PHE  28           HE2      PHE  28  -0.758 -21.532  -1.110
  209    HZ   PHE  28           HZ       PHE  28  -3.071 -20.843  -0.540
  210    H    LYS  29           H        LYS  29   0.178 -14.202  -1.168
  211    HA   LYS  29           HA       LYS  29  -1.511 -14.497   1.289
  212   1HB   LYS  29          2HB       LYS  29   0.339 -12.401   0.448
  213   2HB   LYS  29          1HB       LYS  29  -1.274 -11.760   0.756
  214   1HG   LYS  29          2HG       LYS  29  -0.514 -11.704   2.916
  215   2HG   LYS  29          1HG       LYS  29  -1.024 -13.394   2.897
  216   1HD   LYS  29          2HD       LYS  29   1.354 -13.898   2.016
  217   2HD   LYS  29          1HD       LYS  29   1.756 -12.272   2.570
  218   1HE   LYS  29          2HE       LYS  29   1.112 -12.812   4.835
  219   2HE   LYS  29          1HE       LYS  29   0.463 -14.371   4.331
  220   1HZ   LYS  29          1HZ       LYS  29   2.502 -15.280   4.207
  221   2HZ   LYS  29          2HZ       LYS  29   2.916 -14.043   5.293
  222   3HZ   LYS  29          3HZ       LYS  29   3.241 -13.864   3.635
  223    H    VAL  30           H        VAL  30  -3.684 -14.227   0.990
  224    HA   VAL  30           HA       VAL  30  -4.619 -13.463  -1.738
  225    HB   VAL  30           HB       VAL  30  -6.140 -14.799   0.529
  226   1HG1  VAL  30          1HG1      VAL  30  -6.810 -14.011  -2.296
  227   2HG1  VAL  30          2HG1      VAL  30  -7.781 -13.833  -0.834
  228   3HG1  VAL  30          3HG1      VAL  30  -7.586 -15.421  -1.575
  229   1HG2  VAL  30          1HG2      VAL  30  -5.953 -16.759  -1.198
  230   2HG2  VAL  30          2HG2      VAL  30  -4.578 -16.418  -0.150
  231   3HG2  VAL  30          3HG2      VAL  30  -4.575 -15.853  -1.820
  232    H    LEU  31           H        LEU  31  -5.432 -11.452  -2.005
  233    HA   LEU  31           HA       LEU  31  -6.471 -10.010   0.407
  234   1HB   LEU  31          2HB       LEU  31  -4.481  -9.265  -1.549
  235   2HB   LEU  31          1HB       LEU  31  -5.830  -8.132  -1.613
  236    HG   LEU  31           HG       LEU  31  -5.156  -8.785   1.140
  237   1HD1  LEU  31          1HD1      LEU  31  -2.985  -7.098   0.186
  238   2HD1  LEU  31          2HD1      LEU  31  -2.920  -8.688  -0.570
  239   3HD1  LEU  31          3HD1      LEU  31  -2.905  -8.547   1.191
  240   1HD2  LEU  31          1HD2      LEU  31  -6.470  -6.818   0.194
  241   2HD2  LEU  31          2HD2      LEU  31  -4.928  -6.153  -0.342
  242   3HD2  LEU  31          3HD2      LEU  31  -5.232  -6.396   1.377
  243    H    SER  32           H        SER  32  -8.659  -9.929   0.295
  244    HA   SER  32           HA       SER  32  -9.969  -9.773  -2.379
  245   1HB   SER  32          2HB       SER  32 -12.069 -10.262  -1.029
  246   2HB   SER  32          1HB       SER  32 -10.871 -11.552  -1.045
  247    HG   SER  32           HG       SER  32 -11.759 -10.975   1.065
  248    H    VAL  33           H        VAL  33 -10.164  -7.677  -3.004
  249    HA   VAL  33           HA       VAL  33 -11.448  -5.769  -1.104
  250    HB   VAL  33           HB       VAL  33  -9.935  -3.966  -2.049
  251   1HG1  VAL  33          1HG1      VAL  33  -7.835  -5.102  -0.783
  252   2HG1  VAL  33          2HG1      VAL  33  -9.124  -6.170  -0.232
  253   3HG1  VAL  33          3HG1      VAL  33  -9.225  -4.436   0.073
  254   1HG2  VAL  33          1HG2      VAL  33  -8.438  -4.452  -3.667
  255   2HG2  VAL  33          2HG2      VAL  33  -9.161  -6.055  -3.777
  256   3HG2  VAL  33          3HG2      VAL  33  -7.775  -5.784  -2.721
  257    HA   PRO  34           HA       PRO  34 -13.947  -4.730  -4.571
  258   1HB   PRO  34          2HB       PRO  34 -14.537  -2.107  -3.981
  259   2HB   PRO  34          1HB       PRO  34 -15.259  -3.489  -3.138
  260   1HG   PRO  34          2HG       PRO  34 -13.135  -1.612  -2.198
  261   2HG   PRO  34          1HG       PRO  34 -14.317  -2.534  -1.253
  262   1HD   PRO  34          2HD       PRO  34 -11.599  -3.210  -1.587
  263   2HD   PRO  34          1HD       PRO  34 -12.869  -4.293  -0.978
  264    H    GLU  35           H        GLU  35 -13.993  -3.395  -6.539
  265    HA   GLU  35           HA       GLU  35 -11.425  -2.799  -7.628
  266   1HB   GLU  35          2HB       GLU  35 -14.248  -2.197  -8.478
  267   2HB   GLU  35          1HB       GLU  35 -12.890  -1.517  -9.376
  268   1HG   GLU  35          2HG       GLU  35 -12.986  -3.493 -10.517
  269   2HG   GLU  35          1HG       GLU  35 -12.067  -4.100  -9.141
  270    H    SER  36           H        SER  36 -13.542  -0.872  -5.649
  271    HA   SER  36           HA       SER  36 -12.722   1.747  -6.437
  272   1HB   SER  36          2HB       SER  36 -13.408   2.373  -4.074
  273   2HB   SER  36          1HB       SER  36 -14.635   1.551  -5.021
  274    HG   SER  36           HG       SER  36 -13.977   0.831  -2.719
  275    H    THR  37           H        THR  37 -11.318  -0.554  -4.100
  276    HA   THR  37           HA       THR  37  -9.338   1.293  -3.096
  277    HB   THR  37           HB       THR  37  -8.217  -0.754  -2.206
  278    HG1  THR  37           HG1      THR  37  -8.572  -2.385  -3.513
  279   1HG2  THR  37          1HG2      THR  37  -9.986  -1.350  -0.672
  280   2HG2  THR  37          2HG2      THR  37 -11.218  -0.809  -1.812
  281   3HG2  THR  37          3HG2      THR  37 -10.146   0.365  -1.047
  282    HA   PRO  38           HA       PRO  38  -6.665   1.135  -6.631
  283   1HB   PRO  38          2HB       PRO  38  -4.698   2.719  -5.546
  284   2HB   PRO  38          1HB       PRO  38  -6.213   3.353  -6.213
  285   1HG   PRO  38          2HG       PRO  38  -5.395   3.065  -3.360
  286   2HG   PRO  38          1HG       PRO  38  -6.535   4.206  -4.091
  287   1HD   PRO  38          2HD       PRO  38  -7.221   1.867  -2.653
  288   2HD   PRO  38          1HD       PRO  38  -8.317   2.833  -3.664
  289    H    PHE  39           H        PHE  39  -4.346   0.499  -7.078
  290    HA   PHE  39           HA       PHE  39  -3.624  -1.897  -5.666
  291   1HB   PHE  39          2HB       PHE  39  -3.031  -1.073  -8.110
  292   2HB   PHE  39          1HB       PHE  39  -1.603  -0.414  -7.311
  293    HD1  PHE  39           HD1      PHE  39   0.264  -1.804  -7.371
  294    HD2  PHE  39           HD2      PHE  39  -3.642  -3.570  -7.095
  295    HE1  PHE  39           HE1      PHE  39   1.286  -4.063  -7.340
  296    HE2  PHE  39           HE2      PHE  39  -2.620  -5.827  -7.065
  297    HZ   PHE  39           HZ       PHE  39  -0.156  -6.074  -7.187
  298    H    THR  40           H        THR  40  -2.969   1.433  -5.002
  299    HA   THR  40           HA       THR  40  -0.456   1.205  -3.646
  300    HB   THR  40           HB       THR  40  -1.248   3.262  -2.389
  301    HG1  THR  40           HG1      THR  40  -3.290   3.665  -2.401
  302   1HG2  THR  40          1HG2      THR  40  -0.934   2.920  -5.276
  303   2HG2  THR  40          2HG2      THR  40  -0.223   4.126  -4.204
  304   3HG2  THR  40          3HG2      THR  40  -1.845   4.368  -4.852
  305    H    ALA  41           H        ALA  41  -3.822   0.901  -2.507
  306    HA   ALA  41           HA       ALA  41  -3.065   0.239   0.222
  307   1HB   ALA  41          1HB       ALA  41  -5.683  -0.196  -1.249
  308   2HB   ALA  41          2HB       ALA  41  -5.264   1.234  -0.307
  309   3HB   ALA  41          3HB       ALA  41  -5.454  -0.325   0.495
  310    H    VAL  42           H        VAL  42  -3.941  -1.613  -2.693
  311    HA   VAL  42           HA       VAL  42  -4.081  -4.196  -1.464
  312    HB   VAL  42           HB       VAL  42  -3.247  -3.449  -4.290
  313   1HG1  VAL  42          1HG1      VAL  42  -4.556  -6.044  -3.734
  314   2HG1  VAL  42          2HG1      VAL  42  -2.915  -5.894  -3.110
  315   3HG1  VAL  42          3HG1      VAL  42  -3.227  -5.665  -4.830
  316   1HG2  VAL  42          1HG2      VAL  42  -5.907  -4.052  -2.980
  317   2HG2  VAL  42          2HG2      VAL  42  -5.673  -4.186  -4.723
  318   3HG2  VAL  42          3HG2      VAL  42  -5.458  -2.630  -3.922
  319    H    LEU  43           H        LEU  43  -1.352  -2.537  -3.089
  320    HA   LEU  43           HA       LEU  43   0.606  -4.566  -2.590
  321   1HB   LEU  43          2HB       LEU  43   0.746  -2.513  -4.163
  322   2HB   LEU  43          1HB       LEU  43   1.230  -1.610  -2.728
  323    HG   LEU  43           HG       LEU  43   2.691  -4.122  -2.952
  324   1HD1  LEU  43          1HD1      LEU  43   2.793  -2.157  -5.256
  325   2HD1  LEU  43          2HD1      LEU  43   2.496  -3.893  -5.335
  326   3HD1  LEU  43          3HD1      LEU  43   4.096  -3.291  -4.904
  327   1HD2  LEU  43          1HD2      LEU  43   4.579  -2.259  -2.999
  328   2HD2  LEU  43          2HD2      LEU  43   3.653  -2.554  -1.529
  329   3HD2  LEU  43          3HD2      LEU  43   3.237  -1.196  -2.575
  330    H    LYS  44           H        LYS  44  -0.478  -1.776  -0.678
  331    HA   LYS  44           HA       LYS  44   1.516  -1.879   1.363
  332   1HB   LYS  44          2HB       LYS  44  -0.769  -0.350   0.821
  333   2HB   LYS  44          1HB       LYS  44  -1.115  -1.123   2.366
  334   1HG   LYS  44          2HG       LYS  44   0.175   0.443   3.343
  335   2HG   LYS  44          1HG       LYS  44   1.564  -0.302   2.553
  336   1HD   LYS  44          2HD       LYS  44   1.463   1.195   0.715
  337   2HD   LYS  44          1HD       LYS  44  -0.175   1.710   1.122
  338   1HE   LYS  44          2HE       LYS  44   0.674   2.750   3.198
  339   2HE   LYS  44          1HE       LYS  44   2.312   2.257   2.770
  340   1HZ   LYS  44          1HZ       LYS  44   1.984   3.540   0.659
  341   2HZ   LYS  44          2HZ       LYS  44   2.055   4.482   2.070
  342   3HZ   LYS  44          3HZ       LYS  44   0.559   4.167   1.330
  343    H    PHE  45           H        PHE  45  -1.766  -3.338   1.283
  344    HA   PHE  45           HA       PHE  45  -1.578  -4.694   3.788
  345   1HB   PHE  45          2HB       PHE  45  -3.455  -4.506   1.666
  346   2HB   PHE  45          1HB       PHE  45  -3.153  -6.221   1.924
  347    HD1  PHE  45           HD1      PHE  45  -4.162  -3.064   3.603
  348    HD2  PHE  45           HD2      PHE  45  -3.933  -7.340   3.885
  349    HE1  PHE  45           HE1      PHE  45  -5.577  -3.004   5.639
  350    HE2  PHE  45           HE2      PHE  45  -5.347  -7.283   5.921
  351    HZ   PHE  45           HZ       PHE  45  -6.171  -5.115   6.800
  352    H    ALA  46           H        ALA  46  -0.748  -5.776   0.484
  353    HA   ALA  46           HA       ALA  46  -0.051  -8.465   1.200
  354   1HB   ALA  46          1HB       ALA  46   0.544  -8.697  -0.998
  355   2HB   ALA  46          2HB       ALA  46   1.467  -7.196  -1.013
  356   3HB   ALA  46          3HB       ALA  46  -0.289  -7.152  -1.167
  357    H    ALA  47           H        ALA  47   1.932  -5.502   0.899
  358    HA   ALA  47           HA       ALA  47   4.429  -6.760   1.569
  359   1HB   ALA  47          1HB       ALA  47   5.220  -4.452   1.999
  360   2HB   ALA  47          2HB       ALA  47   3.556  -3.875   1.914
  361   3HB   ALA  47          3HB       ALA  47   4.326  -4.556   0.481
  362    H    GLU  48           H        GLU  48   1.995  -5.047   3.553
  363    HA   GLU  48           HA       GLU  48   3.397  -5.156   6.032
  364   1HB   GLU  48          2HB       GLU  48   0.624  -4.681   5.156
  365   2HB   GLU  48          1HB       GLU  48   0.748  -5.395   6.764
  366   1HG   GLU  48          2HG       GLU  48   0.907  -3.120   7.258
  367   2HG   GLU  48          1HG       GLU  48   2.606  -3.570   7.126
  368    H    GLU  49           H        GLU  49   1.148  -7.486   4.523
  369    HA   GLU  49           HA       GLU  49   1.225  -9.383   6.703
  370   1HB   GLU  49          2HB       GLU  49   0.442  -9.577   3.789
  371   2HB   GLU  49          1HB       GLU  49   0.429 -10.990   4.845
  372   1HG   GLU  49          2HG       GLU  49  -1.092  -9.803   6.400
  373   2HG   GLU  49          1HG       GLU  49  -1.102  -8.413   5.314
  374    H    PHE  50           H        PHE  50   3.164  -8.905   3.776
  375    HA   PHE  50           HA       PHE  50   4.682 -11.376   4.114
  376   1HB   PHE  50          2HB       PHE  50   4.717  -9.045   2.251
  377   2HB   PHE  50          1HB       PHE  50   6.209  -9.967   2.416
  378    HD1  PHE  50           HD1      PHE  50   3.355  -9.716   0.484
  379    HD2  PHE  50           HD2      PHE  50   5.664 -12.674   2.576
  380    HE1  PHE  50           HE1      PHE  50   2.434 -11.481  -0.992
  381    HE2  PHE  50           HE2      PHE  50   4.741 -14.437   1.099
  382    HZ   PHE  50           HZ       PHE  50   3.128 -13.842  -0.683
  383    H    LYS  51           H        LYS  51   4.717  -8.525   5.857
  384    HA   LYS  51           HA       LYS  51   6.196  -7.668   7.442
  385   1HB   LYS  51          2HB       LYS  51   6.953 -10.416   7.137
  386   2HB   LYS  51          1HB       LYS  51   8.421  -9.452   7.285
  387   1HG   LYS  51          2HG       LYS  51   6.703  -8.349   9.183
  388   2HG   LYS  51          1HG       LYS  51   6.409 -10.082   9.303
  389   1HD   LYS  51          2HD       LYS  51   8.364 -10.371  10.380
  390   2HD   LYS  51          1HD       LYS  51   9.238  -9.635   9.037
  391   1HE   LYS  51          2HE       LYS  51   8.035  -7.464  10.290
  392   2HE   LYS  51          1HE       LYS  51   8.527  -8.493  11.634
  393   1HZ   LYS  51          1HZ       LYS  51  10.504  -8.235   9.540
  394   2HZ   LYS  51          2HZ       LYS  51  10.682  -8.129  11.228
  395   3HZ   LYS  51          3HZ       LYS  51  10.150  -6.781  10.340
  396    H    VAL  52           H        VAL  52   6.307  -6.729   4.757
  397    HA   VAL  52           HA       VAL  52   9.148  -5.827   4.667
  398    HB   VAL  52           HB       VAL  52   9.043  -5.899   2.157
  399   1HG1  VAL  52          1HG1      VAL  52   8.545  -8.715   2.852
  400   2HG1  VAL  52          2HG1      VAL  52   9.674  -7.900   3.934
  401   3HG1  VAL  52          3HG1      VAL  52   9.997  -7.954   2.202
  402   1HG2  VAL  52          1HG2      VAL  52   6.861  -6.025   1.432
  403   2HG2  VAL  52          2HG2      VAL  52   6.349  -7.003   2.806
  404   3HG2  VAL  52          3HG2      VAL  52   7.218  -7.752   1.468
  405    HA   PRO  53           HA       PRO  53   7.358  -1.837   4.215
  406   1HB   PRO  53          2HB       PRO  53   9.354  -0.563   2.813
  407   2HB   PRO  53          1HB       PRO  53   9.452  -0.958   4.537
  408   1HG   PRO  53          2HG       PRO  53  10.804  -2.279   2.228
  409   2HG   PRO  53          1HG       PRO  53  11.320  -2.178   3.919
  410   1HD   PRO  53          2HD       PRO  53  10.129  -4.427   2.692
  411   2HD   PRO  53          1HD       PRO  53  10.319  -4.175   4.441
  412    H    ALA  54           H        ALA  54   5.750  -1.233   2.858
  413    HA   ALA  54           HA       ALA  54   5.622  -2.169   0.099
  414   1HB   ALA  54          1HB       ALA  54   3.563  -0.462   0.217
  415   2HB   ALA  54          2HB       ALA  54   3.843  -0.645   1.948
  416   3HB   ALA  54          3HB       ALA  54   3.488  -2.060   0.958
  417    H    ALA  55           H        ALA  55   6.633   0.795   1.678
  418    HA   ALA  55           HA       ALA  55   6.342   2.626  -0.481
  419   1HB   ALA  55          1HB       ALA  55   8.471   2.552   1.679
  420   2HB   ALA  55          2HB       ALA  55   6.900   3.344   1.805
  421   3HB   ALA  55          3HB       ALA  55   8.099   3.943   0.659
  422    H    THR  56           H        THR  56   9.011   0.380   0.301
  423    HA   THR  56           HA       THR  56  10.250   1.100  -2.324
  424    HB   THR  56           HB       THR  56  11.659   1.496  -0.302
  425    HG1  THR  56           HG1      THR  56  12.984   1.111  -1.899
  426   1HG2  THR  56          1HG2      THR  56  10.761  -1.208   0.303
  427   2HG2  THR  56          2HG2      THR  56  11.506  -0.012   1.364
  428   3HG2  THR  56          3HG2      THR  56  12.517  -1.069   0.380
  429    H    SER  57           H        SER  57   8.032  -0.713  -2.221
  430    HA   SER  57           HA       SER  57   9.403  -3.211  -3.119
  431   1HB   SER  57          2HB       SER  57   7.914  -3.118  -0.829
  432   2HB   SER  57          1HB       SER  57   6.695  -3.579  -2.009
  433    HG   SER  57           HG       SER  57   7.785  -5.392  -1.151
  434    H    ALA  58           H        ALA  58   8.104  -4.471  -4.648
  435    HA   ALA  58           HA       ALA  58   5.949  -2.965  -6.041
  436   1HB   ALA  58          1HB       ALA  58   7.163  -2.601  -7.908
  437   2HB   ALA  58          2HB       ALA  58   7.680  -4.286  -7.958
  438   3HB   ALA  58          3HB       ALA  58   8.590  -3.113  -7.009
  439    H    ILE  59           H        ILE  59   4.778  -4.433  -7.617
  440    HA   ILE  59           HA       ILE  59   4.987  -7.298  -6.782
  441    HB   ILE  59           HB       ILE  59   2.577  -5.505  -6.960
  442   1HG1  ILE  59          2HG1      ILE  59   3.259  -7.759  -5.051
  443   2HG1  ILE  59          1HG1      ILE  59   3.793  -6.097  -4.800
  444   1HG2  ILE  59          1HG2      ILE  59   2.183  -7.453  -8.499
  445   2HG2  ILE  59          2HG2      ILE  59   1.100  -7.431  -7.108
  446   3HG2  ILE  59          3HG2      ILE  59   2.476  -8.533  -7.135
  447   1HD1  ILE  59          1HD1      ILE  59   1.000  -7.210  -4.750
  448   2HD1  ILE  59          2HD1      ILE  59   1.261  -5.509  -5.135
  449   3HD1  ILE  59          3HD1      ILE  59   1.796  -6.153  -3.583
  450    H    ILE  60           H        ILE  60   5.385  -8.594  -8.502
  451    HA   ILE  60           HA       ILE  60   4.824  -7.541 -11.228
  452    HB   ILE  60           HB       ILE  60   6.341  -9.296 -12.029
  453   1HG1  ILE  60          2HG1      ILE  60   7.341 -10.164  -9.434
  454   2HG1  ILE  60          1HG1      ILE  60   5.640 -10.584  -9.635
  455   1HG2  ILE  60          1HG2      ILE  60   8.011  -7.858 -11.596
  456   2HG2  ILE  60          2HG2      ILE  60   8.137  -8.482  -9.951
  457   3HG2  ILE  60          3HG2      ILE  60   7.051  -7.138 -10.303
  458   1HD1  ILE  60          1HD1      ILE  60   7.760 -11.164 -11.722
  459   2HD1  ILE  60          2HD1      ILE  60   6.096 -11.749 -11.699
  460   3HD1  ILE  60          3HD1      ILE  60   7.250 -12.330 -10.499
  461    H    THR  61           H        THR  61   4.107  -9.335 -12.843
  462    HA   THR  61           HA       THR  61   1.965 -10.959 -11.525
  463    HB   THR  61           HB       THR  61   1.108  -9.156 -12.991
  464    HG1  THR  61           HG1      THR  61  -0.115 -11.009 -12.896
  465   1HG2  THR  61          1HG2      THR  61   3.097 -10.334 -14.837
  466   2HG2  THR  61          2HG2      THR  61   2.498  -8.681 -14.729
  467   3HG2  THR  61          3HG2      THR  61   1.550  -9.909 -15.566
  468    H    ASN  62           H        ASN  62   1.322 -12.913 -12.962
  469    HA   ASN  62           HA       ASN  62   3.581 -14.663 -13.207
  470   1HB   ASN  62          2HB       ASN  62   1.987 -16.289 -14.094
  471   2HB   ASN  62          1HB       ASN  62   1.261 -15.434 -12.734
  472   1HD2  ASN  62          1HD2      ASN  62   0.893 -16.169 -16.101
  473   2HD2  ASN  62          2HD2      ASN  62  -0.451 -15.175 -16.392
  474    H    ASP  63           H        ASP  63   2.178 -12.414 -15.451
  475    HA   ASP  63           HA       ASP  63   3.165 -13.740 -17.861
  476   1HB   ASP  63          2HB       ASP  63   2.297 -10.854 -17.515
  477   2HB   ASP  63          1HB       ASP  63   2.403 -11.755 -19.027
  478    H    GLY  64           H        GLY  64   4.446 -11.449 -15.538
  479   1HA   GLY  64          2HA       GLY  64   6.890 -11.199 -15.387
  480   2HA   GLY  64          1HA       GLY  64   6.960 -11.314 -17.145
  481    H    VAL  65           H        VAL  65   4.872  -9.347 -15.010
  482    HA   VAL  65           HA       VAL  65   6.030  -6.892 -16.269
  483    HB   VAL  65           HB       VAL  65   3.090  -7.336 -15.645
  484   1HG1  VAL  65          1HG1      VAL  65   2.842  -5.222 -16.962
  485   2HG1  VAL  65          2HG1      VAL  65   4.600  -5.088 -17.012
  486   3HG1  VAL  65          3HG1      VAL  65   3.751  -4.999 -15.468
  487   1HG2  VAL  65          1HG2      VAL  65   2.729  -7.558 -18.011
  488   2HG2  VAL  65          2HG2      VAL  65   4.025  -8.679 -17.598
  489   3HG2  VAL  65          3HG2      VAL  65   4.404  -7.139 -18.369
  490    H    GLY  66           H        GLY  66   6.708  -5.455 -14.752
  491   1HA   GLY  66          2HA       GLY  66   6.313  -5.999 -11.920
  492   2HA   GLY  66          1HA       GLY  66   7.224  -4.650 -12.599
  493    H    VAL  67           H        VAL  67   4.019  -5.768 -11.698
  494    HA   VAL  67           HA       VAL  67   2.564  -3.399 -12.443
  495    HB   VAL  67           HB       VAL  67   1.893  -5.303 -10.177
  496   1HG1  VAL  67          1HG1      VAL  67   0.551  -3.231 -10.286
  497   2HG1  VAL  67          2HG1      VAL  67  -0.422  -4.641 -10.705
  498   3HG1  VAL  67          3HG1      VAL  67   0.170  -3.570 -11.975
  499   1HG2  VAL  67          1HG2      VAL  67   2.268  -6.663 -12.135
  500   2HG2  VAL  67          2HG2      VAL  67   1.406  -5.518 -13.162
  501   3HG2  VAL  67          3HG2      VAL  67   0.523  -6.470 -11.968
  502    H    ASN  68           H        ASN  68   2.426  -1.450 -11.430
  503    HA   ASN  68           HA       ASN  68   3.834  -1.147  -8.812
  504   1HB   ASN  68          2HB       ASN  68   3.475   0.614 -11.203
  505   2HB   ASN  68          1HB       ASN  68   3.591   1.389  -9.623
  506   1HD2  ASN  68          1HD2      ASN  68   5.684   1.647  -8.772
  507   2HD2  ASN  68          2HD2      ASN  68   7.071   0.887  -9.390
  508    HA   PRO  69           HA       PRO  69   0.083   0.055  -6.858
  509   1HB   PRO  69          2HB       PRO  69   1.062   1.832  -4.997
  510   2HB   PRO  69          1HB       PRO  69   1.262   0.077  -4.874
  511   1HG   PRO  69          2HG       PRO  69   3.274   2.145  -5.612
  512   2HG   PRO  69          1HG       PRO  69   3.522   0.540  -4.901
  513   1HD   PRO  69          2HD       PRO  69   3.901   1.240  -7.626
  514   2HD   PRO  69          1HD       PRO  69   3.859  -0.406  -6.960
  515    H    ALA  70           H        ALA  70  -0.296   1.216  -9.076
  516    HA   ALA  70           HA       ALA  70  -0.775   4.115  -8.532
  517   1HB   ALA  70          1HB       ALA  70   0.584   4.733 -10.215
  518   2HB   ALA  70          2HB       ALA  70  -0.312   3.710 -11.337
  519   3HB   ALA  70          3HB       ALA  70   1.051   3.048 -10.438
  520    H    GLN  71           H        GLN  71  -1.611   1.306 -10.585
  521    HA   GLN  71           HA       GLN  71  -4.098   2.540 -11.508
  522   1HB   GLN  71          2HB       GLN  71  -2.812  -0.169 -11.842
  523   2HB   GLN  71          1HB       GLN  71  -4.471   0.115 -12.370
  524   1HG   GLN  71          2HG       GLN  71  -3.727   1.116 -14.241
  525   2HG   GLN  71          1HG       GLN  71  -2.844   2.296 -13.274
  526   1HE2  GLN  71          1HE2      GLN  71  -0.626   1.471 -12.423
  527   2HE2  GLN  71          2HE2      GLN  71   0.263   0.453 -13.448
  528    HA   PRO  72           HA       PRO  72  -6.785   1.062  -8.352
  529   1HB   PRO  72          2HB       PRO  72  -9.068   0.598  -9.813
  530   2HB   PRO  72          1HB       PRO  72  -8.483   2.216  -9.391
  531   1HG   PRO  72          2HG       PRO  72  -8.373   0.805 -12.017
  532   2HG   PRO  72          1HG       PRO  72  -8.417   2.543 -11.677
  533   1HD   PRO  72          2HD       PRO  72  -6.118   1.059 -12.384
  534   2HD   PRO  72          1HD       PRO  72  -6.129   2.700 -11.702
  535    H    ALA  73           H        ALA  73  -7.874  -0.864  -7.530
  536    HA   ALA  73           HA       ALA  73  -6.683  -3.344  -8.165
  537   1HB   ALA  73          1HB       ALA  73  -7.907  -2.844  -6.046
  538   2HB   ALA  73          2HB       ALA  73  -8.413  -4.364  -6.780
  539   3HB   ALA  73          3HB       ALA  73  -9.427  -2.930  -6.937
  540    H    GLY  74           H        GLY  74  -9.732  -1.942  -9.368
  541   1HA   GLY  74          2HA       GLY  74 -10.710  -4.215 -10.763
  542   2HA   GLY  74          1HA       GLY  74 -11.068  -2.544 -11.199
  543    H    ASN  75           H        ASN  75  -8.572  -1.580 -11.914
  544    HA   ASN  75           HA       ASN  75  -8.235  -2.655 -14.566
  545   1HB   ASN  75          2HB       ASN  75  -7.396  -0.353 -13.150
  546   2HB   ASN  75          1HB       ASN  75  -5.927  -1.146 -13.717
  547   1HD2  ASN  75          1HD2      ASN  75  -9.145  -0.036 -14.903
  548   2HD2  ASN  75          2HD2      ASN  75  -8.620   0.274 -16.487
  549    H    ILE  76           H        ILE  76  -6.395  -3.040 -11.543
  550    HA   ILE  76           HA       ILE  76  -4.166  -4.465 -12.620
  551    HB   ILE  76           HB       ILE  76  -5.462  -4.672  -9.882
  552   1HG1  ILE  76          2HG1      ILE  76  -4.667  -2.396 -10.525
  553   2HG1  ILE  76          1HG1      ILE  76  -3.739  -3.076  -9.193
  554   1HG2  ILE  76          1HG2      ILE  76  -2.635  -5.425 -10.673
  555   2HG2  ILE  76          2HG2      ILE  76  -3.944  -6.597 -10.535
  556   3HG2  ILE  76          3HG2      ILE  76  -3.422  -5.690  -9.118
  557   1HD1  ILE  76          1HD1      ILE  76  -2.866  -2.348 -11.899
  558   2HD1  ILE  76          2HD1      ILE  76  -2.348  -3.963 -11.417
  559   3HD1  ILE  76          3HD1      ILE  76  -1.912  -2.565 -10.432
  560    H    PHE  77           H        PHE  77  -7.298  -5.626 -11.356
  561    HA   PHE  77           HA       PHE  77  -6.708  -8.429 -11.796
  562   1HB   PHE  77          2HB       PHE  77  -8.488  -7.377 -10.236
  563   2HB   PHE  77          1HB       PHE  77  -9.482  -7.242 -11.686
  564    HD1  PHE  77           HD1      PHE  77 -10.295  -9.236 -12.855
  565    HD2  PHE  77           HD2      PHE  77  -7.910  -9.558  -9.297
  566    HE1  PHE  77           HE1      PHE  77 -10.930 -11.624 -12.645
  567    HE2  PHE  77           HE2      PHE  77  -8.543 -11.947  -9.091
  568    HZ   PHE  77           HZ       PHE  77 -10.054 -12.980 -10.763
  569    H    LEU  78           H        LEU  78  -8.281  -5.887 -13.714
  570    HA   LEU  78           HA       LEU  78  -9.299  -7.607 -15.784
  571   1HB   LEU  78          2HB       LEU  78  -8.671  -4.661 -15.629
  572   2HB   LEU  78          1HB       LEU  78  -9.199  -5.397 -17.141
  573    HG   LEU  78           HG       LEU  78 -10.734  -5.764 -14.563
  574   1HD1  LEU  78          1HD1      LEU  78 -10.949  -3.462 -14.757
  575   2HD1  LEU  78          2HD1      LEU  78 -12.259  -3.987 -15.815
  576   3HD1  LEU  78          3HD1      LEU  78 -10.717  -3.483 -16.505
  577   1HD2  LEU  78          1HD2      LEU  78 -10.938  -6.759 -17.254
  578   2HD2  LEU  78          2HD2      LEU  78 -12.338  -5.740 -16.919
  579   3HD2  LEU  78          3HD2      LEU  78 -11.977  -7.114 -15.873
  580    H    LYS  79           H        LYS  79  -6.219  -5.846 -15.413
  581    HA   LYS  79           HA       LYS  79  -5.255  -6.697 -18.043
  582   1HB   LYS  79          2HB       LYS  79  -4.038  -5.200 -15.726
  583   2HB   LYS  79          1HB       LYS  79  -3.048  -5.737 -17.084
  584   1HG   LYS  79          2HG       LYS  79  -4.704  -4.579 -18.616
  585   2HG   LYS  79          1HG       LYS  79  -5.431  -3.873 -17.173
  586   1HD   LYS  79          2HD       LYS  79  -2.469  -3.633 -17.501
  587   2HD   LYS  79          1HD       LYS  79  -3.496  -2.611 -18.507
  588   1HE   LYS  79          2HE       LYS  79  -3.362  -1.237 -16.667
  589   2HE   LYS  79          1HE       LYS  79  -4.729  -2.224 -16.153
  590   1HZ   LYS  79          1HZ       LYS  79  -3.543  -2.904 -14.431
  591   2HZ   LYS  79          2HZ       LYS  79  -2.222  -1.963 -14.933
  592   3HZ   LYS  79          3HZ       LYS  79  -2.372  -3.570 -15.461
  593    H    HIS  80           H        HIS  80  -4.242  -7.417 -14.669
  594    HA   HIS  80           HA       HIS  80  -2.803  -9.813 -15.698
  595   1HB   HIS  80          2HB       HIS  80  -2.729  -8.645 -12.902
  596   2HB   HIS  80          1HB       HIS  80  -1.620  -9.830 -13.592
  597    HD1  HIS  80           HD1      HIS  80  -0.386  -8.860 -15.919
  598    HD2  HIS  80           HD2      HIS  80  -1.770  -6.072 -13.146
  599    HE1  HIS  80           HE1      HIS  80   0.805  -6.685 -16.434
  600    H    GLY  81           H        GLY  81  -4.772  -9.078 -12.778
  601   1HA   GLY  81          2HA       GLY  81  -6.916 -10.418 -12.555
  602   2HA   GLY  81          1HA       GLY  81  -5.961 -11.813 -13.053
  603    H    SER  82           H        SER  82  -5.581 -13.100 -11.323
  604    HA   SER  82           HA       SER  82  -5.158 -11.824  -8.657
  605   1HB   SER  82          2HB       SER  82  -6.912 -13.754  -9.222
  606   2HB   SER  82          1HB       SER  82  -5.505 -14.779  -8.959
  607    HG   SER  82           HG       SER  82  -6.344 -14.513  -6.971
  608    H    GLU  83           H        GLU  83  -3.649 -13.961 -11.039
  609    HA   GLU  83           HA       GLU  83  -1.518 -14.939  -9.407
  610   1HB   GLU  83          2HB       GLU  83  -1.848 -14.549 -12.378
  611   2HB   GLU  83          1HB       GLU  83  -0.317 -15.111 -11.706
  612   1HG   GLU  83          2HG       GLU  83  -1.153 -17.194 -11.556
  613   2HG   GLU  83          1HG       GLU  83  -2.400 -16.608 -10.457
  614    H    LEU  84           H        LEU  84  -0.482 -13.397  -8.190
  615    HA   LEU  84           HA       LEU  84   1.139 -11.381  -9.676
  616   1HB   LEU  84          2HB       LEU  84  -0.599 -10.895  -7.239
  617   2HB   LEU  84          1HB       LEU  84   0.691  -9.796  -7.724
  618    HG   LEU  84           HG       LEU  84  -1.413 -10.642  -9.709
  619   1HD1  LEU  84          1HD1      LEU  84  -1.702  -8.791  -7.395
  620   2HD1  LEU  84          2HD1      LEU  84  -2.929  -9.726  -8.250
  621   3HD1  LEU  84          3HD1      LEU  84  -2.325  -8.220  -8.944
  622   1HD2  LEU  84          1HD2      LEU  84   0.894  -9.024  -9.781
  623   2HD2  LEU  84          2HD2      LEU  84  -0.465  -7.899  -9.788
  624   3HD2  LEU  84          3HD2      LEU  84  -0.349  -9.149 -11.027
  625    H    ARG  85           H        ARG  85   2.950 -10.539  -8.180
  626    HA   ARG  85           HA       ARG  85   3.709 -12.450  -6.043
  627   1HB   ARG  85          2HB       ARG  85   5.069 -12.152  -8.677
  628   2HB   ARG  85          1HB       ARG  85   6.100 -12.316  -7.256
  629   1HG   ARG  85          2HG       ARG  85   5.124 -14.416  -6.673
  630   2HG   ARG  85          1HG       ARG  85   3.799 -14.197  -7.815
  631   1HD   ARG  85          2HD       ARG  85   5.464 -14.233  -9.681
  632   2HD   ARG  85          1HD       ARG  85   6.725 -14.610  -8.507
  633    HE   ARG  85           HE       ARG  85   4.524 -16.420  -9.335
  634   1HH1  ARG  85          2HH1      ARG  85   5.707 -16.218  -6.364
  635   2HH1  ARG  85          1HH1      ARG  85   6.677 -17.651  -6.382
  636   1HH2  ARG  85          1HH2      ARG  85   6.447 -18.080  -9.817
  637   2HH2  ARG  85          2HH2      ARG  85   7.097 -18.710  -8.340
  638    H    LEU  86           H        LEU  86   5.231 -11.570  -4.549
  639    HA   LEU  86           HA       LEU  86   5.466  -8.605  -4.697
  640   1HB   LEU  86          2HB       LEU  86   4.523 -10.012  -2.663
  641   2HB   LEU  86          1HB       LEU  86   6.233 -10.192  -2.272
  642    HG   LEU  86           HG       LEU  86   5.819  -7.461  -2.958
  643   1HD1  LEU  86          1HD1      LEU  86   3.810  -8.535  -0.950
  644   2HD1  LEU  86          2HD1      LEU  86   3.426  -7.811  -2.513
  645   3HD1  LEU  86          3HD1      LEU  86   4.143  -6.825  -1.238
  646   1HD2  LEU  86          1HD2      LEU  86   6.641  -9.101  -0.617
  647   2HD2  LEU  86          2HD2      LEU  86   6.134  -7.449  -0.266
  648   3HD2  LEU  86          3HD2      LEU  86   7.466  -7.743  -1.385
  649    H    ILE  87           H        ILE  87   7.397  -7.678  -5.108
  650    HA   ILE  87           HA       ILE  87   9.887  -9.247  -4.601
  651    HB   ILE  87           HB       ILE  87   9.536  -9.352  -6.995
  652   1HG1  ILE  87          2HG1      ILE  87  11.480  -7.069  -6.621
  653   2HG1  ILE  87          1HG1      ILE  87  11.838  -8.686  -6.017
  654   1HG2  ILE  87          1HG2      ILE  87   9.310  -7.253  -8.336
  655   2HG2  ILE  87          2HG2      ILE  87   9.155  -6.347  -6.832
  656   3HG2  ILE  87          3HG2      ILE  87   7.933  -7.540  -7.272
  657   1HD1  ILE  87          1HD1      ILE  87  12.790  -8.441  -8.249
  658   2HD1  ILE  87          2HD1      ILE  87  11.228  -7.937  -8.891
  659   3HD1  ILE  87          3HD1      ILE  87  11.453  -9.588  -8.314
  660    HA   PRO  88           HA       PRO  88  10.795  -5.497  -2.402
  661   1HB   PRO  88          2HB       PRO  88  13.283  -6.296  -1.538
  662   2HB   PRO  88          1HB       PRO  88  11.765  -6.816  -0.787
  663   1HG   PRO  88          2HG       PRO  88  13.595  -8.348  -2.581
  664   2HG   PRO  88          1HG       PRO  88  12.496  -8.943  -1.326
  665   1HD   PRO  88          2HD       PRO  88  12.003  -9.015  -4.101
  666   2HD   PRO  88          1HD       PRO  88  10.787  -9.241  -2.826
  667    H    ARG  89           H        ARG  89  11.347  -3.705  -3.572
  668    HA   ARG  89           HA       ARG  89  13.205  -3.776  -5.793
  669   1HB   ARG  89          2HB       ARG  89  11.817  -1.509  -4.339
  670   2HB   ARG  89          1HB       ARG  89  12.902  -1.239  -5.703
  671   1HG   ARG  89          2HG       ARG  89  11.482  -2.851  -7.041
  672   2HG   ARG  89          1HG       ARG  89  10.334  -2.852  -5.703
  673   1HD   ARG  89          2HD       ARG  89   9.436  -1.169  -7.024
  674   2HD   ARG  89          1HD       ARG  89  10.496  -0.221  -5.983
  675    HE   ARG  89           HE       ARG  89  11.990  -1.031  -8.271
  676   1HH1  ARG  89          1HH2      ARG  89  11.760   1.799  -7.260
  677   2HH1  ARG  89          2HH2      ARG  89  10.939   2.584  -8.565
  678   1HH2  ARG  89          2HH1      ARG  89   9.877  -0.392 -10.027
  679   2HH2  ARG  89          1HH1      ARG  89   9.870   1.336 -10.143
  680    H    ASP  90           H        ASP  90  13.387  -2.206  -2.561
  681    HA   ASP  90           HA       ASP  90  15.220  -1.631  -1.231
  682   1HB   ASP  90          2HB       ASP  90  15.784  -4.078  -1.757
  683   2HB   ASP  90          1HB       ASP  90  16.900  -3.449  -2.969
  684    H    ARG  91           H        ARG  91  15.721   0.473  -1.585
  685    HA   ARG  91           HA       ARG  91  16.939   1.334  -4.127
  686   1HB   ARG  91          2HB       ARG  91  15.154   2.593  -2.643
  687   2HB   ARG  91          1HB       ARG  91  16.573   3.136  -1.748
  688   1HG   ARG  91          2HG       ARG  91  17.494   4.217  -3.655
  689   2HG   ARG  91          1HG       ARG  91  16.395   3.384  -4.758
  690   1HD   ARG  91          2HD       ARG  91  14.946   4.868  -2.714
  691   2HD   ARG  91          1HD       ARG  91  16.018   5.915  -3.637
  692    HE   ARG  91           HE       ARG  91  14.856   5.089  -5.698
  693   1HH1  ARG  91          2HH1      ARG  91  13.008   6.386  -3.454
  694   2HH1  ARG  91          1HH1      ARG  91  11.605   5.400  -3.680
  695   1HH2  ARG  91          1HH2      ARG  91  13.218   3.036  -5.629
  696   2HH2  ARG  91          2HH2      ARG  91  11.718   3.511  -4.918
  697    H    VAL  92           H        VAL  92  17.846   1.625  -0.645
  698    HA   VAL  92           HA       VAL  92  20.700   1.729  -1.543
  699    HB   VAL  92           HB       VAL  92  21.183   2.871   0.614
  700   1HG1  VAL  92          1HG1      VAL  92  20.972   4.618  -0.800
  701   2HG1  VAL  92          2HG1      VAL  92  19.383   4.859  -0.077
  702   3HG1  VAL  92          3HG1      VAL  92  19.542   3.932  -1.569
  703   1HG2  VAL  92          1HG2      VAL  92  19.036   3.854   1.727
  704   2HG2  VAL  92          2HG2      VAL  92  19.505   2.199   2.111
  705   3HG2  VAL  92          3HG2      VAL  92  18.211   2.503   0.953
  706    H    GLY  93           H        GLY  93  22.029   0.106  -0.905
  707   1HA   GLY  93          2HA       GLY  93  21.084  -2.272   0.314
  708   2HA   GLY  93          1HA       GLY  93  22.787  -1.838   0.172
  709    H    HIS  94           HN       HIS  94  23.062   0.341   1.760
  710    HA   HIS  94           HA       HIS  94  22.380  -0.735   4.455
  711   1HB   HIS  94          2HB       HIS  94  24.804   0.084   3.441
  712   2HB   HIS  94          1HB       HIS  94  24.267   1.521   4.309
  713    HD1  HIS  94           HD1      HIS  94  23.986   1.338   6.878
  714    HD2  HIS  94           HD2      HIS  94  25.309  -2.183   5.089
  715    HE1  HIS  94           HE1      HIS  94  24.767  -0.167   8.757
  Start of MODEL    9
    1   1H    MET   1          1H        MET   1 -16.954 -10.657  -7.517
    2   2H    MET   1          2H        MET   1 -15.551 -11.484  -7.040
    3   3H    MET   1          3H        MET   1 -16.775 -12.303  -7.885
    4    HA   MET   1           HA       MET   1 -14.644 -10.609  -8.872
    5   1HB   MET   1          2HB       MET   1 -15.263 -13.145  -9.299
    6   2HB   MET   1          1HB       MET   1 -16.354 -12.463 -10.505
    7   1HG   MET   1          2HG       MET   1 -14.397 -12.771 -11.747
    8   2HG   MET   1          1HG       MET   1 -14.242 -11.089 -11.240
    9   1HE   MET   1          1HE       MET   1 -11.115 -10.759  -9.769
   10   2HE   MET   1          2HE       MET   1 -12.530 -10.509  -8.750
   11   3HE   MET   1          3HE       MET   1 -12.623 -10.154 -10.471
   12    H    SER   2           H        SER   2 -15.095  -8.588  -9.574
   13    HA   SER   2           HA       SER   2 -17.625  -8.156 -11.115
   14   1HB   SER   2          2HB       SER   2 -16.949  -6.972  -8.660
   15   2HB   SER   2          1HB       SER   2 -16.619  -5.733  -9.866
   16    HG   SER   2           HG       SER   2 -18.712  -5.461  -9.728
   17    H    GLY   3           H        GLY   3 -14.429  -6.644 -10.449
   18   1HA   GLY   3          2HA       GLY   3 -14.361  -5.680 -13.265
   19   2HA   GLY   3          1HA       GLY   3 -13.297  -5.133 -11.968
   20    H    GLY   4           H        GLY   4 -14.086  -8.130 -13.780
   21   1HA   GLY   4          2HA       GLY   4 -11.341  -8.606 -14.505
   22   2HA   GLY   4          1HA       GLY   4 -11.786  -9.619 -13.131
   23    H    THR   5           H        THR   5 -13.764 -11.003 -13.431
   24    HA   THR   5           HA       THR   5 -13.894 -11.981 -16.252
   25    HB   THR   5           HB       THR   5 -14.734 -13.446 -13.727
   26    HG1  THR   5           HG1      THR   5 -12.336 -13.642 -15.235
   27   1HG2  THR   5          1HG2      THR   5 -15.591 -14.924 -15.188
   28   2HG2  THR   5          2HG2      THR   5 -13.965 -15.187 -15.819
   29   3HG2  THR   5          3HG2      THR   5 -15.011 -13.969 -16.552
   30    H    ALA   6           H        ALA   6 -16.123 -11.920 -13.422
   31    HA   ALA   6           HA       ALA   6 -18.415 -11.638 -15.261
   32   1HB   ALA   6          1HB       ALA   6 -19.468 -11.449 -12.735
   33   2HB   ALA   6          2HB       ALA   6 -18.012 -12.400 -12.436
   34   3HB   ALA   6          3HB       ALA   6 -19.213 -12.968 -13.596
   35    H    ALA   7           H        ALA   7 -18.820  -9.620 -16.002
   36    HA   ALA   7           HA       ALA   7 -18.067  -7.230 -14.481
   37   1HB   ALA   7          1HB       ALA   7 -19.656  -7.485 -17.056
   38   2HB   ALA   7          2HB       ALA   7 -17.904  -7.298 -16.959
   39   3HB   ALA   7          3HB       ALA   7 -18.961  -5.998 -16.409
   40    H    THR   8           H        THR   8 -21.132  -8.754 -15.531
   41    HA   THR   8           HA       THR   8 -22.738  -6.814 -14.036
   42    HB   THR   8           HB       THR   8 -24.627  -8.440 -14.660
   43    HG1  THR   8           HG1      THR   8 -23.991 -10.279 -15.399
   44   1HG2  THR   8          1HG2      THR   8 -22.921  -6.824 -16.471
   45   2HG2  THR   8          2HG2      THR   8 -24.648  -6.697 -16.137
   46   3HG2  THR   8          3HG2      THR   8 -24.054  -7.923 -17.255
   47    H    THR   9           H        THR   9 -22.178  -7.007 -11.855
   48    HA   THR   9           HA       THR   9 -23.251  -9.385 -10.472
   49    HB   THR   9           HB       THR   9 -20.930  -9.052  -9.040
   50    HG1  THR   9           HG1      THR   9 -19.468  -8.263 -10.288
   51   1HG2  THR   9          1HG2      THR   9 -21.077 -10.966 -11.361
   52   2HG2  THR   9          2HG2      THR   9 -22.153 -11.132  -9.974
   53   3HG2  THR   9          3HG2      THR   9 -20.406 -11.233  -9.752
   54    H    ALA  10           H        ALA  10 -24.292  -8.757  -8.646
   55    HA   ALA  10           HA       ALA  10 -24.116  -5.917  -7.844
   56   1HB   ALA  10          1HB       ALA  10 -25.953  -8.149  -6.917
   57   2HB   ALA  10          2HB       ALA  10 -26.343  -6.920  -8.120
   58   3HB   ALA  10          3HB       ALA  10 -26.090  -6.457  -6.437
   59    H    GLY  11           H        GLY  11 -22.478  -5.466  -6.447
   60   1HA   GLY  11          2HA       GLY  11 -21.304  -5.474  -4.404
   61   2HA   GLY  11          1HA       GLY  11 -22.388  -6.745  -3.835
   62    H    SER  12           H        SER  12 -19.664  -6.249  -6.111
   63    HA   SER  12           HA       SER  12 -18.577  -8.878  -5.223
   64   1HB   SER  12          2HB       SER  12 -19.585  -8.232  -7.869
   65   2HB   SER  12          1HB       SER  12 -17.877  -8.654  -7.936
   66    HG   SER  12           HG       SER  12 -19.434 -10.444  -8.039
   67    H    LYS  13           H        LYS  13 -16.329  -8.938  -5.097
   68    HA   LYS  13           HA       LYS  13 -14.905  -6.378  -5.734
   69   1HB   LYS  13          2HB       LYS  13 -14.588  -8.306  -3.423
   70   2HB   LYS  13          1HB       LYS  13 -13.350  -7.122  -3.836
   71   1HG   LYS  13          2HG       LYS  13 -14.486  -5.583  -2.654
   72   2HG   LYS  13          1HG       LYS  13 -15.800  -5.711  -3.821
   73   1HD   LYS  13          2HD       LYS  13 -16.475  -7.831  -2.431
   74   2HD   LYS  13          1HD       LYS  13 -15.488  -7.096  -1.167
   75   1HE   LYS  13          2HE       LYS  13 -16.992  -4.960  -2.074
   76   2HE   LYS  13          1HE       LYS  13 -18.132  -6.301  -2.171
   77   1HZ   LYS  13          1HZ       LYS  13 -17.609  -6.851   0.129
   78   2HZ   LYS  13          2HZ       LYS  13 -18.201  -5.265  -0.004
   79   3HZ   LYS  13          3HZ       LYS  13 -16.538  -5.537   0.216
   80    H    VAL  14           H        VAL  14 -12.444  -6.786  -5.931
   81    HA   VAL  14           HA       VAL  14 -12.035  -9.181  -7.666
   82    HB   VAL  14           HB       VAL  14  -9.987  -7.893  -8.462
   83   1HG1  VAL  14          1HG1      VAL  14 -12.310  -6.123  -8.995
   84   2HG1  VAL  14          2HG1      VAL  14 -12.555  -7.839  -9.326
   85   3HG1  VAL  14          3HG1      VAL  14 -11.250  -6.963 -10.125
   86   1HG2  VAL  14          1HG2      VAL  14 -11.298  -5.436  -7.337
   87   2HG2  VAL  14          2HG2      VAL  14  -9.620  -5.684  -7.821
   88   3HG2  VAL  14          3HG2      VAL  14 -10.209  -6.364  -6.306
   89    H    THR  15           H        THR  15 -10.655 -10.765  -7.006
   90    HA   THR  15           HA       THR  15  -9.233 -10.373  -4.422
   91    HB   THR  15           HB       THR  15  -8.967 -12.878  -4.523
   92    HG1  THR  15           HG1      THR  15  -9.495 -13.863  -6.286
   93   1HG2  THR  15          1HG2      THR  15 -11.529 -11.396  -4.387
   94   2HG2  THR  15          2HG2      THR  15 -10.776 -12.459  -3.199
   95   3HG2  THR  15          3HG2      THR  15 -11.665 -13.146  -4.558
   96    H    PHE  16           H        PHE  16  -6.987 -10.813  -4.215
   97    HA   PHE  16           HA       PHE  16  -5.500 -11.175  -6.784
   98   1HB   PHE  16          2HB       PHE  16  -4.807  -9.234  -4.559
   99   2HB   PHE  16          1HB       PHE  16  -3.811  -9.546  -5.978
  100    HD1  PHE  16           HD1      PHE  16  -4.972  -9.236  -8.308
  101    HD2  PHE  16           HD2      PHE  16  -6.450  -7.553  -4.638
  102    HE1  PHE  16           HE1      PHE  16  -6.289  -7.575  -9.596
  103    HE2  PHE  16           HE2      PHE  16  -7.764  -5.895  -5.931
  104    HZ   PHE  16           HZ       PHE  16  -7.682  -5.907  -8.406
  105    H    LYS  17           H        LYS  17  -3.745 -12.524  -6.662
  106    HA   LYS  17           HA       LYS  17  -3.174 -13.774  -4.003
  107   1HB   LYS  17          2HB       LYS  17  -4.122 -15.098  -6.137
  108   2HB   LYS  17          1HB       LYS  17  -2.411 -15.130  -6.563
  109   1HG   LYS  17          2HG       LYS  17  -2.092 -15.914  -4.073
  110   2HG   LYS  17          1HG       LYS  17  -3.793 -16.351  -4.194
  111   1HD   LYS  17          2HD       LYS  17  -3.101 -18.283  -5.144
  112   2HD   LYS  17          1HD       LYS  17  -2.689 -17.323  -6.563
  113   1HE   LYS  17          2HE       LYS  17  -0.439 -16.866  -5.459
  114   2HE   LYS  17          1HE       LYS  17  -0.861 -18.109  -4.276
  115   1HZ   LYS  17          1HZ       LYS  17  -1.393 -19.346  -6.599
  116   2HZ   LYS  17          2HZ       LYS  17   0.067 -19.485  -5.752
  117   3HZ   LYS  17          3HZ       LYS  17  -0.067 -18.388  -7.042
  118    H    ILE  18           H        ILE  18  -1.368 -12.694  -3.259
  119    HA   ILE  18           HA       ILE  18   0.883 -12.266  -5.181
  120    HB   ILE  18           HB       ILE  18   0.434 -10.905  -2.504
  121   1HG1  ILE  18          2HG1      ILE  18   0.155  -9.009  -4.519
  122   2HG1  ILE  18          1HG1      ILE  18  -0.697 -10.409  -5.170
  123   1HG2  ILE  18          1HG2      ILE  18   2.036  -9.292  -4.046
  124   2HG2  ILE  18          2HG2      ILE  18   2.576 -10.899  -4.534
  125   3HG2  ILE  18          3HG2      ILE  18   2.632 -10.426  -2.836
  126   1HD1  ILE  18          1HD1      ILE  18  -1.519 -10.352  -2.520
  127   2HD1  ILE  18          2HD1      ILE  18  -2.445  -9.749  -3.895
  128   3HD1  ILE  18          3HD1      ILE  18  -1.442  -8.644  -2.955
  129    H    THR  19           H        THR  19   2.694 -13.462  -4.897
  130    HA   THR  19           HA       THR  19   3.094 -14.832  -2.260
  131    HB   THR  19           HB       THR  19   4.143 -15.841  -4.909
  132    HG1  THR  19           HG1      THR  19   2.200 -16.431  -5.364
  133   1HG2  THR  19          1HG2      THR  19   5.140 -16.675  -2.777
  134   2HG2  THR  19          2HG2      THR  19   4.350 -17.941  -3.717
  135   3HG2  THR  19          3HG2      THR  19   3.544 -17.257  -2.305
  136    H    LEU  20           H        LEU  20   5.065 -14.476  -1.280
  137    HA   LEU  20           HA       LEU  20   6.829 -12.449  -2.387
  138   1HB   LEU  20          2HB       LEU  20   6.320 -13.052   0.123
  139   2HB   LEU  20          1HB       LEU  20   7.615 -14.230  -0.094
  140    HG   LEU  20           HG       LEU  20   8.978 -12.249  -1.067
  141   1HD1  LEU  20          1HD1      LEU  20   8.212 -10.097  -0.782
  142   2HD1  LEU  20          2HD1      LEU  20   7.304 -10.503   0.673
  143   3HD1  LEU  20          3HD1      LEU  20   6.647 -10.898  -0.910
  144   1HD2  LEU  20          1HD2      LEU  20   9.957 -11.991   1.006
  145   2HD2  LEU  20          2HD2      LEU  20   8.939 -13.385   1.362
  146   3HD2  LEU  20          3HD2      LEU  20   8.411 -11.769   1.826
  147    H    THR  21           H        THR  21   8.244 -12.892  -3.988
  148    HA   THR  21           HA       THR  21   9.180 -15.631  -4.479
  149    HB   THR  21           HB       THR  21   8.623 -14.077  -6.348
  150    HG1  THR  21           HG1      THR  21   9.982 -15.279  -7.357
  151   1HG2  THR  21          1HG2      THR  21  11.088 -12.591  -6.375
  152   2HG2  THR  21          2HG2      THR  21  10.235 -12.280  -4.865
  153   3HG2  THR  21          3HG2      THR  21   9.435 -11.983  -6.407
  154    H    SER  22           H        SER  22  10.384 -12.768  -2.875
  155    HA   SER  22           HA       SER  22  13.190 -13.454  -2.958
  156   1HB   SER  22          2HB       SER  22  11.894 -11.212  -2.275
  157   2HB   SER  22          1HB       SER  22  12.072 -11.900  -0.663
  158    HG   SER  22           HG       SER  22  13.980 -10.938  -2.439
  159    H    ASP  23           H        ASP  23  10.658 -13.882  -0.451
  160    HA   ASP  23           HA       ASP  23  12.474 -15.776   0.964
  161   1HB   ASP  23          2HB       ASP  23  11.324 -13.788   2.157
  162   2HB   ASP  23          1HB       ASP  23   9.846 -14.738   2.025
  163    HA   PRO  24           HA       PRO  24   9.865 -18.942  -0.810
  164   1HB   PRO  24          2HB       PRO  24  11.405 -21.029   0.110
  165   2HB   PRO  24          1HB       PRO  24  11.788 -20.086  -1.340
  166   1HG   PRO  24          2HG       PRO  24  13.070 -19.998   1.350
  167   2HG   PRO  24          1HG       PRO  24  13.754 -19.594  -0.233
  168   1HD   PRO  24          2HD       PRO  24  12.853 -17.738   1.703
  169   2HD   PRO  24          1HD       PRO  24  13.220 -17.378   0.002
  170    H    LYS  25           H        LYS  25  10.929 -18.783   2.574
  171    HA   LYS  25           HA       LYS  25   9.220 -20.819   3.641
  172   1HB   LYS  25          2HB       LYS  25  10.747 -18.503   4.725
  173   2HB   LYS  25          1HB       LYS  25   9.421 -19.095   5.723
  174   1HG   LYS  25          2HG       LYS  25  10.580 -20.941   6.315
  175   2HG   LYS  25          1HG       LYS  25  11.007 -21.290   4.639
  176   1HD   LYS  25          2HD       LYS  25  12.558 -19.067   5.206
  177   2HD   LYS  25          1HD       LYS  25  12.587 -19.957   6.728
  178   1HE   LYS  25          2HE       LYS  25  14.150 -21.307   5.823
  179   2HE   LYS  25          1HE       LYS  25  12.910 -21.909   4.724
  180   1HZ   LYS  25          1HZ       LYS  25  14.749 -21.094   3.456
  181   2HZ   LYS  25          2HZ       LYS  25  14.721 -19.601   4.267
  182   3HZ   LYS  25          3HZ       LYS  25  13.442 -20.036   3.235
  183    H    LEU  26           H        LEU  26   8.717 -17.298   3.200
  184    HA   LEU  26           HA       LEU  26   6.058 -17.259   4.317
  185   1HB   LEU  26          2HB       LEU  26   7.707 -15.400   2.643
  186   2HB   LEU  26          1HB       LEU  26   5.972 -15.109   2.754
  187    HG   LEU  26           HG       LEU  26   7.329 -15.692   5.323
  188   1HD1  LEU  26          1HD1      LEU  26   8.206 -13.533   3.516
  189   2HD1  LEU  26          2HD1      LEU  26   9.011 -14.219   4.928
  190   3HD1  LEU  26          3HD1      LEU  26   7.764 -12.989   5.135
  191   1HD2  LEU  26          1HD2      LEU  26   5.648 -14.341   6.170
  192   2HD2  LEU  26          2HD2      LEU  26   4.866 -14.894   4.688
  193   3HD2  LEU  26          3HD2      LEU  26   5.623 -13.302   4.745
  194    HA   PRO  27           HA       PRO  27   4.133 -19.226   0.789
  195   1HB   PRO  27          2HB       PRO  27   1.644 -19.379   1.942
  196   2HB   PRO  27          1HB       PRO  27   2.961 -20.509   2.300
  197   1HG   PRO  27          2HG       PRO  27   1.884 -18.290   3.974
  198   2HG   PRO  27          1HG       PRO  27   2.710 -19.775   4.475
  199   1HD   PRO  27          2HD       PRO  27   3.872 -17.194   4.321
  200   2HD   PRO  27          1HD       PRO  27   4.745 -18.728   4.521
  201    H    PHE  28           H        PHE  28   1.987 -18.759  -0.450
  202    HA   PHE  28           HA       PHE  28   1.925 -15.954  -1.184
  203   1HB   PHE  28          2HB       PHE  28   0.258 -16.603  -2.818
  204   2HB   PHE  28          1HB       PHE  28   1.493 -17.858  -2.777
  205    HD1  PHE  28           HD1      PHE  28  -1.960 -16.978  -1.787
  206    HD2  PHE  28           HD2      PHE  28   1.013 -20.077  -1.929
  207    HE1  PHE  28           HE1      PHE  28  -3.694 -18.668  -1.256
  208    HE2  PHE  28           HE2      PHE  28  -0.722 -21.765  -1.396
  209    HZ   PHE  28           HZ       PHE  28  -3.075 -21.061  -1.060
  210    H    LYS  29           H        LYS  29  -0.094 -14.627  -1.149
  211    HA   LYS  29           HA       LYS  29  -1.978 -15.343   1.049
  212   1HB   LYS  29          2HB       LYS  29  -0.162 -12.969   0.902
  213   2HB   LYS  29          1HB       LYS  29  -1.784 -12.726   1.554
  214   1HG   LYS  29          2HG       LYS  29  -1.352 -14.711   3.077
  215   2HG   LYS  29          1HG       LYS  29   0.328 -14.654   2.545
  216   1HD   LYS  29          2HD       LYS  29  -0.923 -12.116   3.520
  217   2HD   LYS  29          1HD       LYS  29  -0.469 -13.329   4.717
  218   1HE   LYS  29          2HE       LYS  29   1.563 -12.283   4.596
  219   2HE   LYS  29          1HE       LYS  29   1.773 -13.321   3.186
  220   1HZ   LYS  29          1HZ       LYS  29   1.309 -11.612   1.746
  221   2HZ   LYS  29          2HZ       LYS  29   2.140 -10.787   2.977
  222   3HZ   LYS  29          3HZ       LYS  29   0.447 -10.712   2.893
  223    H    VAL  30           H        VAL  30  -4.081 -14.583   0.722
  224    HA   VAL  30           HA       VAL  30  -4.606 -13.443  -1.980
  225    HB   VAL  30           HB       VAL  30  -6.547 -14.711  -0.023
  226   1HG1  VAL  30          1HG1      VAL  30  -7.777 -14.993  -2.332
  227   2HG1  VAL  30          2HG1      VAL  30  -6.746 -13.652  -2.830
  228   3HG1  VAL  30          3HG1      VAL  30  -7.866 -13.451  -1.482
  229   1HG2  VAL  30          1HG2      VAL  30  -4.797 -16.295  -0.812
  230   2HG2  VAL  30          2HG2      VAL  30  -5.207 -15.893  -2.480
  231   3HG2  VAL  30          3HG2      VAL  30  -6.389 -16.702  -1.451
  232    H    LEU  31           H        LEU  31  -5.301 -11.384  -2.187
  233    HA   LEU  31           HA       LEU  31  -6.190  -9.926   0.269
  234   1HB   LEU  31          2HB       LEU  31  -4.162  -9.316  -1.592
  235   2HB   LEU  31          1HB       LEU  31  -5.482  -8.210  -1.964
  236    HG   LEU  31           HG       LEU  31  -5.258  -8.335   0.875
  237   1HD1  LEU  31          1HD1      LEU  31  -3.039  -8.965   0.991
  238   2HD1  LEU  31          2HD1      LEU  31  -2.831  -7.228   0.768
  239   3HD1  LEU  31          3HD1      LEU  31  -2.661  -8.320  -0.606
  240   1HD2  LEU  31          1HD2      LEU  31  -4.886  -6.329  -1.319
  241   2HD2  LEU  31          2HD2      LEU  31  -4.355  -5.895   0.306
  242   3HD2  LEU  31          3HD2      LEU  31  -6.041  -6.328   0.014
  243    H    SER  32           H        SER  32  -8.387  -9.729   0.260
  244    HA   SER  32           HA       SER  32  -9.815  -9.566  -2.346
  245   1HB   SER  32          2HB       SER  32 -10.722 -10.164   0.475
  246   2HB   SER  32          1HB       SER  32 -11.864  -9.835  -0.824
  247    HG   SER  32           HG       SER  32 -11.324 -12.095  -0.509
  248    H    VAL  33           H        VAL  33 -10.032  -7.506  -3.065
  249    HA   VAL  33           HA       VAL  33 -11.123  -5.470  -1.188
  250    HB   VAL  33           HB       VAL  33  -9.586  -3.747  -2.174
  251   1HG1  VAL  33          1HG1      VAL  33  -7.724  -4.287  -0.769
  252   2HG1  VAL  33          2HG1      VAL  33  -8.049  -6.017  -0.894
  253   3HG1  VAL  33          3HG1      VAL  33  -9.152  -4.975   0.006
  254   1HG2  VAL  33          1HG2      VAL  33  -8.749  -4.526  -4.186
  255   2HG2  VAL  33          2HG2      VAL  33  -8.600  -6.185  -3.605
  256   3HG2  VAL  33          3HG2      VAL  33  -7.413  -4.972  -3.125
  257    HA   PRO  34           HA       PRO  34 -13.730  -4.518  -4.595
  258   1HB   PRO  34          2HB       PRO  34 -14.295  -1.885  -4.026
  259   2HB   PRO  34          1HB       PRO  34 -14.996  -3.255  -3.146
  260   1HG   PRO  34          2HG       PRO  34 -12.839  -1.376  -2.290
  261   2HG   PRO  34          1HG       PRO  34 -14.002  -2.275  -1.301
  262   1HD   PRO  34          2HD       PRO  34 -11.301  -2.977  -1.684
  263   2HD   PRO  34          1HD       PRO  34 -12.567  -4.048  -1.046
  264    H    GLU  35           H        GLU  35 -13.894  -3.124  -6.539
  265    HA   GLU  35           HA       GLU  35 -11.391  -2.624  -7.805
  266   1HB   GLU  35          2HB       GLU  35 -14.198  -1.696  -8.452
  267   2HB   GLU  35          1HB       GLU  35 -12.817  -1.339  -9.488
  268   1HG   GLU  35          2HG       GLU  35 -13.323  -3.331 -10.470
  269   2HG   GLU  35          1HG       GLU  35 -12.486  -4.026  -9.082
  270    H    SER  36           H        SER  36 -13.501  -0.518  -5.911
  271    HA   SER  36           HA       SER  36 -12.401   2.007  -6.628
  272   1HB   SER  36          2HB       SER  36 -14.123   0.956  -4.546
  273   2HB   SER  36          1HB       SER  36 -12.998   2.134  -3.876
  274    HG   SER  36           HG       SER  36 -14.667   3.321  -4.646
  275    H    THR  37           H        THR  37 -11.326  -0.411  -4.241
  276    HA   THR  37           HA       THR  37  -9.249   1.181  -3.059
  277    HB   THR  37           HB       THR  37  -9.445  -1.837  -3.357
  278    HG1  THR  37           HG1      THR  37 -10.163  -0.091  -1.238
  279   1HG2  THR  37          1HG2      THR  37  -8.026  -1.516  -1.122
  280   2HG2  THR  37          2HG2      THR  37  -7.542  -0.027  -1.933
  281   3HG2  THR  37          3HG2      THR  37  -7.247  -1.586  -2.703
  282    HA   PRO  38           HA       PRO  38  -6.547   1.127  -6.606
  283   1HB   PRO  38          2HB       PRO  38  -4.619   2.715  -5.461
  284   2HB   PRO  38          1HB       PRO  38  -6.122   3.344  -6.157
  285   1HG   PRO  38          2HG       PRO  38  -5.367   3.036  -3.289
  286   2HG   PRO  38          1HG       PRO  38  -6.498   4.177  -4.036
  287   1HD   PRO  38          2HD       PRO  38  -7.201   1.821  -2.636
  288   2HD   PRO  38          1HD       PRO  38  -8.281   2.788  -3.663
  289    H    PHE  39           H        PHE  39  -4.255   0.461  -7.029
  290    HA   PHE  39           HA       PHE  39  -3.533  -1.915  -5.591
  291   1HB   PHE  39          2HB       PHE  39  -2.923  -1.090  -8.039
  292   2HB   PHE  39          1HB       PHE  39  -1.493  -0.454  -7.226
  293    HD1  PHE  39           HD1      PHE  39  -3.583  -3.582  -7.131
  294    HD2  PHE  39           HD2      PHE  39   0.356  -1.869  -7.173
  295    HE1  PHE  39           HE1      PHE  39  -2.594  -5.855  -7.092
  296    HE2  PHE  39           HE2      PHE  39   1.344  -4.141  -7.136
  297    HZ   PHE  39           HZ       PHE  39  -0.131  -6.134  -7.094
  298    H    THR  40           H        THR  40  -2.846   1.436  -5.001
  299    HA   THR  40           HA       THR  40  -0.361   1.244  -3.617
  300    HB   THR  40           HB       THR  40  -1.617   3.185  -2.194
  301    HG1  THR  40           HG1      THR  40  -3.311   3.959  -3.205
  302   1HG2  THR  40          1HG2      THR  40  -0.347   4.609  -3.439
  303   2HG2  THR  40          2HG2      THR  40  -0.952   3.979  -4.972
  304   3HG2  THR  40          3HG2      THR  40   0.302   3.105  -4.091
  305    H    ALA  41           H        ALA  41  -3.717   0.952  -2.429
  306    HA   ALA  41           HA       ALA  41  -2.917   0.268   0.278
  307   1HB   ALA  41          1HB       ALA  41  -5.387  -0.495   0.391
  308   2HB   ALA  41          2HB       ALA  41  -5.522   0.151  -1.243
  309   3HB   ALA  41          3HB       ALA  41  -5.077   1.214   0.091
  310    H    VAL  42           H        VAL  42  -3.869  -1.594  -2.616
  311    HA   VAL  42           HA       VAL  42  -4.023  -4.169  -1.385
  312    HB   VAL  42           HB       VAL  42  -3.129  -3.465  -4.204
  313   1HG1  VAL  42          1HG1      VAL  42  -3.147  -5.953  -2.835
  314   2HG1  VAL  42          2HG1      VAL  42  -2.892  -5.674  -4.556
  315   3HG1  VAL  42          3HG1      VAL  42  -4.517  -5.976  -3.944
  316   1HG2  VAL  42          1HG2      VAL  42  -5.656  -4.359  -4.471
  317   2HG2  VAL  42          2HG2      VAL  42  -5.286  -2.657  -4.202
  318   3HG2  VAL  42          3HG2      VAL  42  -5.780  -3.676  -2.850
  319    H    LEU  43           H        LEU  43  -1.271  -2.611  -3.071
  320    HA   LEU  43           HA       LEU  43   0.642  -4.659  -2.464
  321   1HB   LEU  43          2HB       LEU  43   0.830  -2.775  -4.200
  322   2HB   LEU  43          1HB       LEU  43   1.293  -1.731  -2.857
  323    HG   LEU  43           HG       LEU  43   2.737  -4.298  -2.918
  324   1HD1  LEU  43          1HD1      LEU  43   2.545  -2.629  -5.332
  325   2HD1  LEU  43          2HD1      LEU  43   3.165  -4.269  -5.144
  326   3HD1  LEU  43          3HD1      LEU  43   4.202  -2.890  -4.787
  327   1HD2  LEU  43          1HD2      LEU  43   3.541  -1.373  -2.763
  328   2HD2  LEU  43          2HD2      LEU  43   4.655  -2.727  -2.564
  329   3HD2  LEU  43          3HD2      LEU  43   3.349  -2.481  -1.404
  330    H    LYS  44           H        LYS  44  -0.412  -1.755  -0.715
  331    HA   LYS  44           HA       LYS  44   1.647  -1.745   1.285
  332   1HB   LYS  44          2HB       LYS  44  -0.390  -0.055   0.691
  333   2HB   LYS  44          1HB       LYS  44  -1.088  -0.879   2.083
  334   1HG   LYS  44          2HG       LYS  44   1.521  -0.371   2.892
  335   2HG   LYS  44          1HG       LYS  44   1.098   1.072   1.971
  336   1HD   LYS  44          2HD       LYS  44   0.260   1.689   4.030
  337   2HD   LYS  44          1HD       LYS  44  -1.161   0.864   3.384
  338   1HE   LYS  44          2HE       LYS  44  -0.671  -1.136   4.598
  339   2HE   LYS  44          1HE       LYS  44   0.951  -0.574   5.006
  340   1HZ   LYS  44          1HZ       LYS  44  -0.305  -0.203   6.916
  341   2HZ   LYS  44          2HZ       LYS  44  -1.643   0.384   6.048
  342   3HZ   LYS  44          3HZ       LYS  44  -0.234   1.325   6.177
  343    H    PHE  45           H        PHE  45  -1.619  -3.194   1.244
  344    HA   PHE  45           HA       PHE  45  -1.426  -4.366   3.863
  345   1HB   PHE  45          2HB       PHE  45  -3.478  -3.984   2.175
  346   2HB   PHE  45          1HB       PHE  45  -3.123  -5.667   1.782
  347    HD1  PHE  45           HD1      PHE  45  -4.338  -7.237   2.984
  348    HD2  PHE  45           HD2      PHE  45  -3.257  -3.537   4.882
  349    HE1  PHE  45           HE1      PHE  45  -5.478  -7.967   5.061
  350    HE2  PHE  45           HE2      PHE  45  -4.397  -4.268   6.957
  351    HZ   PHE  45           HZ       PHE  45  -5.508  -6.484   7.047
  352    H    ALA  46           H        ALA  46  -0.772  -5.666   0.593
  353    HA   ALA  46           HA       ALA  46  -0.212  -8.349   1.404
  354   1HB   ALA  46          1HB       ALA  46   0.971  -6.795  -0.920
  355   2HB   ALA  46          2HB       ALA  46  -0.551  -7.684  -0.957
  356   3HB   ALA  46          3HB       ALA  46   0.970  -8.550  -0.746
  357    H    ALA  47           H        ALA  47   1.977  -5.549   0.955
  358    HA   ALA  47           HA       ALA  47   4.370  -6.945   1.732
  359   1HB   ALA  47          1HB       ALA  47   4.242  -4.726   0.494
  360   2HB   ALA  47          2HB       ALA  47   5.406  -4.780   1.817
  361   3HB   ALA  47          3HB       ALA  47   3.852  -3.976   2.042
  362    H    GLU  48           H        GLU  48   1.917  -5.145   3.557
  363    HA   GLU  48           HA       GLU  48   3.269  -4.943   6.051
  364   1HB   GLU  48          2HB       GLU  48   1.089  -3.836   5.460
  365   2HB   GLU  48          1HB       GLU  48   0.300  -5.402   5.639
  366   1HG   GLU  48          2HG       GLU  48   1.880  -5.042   7.963
  367   2HG   GLU  48          1HG       GLU  48   1.044  -3.513   7.690
  368    H    GLU  49           H        GLU  49   1.132  -7.539   4.813
  369    HA   GLU  49           HA       GLU  49   1.522  -9.204   7.168
  370   1HB   GLU  49          2HB       GLU  49   0.239  -9.576   4.476
  371   2HB   GLU  49          1HB       GLU  49   0.545 -10.981   5.496
  372   1HG   GLU  49          2HG       GLU  49  -1.455 -10.479   6.446
  373   2HG   GLU  49          1HG       GLU  49  -0.559  -9.220   7.295
  374    H    PHE  50           H        PHE  50   3.169  -8.813   4.079
  375    HA   PHE  50           HA       PHE  50   4.675 -11.312   4.290
  376   1HB   PHE  50          2HB       PHE  50   4.583  -8.994   2.421
  377   2HB   PHE  50          1HB       PHE  50   6.104  -9.878   2.504
  378    HD1  PHE  50           HD1      PHE  50   3.455  -9.651   0.486
  379    HD2  PHE  50           HD2      PHE  50   5.329 -12.644   2.933
  380    HE1  PHE  50           HE1      PHE  50   2.500 -11.428  -0.955
  381    HE2  PHE  50           HE2      PHE  50   4.370 -14.420   1.493
  382    HZ   PHE  50           HZ       PHE  50   2.956 -13.812  -0.451
  383    H    LYS  51           H        LYS  51   4.852  -8.501   6.064
  384    HA   LYS  51           HA       LYS  51   6.458  -7.608   7.493
  385   1HB   LYS  51          2HB       LYS  51   7.726 -10.284   6.861
  386   2HB   LYS  51          1HB       LYS  51   8.489  -9.123   7.948
  387   1HG   LYS  51          2HG       LYS  51   6.404  -9.081   9.315
  388   2HG   LYS  51          1HG       LYS  51   5.718 -10.317   8.263
  389   1HD   LYS  51          2HD       LYS  51   7.997 -11.577   8.858
  390   2HD   LYS  51          1HD       LYS  51   7.900 -10.554  10.293
  391   1HE   LYS  51          2HE       LYS  51   6.629 -12.304  11.066
  392   2HE   LYS  51          1HE       LYS  51   5.352 -11.425  10.227
  393   1HZ   LYS  51          1HZ       LYS  51   5.535 -12.826   8.365
  394   2HZ   LYS  51          2HZ       LYS  51   5.539 -13.861   9.713
  395   3HZ   LYS  51          3HZ       LYS  51   6.993 -13.508   8.905
  396    H    VAL  52           H        VAL  52   6.442  -6.809   4.757
  397    HA   VAL  52           HA       VAL  52   9.296  -5.993   4.448
  398    HB   VAL  52           HB       VAL  52   8.953  -6.104   1.943
  399   1HG1  VAL  52          1HG1      VAL  52   9.371  -8.505   1.813
  400   2HG1  VAL  52          2HG1      VAL  52   8.674  -8.740   3.416
  401   3HG1  VAL  52          3HG1      VAL  52  10.182  -7.844   3.232
  402   1HG2  VAL  52          1HG2      VAL  52   6.950  -6.679   1.076
  403   2HG2  VAL  52          2HG2      VAL  52   6.287  -6.622   2.707
  404   3HG2  VAL  52          3HG2      VAL  52   6.893  -8.143   2.056
  405    HA   PRO  53           HA       PRO  53   7.580  -1.972   4.107
  406   1HB   PRO  53          2HB       PRO  53   9.547  -0.749   2.626
  407   2HB   PRO  53          1HB       PRO  53   9.698  -1.142   4.344
  408   1HG   PRO  53          2HG       PRO  53  10.933  -2.502   1.992
  409   2HG   PRO  53          1HG       PRO  53  11.512  -2.410   3.663
  410   1HD   PRO  53          2HD       PRO  53  10.225  -4.631   2.489
  411   2HD   PRO  53          1HD       PRO  53  10.478  -4.377   4.228
  412    H    ALA  54           H        ALA  54   5.891  -1.425   2.850
  413    HA   ALA  54           HA       ALA  54   5.610  -2.298   0.096
  414   1HB   ALA  54          1HB       ALA  54   3.432  -1.717   0.369
  415   2HB   ALA  54          2HB       ALA  54   3.844  -0.113   0.976
  416   3HB   ALA  54          3HB       ALA  54   3.857  -1.499   2.067
  417    H    ALA  55           H        ALA  55   6.547   0.726   1.674
  418    HA   ALA  55           HA       ALA  55   6.392   2.477  -0.563
  419   1HB   ALA  55          1HB       ALA  55   8.668   2.820   1.326
  420   2HB   ALA  55          2HB       ALA  55   7.049   2.821   2.029
  421   3HB   ALA  55          3HB       ALA  55   7.470   3.995   0.781
  422    H    THR  56           H        THR  56   8.908   0.169   0.411
  423    HA   THR  56           HA       THR  56  10.398   0.857  -2.092
  424    HB   THR  56           HB       THR  56  12.354  -0.277  -0.917
  425    HG1  THR  56           HG1      THR  56  12.058  -1.029   1.015
  426   1HG2  THR  56          1HG2      THR  56  11.450   2.026   0.764
  427   2HG2  THR  56          2HG2      THR  56  11.664   2.284  -0.968
  428   3HG2  THR  56          3HG2      THR  56  13.020   1.731   0.017
  429    H    SER  57           H        SER  57   8.167  -0.777  -2.332
  430    HA   SER  57           HA       SER  57   9.424  -3.319  -3.179
  431   1HB   SER  57          2HB       SER  57   7.251  -3.081  -1.121
  432   2HB   SER  57          1HB       SER  57   7.282  -4.477  -2.193
  433    HG   SER  57           HG       SER  57   8.499  -4.600  -0.130
  434    H    ALA  58           H        ALA  58   8.187  -4.431  -4.790
  435    HA   ALA  58           HA       ALA  58   5.833  -2.969  -5.895
  436   1HB   ALA  58          1HB       ALA  58   8.437  -3.064  -7.073
  437   2HB   ALA  58          2HB       ALA  58   6.967  -2.355  -7.741
  438   3HB   ALA  58          3HB       ALA  58   7.358  -4.045  -8.064
  439    H    ILE  59           H        ILE  59   4.715  -4.417  -7.607
  440    HA   ILE  59           HA       ILE  59   5.028  -7.299  -6.853
  441    HB   ILE  59           HB       ILE  59   2.539  -5.603  -7.006
  442   1HG1  ILE  59          2HG1      ILE  59   3.317  -7.810  -5.085
  443   2HG1  ILE  59          1HG1      ILE  59   3.808  -6.133  -4.852
  444   1HG2  ILE  59          1HG2      ILE  59   1.208  -7.296  -7.715
  445   2HG2  ILE  59          2HG2      ILE  59   2.073  -8.492  -6.753
  446   3HG2  ILE  59          3HG2      ILE  59   2.683  -8.029  -8.340
  447   1HD1  ILE  59          1HD1      ILE  59   1.338  -5.518  -5.048
  448   2HD1  ILE  59          2HD1      ILE  59   1.793  -6.407  -3.593
  449   3HD1  ILE  59          3HD1      ILE  59   0.995  -7.243  -4.926
  450    H    ILE  60           H        ILE  60   5.466  -8.522  -8.609
  451    HA   ILE  60           HA       ILE  60   4.879  -7.409 -11.305
  452    HB   ILE  60           HB       ILE  60   6.433  -9.137 -12.140
  453   1HG1  ILE  60          2HG1      ILE  60   7.519  -9.941  -9.566
  454   2HG1  ILE  60          1HG1      ILE  60   5.826 -10.412  -9.702
  455   1HG2  ILE  60          1HG2      ILE  60   7.182  -7.144 -10.071
  456   2HG2  ILE  60          2HG2      ILE  60   7.740  -7.306 -11.735
  457   3HG2  ILE  60          3HG2      ILE  60   8.416  -8.337 -10.475
  458   1HD1  ILE  60          1HD1      ILE  60   7.625 -12.048 -10.616
  459   2HD1  ILE  60          2HD1      ILE  60   7.750 -10.921 -11.965
  460   3HD1  ILE  60          3HD1      ILE  60   6.216 -11.719 -11.622
  461    H    THR  61           H        THR  61   4.302  -9.261 -12.962
  462    HA   THR  61           HA       THR  61   2.067 -10.834 -11.753
  463    HB   THR  61           HB       THR  61   2.445 -10.018 -14.654
  464    HG1  THR  61           HG1      THR  61   1.514  -8.220 -14.127
  465   1HG2  THR  61          1HG2      THR  61   0.443 -11.620 -13.155
  466   2HG2  THR  61          2HG2      THR  61   0.914 -11.708 -14.852
  467   3HG2  THR  61          3HG2      THR  61  -0.206 -10.458 -14.313
  468    H    ASN  62           H        ASN  62   1.699 -13.007 -12.622
  469    HA   ASN  62           HA       ASN  62   3.994 -14.655 -12.650
  470   1HB   ASN  62          2HB       ASN  62   1.118 -14.989 -13.152
  471   2HB   ASN  62          1HB       ASN  62   2.123 -16.146 -14.024
  472   1HD2  ASN  62          1HD2      ASN  62   1.849 -14.733 -10.705
  473   2HD2  ASN  62          2HD2      ASN  62   2.254 -16.175  -9.906
  474    H    ASP  63           H        ASP  63   2.474 -12.942 -15.324
  475    HA   ASP  63           HA       ASP  63   3.822 -14.513 -17.393
  476   1HB   ASP  63          2HB       ASP  63   2.376 -11.847 -17.496
  477   2HB   ASP  63          1HB       ASP  63   3.006 -12.688 -18.913
  478    H    GLY  64           H        GLY  64   4.284 -11.281 -15.928
  479   1HA   GLY  64          2HA       GLY  64   6.858 -10.949 -15.541
  480   2HA   GLY  64          1HA       GLY  64   6.926 -11.087 -17.298
  481    H    VAL  65           H        VAL  65   4.795  -9.352 -14.992
  482    HA   VAL  65           HA       VAL  65   5.421  -6.826 -16.462
  483    HB   VAL  65           HB       VAL  65   2.671  -7.644 -15.472
  484   1HG1  VAL  65          1HG1      VAL  65   2.905  -5.256 -15.407
  485   2HG1  VAL  65          2HG1      VAL  65   2.014  -5.633 -16.881
  486   3HG1  VAL  65          3HG1      VAL  65   3.730  -5.235 -16.966
  487   1HG2  VAL  65          1HG2      VAL  65   3.110  -8.988 -17.392
  488   2HG2  VAL  65          2HG2      VAL  65   3.939  -7.669 -18.218
  489   3HG2  VAL  65          3HG2      VAL  65   2.189  -7.611 -17.996
  490    H    GLY  66           H        GLY  66   6.321  -5.445 -15.027
  491   1HA   GLY  66          2HA       GLY  66   6.183  -5.847 -12.165
  492   2HA   GLY  66          1HA       GLY  66   6.950  -4.484 -12.979
  493    H    VAL  67           H        VAL  67   3.919  -5.721 -11.715
  494    HA   VAL  67           HA       VAL  67   2.297  -3.431 -12.394
  495    HB   VAL  67           HB       VAL  67   1.863  -5.317 -10.059
  496   1HG1  VAL  67          1HG1      VAL  67  -0.519  -4.795 -10.516
  497   2HG1  VAL  67          2HG1      VAL  67  -0.017  -3.686 -11.793
  498   3HG1  VAL  67          3HG1      VAL  67   0.403  -3.347 -10.113
  499   1HG2  VAL  67          1HG2      VAL  67   2.061  -6.839 -11.821
  500   2HG2  VAL  67          2HG2      VAL  67   1.478  -5.683 -13.018
  501   3HG2  VAL  67          3HG2      VAL  67   0.345  -6.441 -11.899
  502    H    ASN  68           H        ASN  68   2.205  -1.474 -11.426
  503    HA   ASN  68           HA       ASN  68   3.796  -1.056  -8.938
  504   1HB   ASN  68          2HB       ASN  68   3.009   0.696 -11.250
  505   2HB   ASN  68          1HB       ASN  68   3.388   1.436  -9.694
  506   1HD2  ASN  68          1HD2      ASN  68   5.568   1.943  -9.450
  507   2HD2  ASN  68          2HD2      ASN  68   6.848   1.148 -10.233
  508    HA   PRO  69           HA       PRO  69   0.168  -0.094  -6.634
  509   1HB   PRO  69          2HB       PRO  69   1.229   1.705  -4.843
  510   2HB   PRO  69          1HB       PRO  69   1.528  -0.038  -4.769
  511   1HG   PRO  69          2HG       PRO  69   3.354   2.142  -5.660
  512   2HG   PRO  69          1HG       PRO  69   3.750   0.548  -4.994
  513   1HD   PRO  69          2HD       PRO  69   3.845   1.284  -7.730
  514   2HD   PRO  69          1HD       PRO  69   3.941  -0.368  -7.084
  515    H    ALA  70           H        ALA  70  -0.393   1.109  -8.847
  516    HA   ALA  70           HA       ALA  70  -1.099   3.917  -8.140
  517   1HB   ALA  70          1HB       ALA  70  -0.251   3.305 -10.951
  518   2HB   ALA  70          2HB       ALA  70   0.990   3.592  -9.732
  519   3HB   ALA  70          3HB       ALA  70  -0.209   4.836 -10.081
  520    H    GLN  71           H        GLN  71  -1.567   1.301 -10.553
  521    HA   GLN  71           HA       GLN  71  -4.083   2.272 -11.538
  522   1HB   GLN  71          2HB       GLN  71  -2.730  -0.425 -11.572
  523   2HB   GLN  71          1HB       GLN  71  -4.352  -0.214 -12.229
  524   1HG   GLN  71          2HG       GLN  71  -3.622   1.187 -13.945
  525   2HG   GLN  71          1HG       GLN  71  -2.173   1.677 -13.067
  526   1HE2  GLN  71          1HE2      GLN  71  -0.390   0.036 -12.906
  527   2HE2  GLN  71          2HE2      GLN  71  -0.268  -1.179 -14.086
  528    HA   PRO  72           HA       PRO  72  -6.877   0.988  -8.381
  529   1HB   PRO  72          2HB       PRO  72  -9.128   0.592  -9.911
  530   2HB   PRO  72          1HB       PRO  72  -8.498   2.194  -9.491
  531   1HG   PRO  72          2HG       PRO  72  -8.357   0.745 -12.094
  532   2HG   PRO  72          1HG       PRO  72  -8.344   2.487 -11.778
  533   1HD   PRO  72          2HD       PRO  72  -6.084   0.903 -12.389
  534   2HD   PRO  72          1HD       PRO  72  -6.053   2.554 -11.734
  535    H    ALA  73           H        ALA  73  -7.979  -0.905  -7.546
  536    HA   ALA  73           HA       ALA  73  -6.877  -3.421  -8.160
  537   1HB   ALA  73          1HB       ALA  73  -8.072  -2.940  -6.059
  538   2HB   ALA  73          2HB       ALA  73  -8.727  -4.378  -6.839
  539   3HB   ALA  73          3HB       ALA  73  -9.595  -2.846  -6.943
  540    H    GLY  74           H        GLY  74  -9.896  -1.962  -9.393
  541   1HA   GLY  74          2HA       GLY  74 -10.897  -4.208 -10.807
  542   2HA   GLY  74          1HA       GLY  74 -11.209  -2.531 -11.252
  543    H    ASN  75           H        ASN  75  -8.719  -1.603 -11.964
  544    HA   ASN  75           HA       ASN  75  -8.347  -2.765 -14.583
  545   1HB   ASN  75          2HB       ASN  75  -7.885  -0.327 -13.736
  546   2HB   ASN  75          1HB       ASN  75  -6.307  -0.973 -13.285
  547   1HD2  ASN  75          1HD2      ASN  75  -4.868  -1.682 -15.024
  548   2HD2  ASN  75          2HD2      ASN  75  -5.174  -1.274 -16.643
  549    H    ILE  76           H        ILE  76  -6.619  -3.075 -11.499
  550    HA   ILE  76           HA       ILE  76  -4.274  -4.377 -12.458
  551    HB   ILE  76           HB       ILE  76  -5.739  -4.635  -9.814
  552   1HG1  ILE  76          2HG1      ILE  76  -4.797  -2.383 -10.481
  553   2HG1  ILE  76          1HG1      ILE  76  -4.107  -3.046  -9.003
  554   1HG2  ILE  76          1HG2      ILE  76  -2.863  -5.411 -10.313
  555   2HG2  ILE  76          2HG2      ILE  76  -4.172  -6.582 -10.462
  556   3HG2  ILE  76          3HG2      ILE  76  -3.872  -5.786  -8.919
  557   1HD1  ILE  76          1HD1      ILE  76  -2.466  -2.059 -10.733
  558   2HD1  ILE  76          2HD1      ILE  76  -2.805  -3.500 -11.690
  559   3HD1  ILE  76          3HD1      ILE  76  -2.090  -3.654 -10.086
  560    H    PHE  77           H        PHE  77  -7.443  -5.723 -11.484
  561    HA   PHE  77           HA       PHE  77  -6.622  -8.471 -12.008
  562   1HB   PHE  77          2HB       PHE  77  -8.536  -7.594 -10.453
  563   2HB   PHE  77          1HB       PHE  77  -9.493  -7.572 -11.934
  564    HD1  PHE  77           HD1      PHE  77  -9.635  -9.715 -13.327
  565    HD2  PHE  77           HD2      PHE  77  -8.113  -9.630  -9.310
  566    HE1  PHE  77           HE1      PHE  77  -9.976 -12.163 -13.146
  567    HE2  PHE  77           HE2      PHE  77  -8.455 -12.079  -9.131
  568    HZ   PHE  77           HZ       PHE  77  -9.385 -13.346 -11.048
  569    H    LEU  78           H        LEU  78  -8.505  -6.008 -13.784
  570    HA   LEU  78           HA       LEU  78  -9.261  -7.664 -15.991
  571   1HB   LEU  78          2HB       LEU  78  -8.833  -4.679 -15.736
  572   2HB   LEU  78          1HB       LEU  78  -9.379  -5.425 -17.236
  573    HG   LEU  78           HG       LEU  78 -10.789  -5.956 -14.620
  574   1HD1  LEU  78          1HD1      LEU  78 -11.013  -3.620 -14.723
  575   2HD1  LEU  78          2HD1      LEU  78 -12.443  -4.184 -15.589
  576   3HD1  LEU  78          3HD1      LEU  78 -11.039  -3.605 -16.486
  577   1HD2  LEU  78          1HD2      LEU  78 -11.049  -7.216 -16.965
  578   2HD2  LEU  78          2HD2      LEU  78 -12.089  -5.836 -17.313
  579   3HD2  LEU  78          3HD2      LEU  78 -12.448  -6.888 -15.943
  580    H    LYS  79           H        LYS  79  -6.320  -5.772 -15.359
  581    HA   LYS  79           HA       LYS  79  -5.206  -6.403 -18.011
  582   1HB   LYS  79          2HB       LYS  79  -4.876  -4.222 -16.568
  583   2HB   LYS  79          1HB       LYS  79  -3.610  -5.169 -15.783
  584   1HG   LYS  79          2HG       LYS  79  -2.435  -5.484 -17.839
  585   2HG   LYS  79          1HG       LYS  79  -3.796  -4.889 -18.790
  586   1HD   LYS  79          2HD       LYS  79  -3.337  -2.679 -18.324
  587   2HD   LYS  79          1HD       LYS  79  -2.650  -3.043 -16.739
  588   1HE   LYS  79          2HE       LYS  79  -0.781  -4.253 -18.146
  589   2HE   LYS  79          1HE       LYS  79  -1.357  -3.212 -19.447
  590   1HZ   LYS  79          1HZ       LYS  79  -1.141  -1.370 -17.665
  591   2HZ   LYS  79          2HZ       LYS  79   0.254  -1.927 -18.462
  592   3HZ   LYS  79          3HZ       LYS  79  -0.103  -2.469 -16.891
  593    H    HIS  80           H        HIS  80  -4.212  -7.035 -14.613
  594    HA   HIS  80           HA       HIS  80  -2.395  -9.169 -15.581
  595   1HB   HIS  80          2HB       HIS  80  -2.795  -8.317 -12.706
  596   2HB   HIS  80          1HB       HIS  80  -1.392  -9.110 -13.421
  597    HD1  HIS  80           HD1      HIS  80  -0.256  -7.558 -15.468
  598    HD2  HIS  80           HD2      HIS  80  -2.461  -5.586 -12.530
  599    HE1  HIS  80           HE1      HIS  80   0.419  -5.120 -15.581
  600    H    GLY  81           H        GLY  81  -4.793  -8.929 -12.910
  601   1HA   GLY  81          2HA       GLY  81  -6.701 -10.612 -13.052
  602   2HA   GLY  81          1HA       GLY  81  -5.455 -11.805 -13.418
  603    H    SER  82           H        SER  82  -5.217 -13.089 -11.651
  604    HA   SER  82           HA       SER  82  -5.157 -11.776  -8.960
  605   1HB   SER  82          2HB       SER  82  -6.935 -13.631  -9.671
  606   2HB   SER  82          1HB       SER  82  -5.617 -14.718  -9.244
  607    HG   SER  82           HG       SER  82  -6.520 -14.393  -7.328
  608    H    GLU  83           H        GLU  83  -3.531 -14.116 -11.088
  609    HA   GLU  83           HA       GLU  83  -1.587 -14.969  -9.126
  610   1HB   GLU  83          2HB       GLU  83  -1.944 -15.257 -12.072
  611   2HB   GLU  83          1HB       GLU  83  -0.314 -15.485 -11.439
  612   1HG   GLU  83          2HG       GLU  83  -2.598 -16.833 -10.041
  613   2HG   GLU  83          1HG       GLU  83  -2.003 -17.524 -11.550
  614    H    LEU  84           H        LEU  84  -0.289 -13.463  -8.183
  615    HA   LEU  84           HA       LEU  84   1.383 -11.754  -9.962
  616   1HB   LEU  84          2HB       LEU  84  -0.294 -10.834  -7.621
  617   2HB   LEU  84          1HB       LEU  84   1.100  -9.913  -8.186
  618    HG   LEU  84           HG       LEU  84  -0.664 -10.745 -10.373
  619   1HD1  LEU  84          1HD1      LEU  84  -2.463  -9.131  -9.824
  620   2HD1  LEU  84          2HD1      LEU  84  -1.738  -8.880  -8.237
  621   3HD1  LEU  84          3HD1      LEU  84  -2.400 -10.457  -8.665
  622   1HD2  LEU  84          1HD2      LEU  84   0.909  -9.109 -10.923
  623   2HD2  LEU  84          2HD2      LEU  84   0.709  -8.259  -9.390
  624   3HD2  LEU  84          3HD2      LEU  84  -0.531  -8.131 -10.638
  625    H    ARG  85           H        ARG  85   3.291 -10.839  -8.716
  626    HA   ARG  85           HA       ARG  85   4.130 -12.638  -6.470
  627   1HB   ARG  85          2HB       ARG  85   5.234 -12.483  -9.101
  628   2HB   ARG  85          1HB       ARG  85   6.405 -11.771  -7.994
  629   1HG   ARG  85          2HG       ARG  85   7.029 -13.957  -7.728
  630   2HG   ARG  85          1HG       ARG  85   5.714 -13.947  -6.554
  631   1HD   ARG  85          2HD       ARG  85   4.362 -14.451  -8.894
  632   2HD   ARG  85          1HD       ARG  85   5.887 -15.294  -9.171
  633    HE   ARG  85           HE       ARG  85   4.589 -15.799  -6.573
  634   1HH1  ARG  85          1HH2      ARG  85   6.612 -17.616  -7.915
  635   2HH1  ARG  85          2HH2      ARG  85   5.600 -18.909  -8.466
  636   1HH2  ARG  85          2HH1      ARG  85   2.644 -17.110  -8.094
  637   2HH2  ARG  85          1HH1      ARG  85   3.347 -18.618  -8.574
  638    H    LEU  86           H        LEU  86   5.502 -11.628  -4.894
  639    HA   LEU  86           HA       LEU  86   5.498  -8.642  -5.035
  640   1HB   LEU  86          2HB       LEU  86   4.471 -10.104  -3.057
  641   2HB   LEU  86          1HB       LEU  86   6.145 -10.104  -2.506
  642    HG   LEU  86           HG       LEU  86   5.144  -7.475  -3.410
  643   1HD1  LEU  86          1HD1      LEU  86   3.963  -7.122  -1.200
  644   2HD1  LEU  86          2HD1      LEU  86   4.013  -8.870  -0.972
  645   3HD1  LEU  86          3HD1      LEU  86   3.114  -8.182  -2.324
  646   1HD2  LEU  86          1HD2      LEU  86   6.300  -6.819  -1.270
  647   2HD2  LEU  86          2HD2      LEU  86   7.335  -7.699  -2.395
  648   3HD2  LEU  86          3HD2      LEU  86   6.649  -8.525  -0.995
  649    H    ILE  87           H        ILE  87   7.421  -7.707  -5.502
  650    HA   ILE  87           HA       ILE  87   9.928  -9.199  -4.821
  651    HB   ILE  87           HB       ILE  87  10.957  -8.004  -6.774
  652   1HG1  ILE  87          2HG1      ILE  87   8.266  -7.434  -7.905
  653   2HG1  ILE  87          1HG1      ILE  87   8.815  -6.333  -6.642
  654   1HG2  ILE  87          1HG2      ILE  87   9.223  -9.284  -8.444
  655   2HG2  ILE  87          2HG2      ILE  87   8.821 -10.046  -6.905
  656   3HG2  ILE  87          3HG2      ILE  87  10.476 -10.103  -7.512
  657   1HD1  ILE  87          1HD1      ILE  87  10.541  -5.509  -7.917
  658   2HD1  ILE  87          2HD1      ILE  87   9.458  -5.977  -9.227
  659   3HD1  ILE  87          3HD1      ILE  87  10.787  -7.038  -8.761
  660    HA   PRO  88           HA       PRO  88  11.123  -5.627  -2.518
  661   1HB   PRO  88          2HB       PRO  88  13.817  -6.167  -2.372
  662   2HB   PRO  88          1HB       PRO  88  12.598  -7.020  -1.411
  663   1HG   PRO  88          2HG       PRO  88  14.118  -7.979  -3.787
  664   2HG   PRO  88          1HG       PRO  88  13.391  -8.912  -2.468
  665   1HD   PRO  88          2HD       PRO  88  12.312  -8.580  -5.071
  666   2HD   PRO  88          1HD       PRO  88  11.468  -9.254  -3.661
  667    H    ARG  89           H        ARG  89  10.641  -4.139  -4.345
  668    HA   ARG  89           HA       ARG  89  12.891  -3.456  -6.147
  669   1HB   ARG  89          2HB       ARG  89  10.415  -3.626  -6.863
  670   2HB   ARG  89          1HB       ARG  89  10.190  -2.092  -6.025
  671   1HG   ARG  89          2HG       ARG  89  12.263  -1.330  -7.457
  672   2HG   ARG  89          1HG       ARG  89  11.809  -2.687  -8.487
  673   1HD   ARG  89          2HD       ARG  89  10.622  -0.845  -9.394
  674   2HD   ARG  89          1HD       ARG  89   9.422  -1.704  -8.429
  675    HE   ARG  89           HE       ARG  89  10.870   0.542  -7.134
  676   1HH1  ARG  89          1HH2      ARG  89   8.454  -0.529  -5.848
  677   2HH1  ARG  89          2HH2      ARG  89   7.206   0.548  -6.383
  678   1HH2  ARG  89          2HH1      ARG  89   9.084   1.850  -9.005
  679   2HH2  ARG  89          1HH1      ARG  89   7.566   1.900  -8.173
  680    H    ASP  90           H        ASP  90  14.415  -2.252  -5.046
  681    HA   ASP  90           HA       ASP  90  13.564  -0.213  -3.084
  682   1HB   ASP  90          2HB       ASP  90  16.102  -1.578  -3.804
  683   2HB   ASP  90          1HB       ASP  90  16.264   0.093  -3.263
  684    H    ARG  91           H        ARG  91  12.925   1.720  -3.899
  685    HA   ARG  91           HA       ARG  91  14.550   2.915  -6.110
  686   1HB   ARG  91          2HB       ARG  91  12.443   3.967  -6.953
  687   2HB   ARG  91          1HB       ARG  91  12.425   2.209  -7.068
  688   1HG   ARG  91          2HG       ARG  91  10.870   1.974  -5.362
  689   2HG   ARG  91          1HG       ARG  91  11.333   3.488  -4.586
  690   1HD   ARG  91          2HD       ARG  91  10.438   4.468  -6.930
  691   2HD   ARG  91          1HD       ARG  91   9.451   3.011  -6.838
  692    HE   ARG  91           HE       ARG  91   9.443   5.182  -4.781
  693   1HH1  ARG  91          2HH1      ARG  91   7.460   3.750  -7.009
  694   2HH1  ARG  91          1HH1      ARG  91   6.213   3.280  -5.905
  695   1HH2  ARG  91          1HH2      ARG  91   8.071   4.027  -3.059
  696   2HH2  ARG  91          2HH2      ARG  91   6.558   3.439  -3.665
  697    H    VAL  92           H        VAL  92  14.794   5.201  -6.019
  698    HA   VAL  92           HA       VAL  92  15.143   7.240  -4.928
  699    HB   VAL  92           HB       VAL  92  12.514   6.481  -3.603
  700   1HG1  VAL  92          1HG1      VAL  92  13.563   8.224  -2.305
  701   2HG1  VAL  92          2HG1      VAL  92  12.335   8.990  -3.314
  702   3HG1  VAL  92          3HG1      VAL  92  14.037   9.097  -3.764
  703   1HG2  VAL  92          1HG2      VAL  92  12.609   6.666  -6.150
  704   2HG2  VAL  92          2HG2      VAL  92  13.014   8.367  -5.919
  705   3HG2  VAL  92          3HG2      VAL  92  11.465   7.742  -5.348
  706    H    GLY  93           H        GLY  93  17.028   6.557  -3.787
  707   1HA   GLY  93          2HA       GLY  93  17.107   5.061  -1.383
  708   2HA   GLY  93          1HA       GLY  93  18.324   6.252  -1.851
  709    H    HIS  94           HN       HIS  94  15.610   5.616   0.176
  710    HA   HIS  94           HA       HIS  94  14.841   6.756   2.075
  711   1HB   HIS  94          2HB       HIS  94  17.317   7.632   2.096
  712   2HB   HIS  94          1HB       HIS  94  16.606   9.117   1.462
  713    HD1  HIS  94           HD1      HIS  94  16.707   6.951   4.518
  714    HD2  HIS  94           HD2      HIS  94  14.896  10.497   3.282
  715    HE1  HIS  94           HE1      HIS  94  15.727   8.020   6.598
  Start of MODEL   10
    1   1H    MET   1          1H        MET   1 -20.575   2.374 -21.429
    2   2H    MET   1          2H        MET   1 -20.977   3.716 -20.470
    3   3H    MET   1          3H        MET   1 -19.349   3.318 -20.736
    4    HA   MET   1           HA       MET   1 -19.447   3.925 -22.999
    5   1HB   MET   1          2HB       MET   1 -21.605   4.789 -23.960
    6   2HB   MET   1          1HB       MET   1 -21.639   3.069 -23.582
    7   1HG   MET   1          2HG       MET   1 -22.452   4.416 -21.224
    8   2HG   MET   1          1HG       MET   1 -23.324   5.171 -22.556
    9   1HE   MET   1          1HE       MET   1 -26.221   3.102 -22.793
   10   2HE   MET   1          2HE       MET   1 -25.244   4.123 -23.847
   11   3HE   MET   1          3HE       MET   1 -25.512   4.597 -22.172
   12    H    SER   2           H        SER   2 -19.461   6.168 -23.757
   13    HA   SER   2           HA       SER   2 -19.444   8.076 -21.464
   14   1HB   SER   2          2HB       SER   2 -17.903   7.829 -24.021
   15   2HB   SER   2          1HB       SER   2 -18.115   9.430 -23.318
   16    HG   SER   2           HG       SER   2 -16.608   8.893 -21.968
   17    H    GLY   3           H        GLY   3 -20.912   9.740 -21.456
   18   1HA   GLY   3          2HA       GLY   3 -22.000  11.535 -22.847
   19   2HA   GLY   3          1HA       GLY   3 -22.403  10.263 -24.000
   20    H    GLY   4           H        GLY   4 -23.017  11.396 -20.698
   21   1HA   GLY   4          2HA       GLY   4 -25.344  11.576 -19.930
   22   2HA   GLY   4          1HA       GLY   4 -25.716  10.138 -20.877
   23    H    THR   5           H        THR   5 -24.820   8.083 -20.135
   24    HA   THR   5           HA       THR   5 -24.465   8.069 -17.172
   25    HB   THR   5           HB       THR   5 -25.329   5.724 -17.311
   26    HG1  THR   5           HG1      THR   5 -25.801   4.862 -19.199
   27   1HG2  THR   5          1HG2      THR   5 -27.279   7.464 -18.777
   28   2HG2  THR   5          2HG2      THR   5 -26.747   7.941 -17.166
   29   3HG2  THR   5          3HG2      THR   5 -27.556   6.392 -17.403
   30    H    ALA   6           H        ALA   6 -22.317   7.966 -16.740
   31    HA   ALA   6           HA       ALA   6 -20.417   6.623 -18.488
   32   1HB   ALA   6          1HB       ALA   6 -19.005   6.893 -16.222
   33   2HB   ALA   6          2HB       ALA   6 -20.297   8.034 -15.851
   34   3HB   ALA   6          3HB       ALA   6 -19.304   8.264 -17.290
   35    H    ALA   7           H        ALA   7 -20.651   4.454 -18.662
   36    HA   ALA   7           HA       ALA   7 -21.441   2.891 -16.275
   37   1HB   ALA   7          1HB       ALA   7 -21.824   1.060 -17.880
   38   2HB   ALA   7          2HB       ALA   7 -21.195   2.071 -19.180
   39   3HB   ALA   7          3HB       ALA   7 -22.688   2.521 -18.358
   40    H    THR   8           H        THR   8 -19.818   2.187 -15.046
   41    HA   THR   8           HA       THR   8 -17.233   1.419 -16.320
   42    HB   THR   8           HB       THR   8 -17.919   1.893 -13.397
   43    HG1  THR   8           HG1      THR   8 -17.760   3.877 -14.078
   44   1HG2  THR   8          1HG2      THR   8 -15.900   0.344 -14.350
   45   2HG2  THR   8          2HG2      THR   8 -15.788   1.279 -12.861
   46   3HG2  THR   8          3HG2      THR   8 -15.119   1.928 -14.357
   47    H    THR   9           H        THR   9 -17.169  -0.719 -16.804
   48    HA   THR   9           HA       THR   9 -18.977  -2.649 -15.658
   49    HB   THR   9           HB       THR   9 -16.408  -3.169 -17.187
   50    HG1  THR   9           HG1      THR   9 -17.616  -2.004 -18.544
   51   1HG2  THR   9          1HG2      THR   9 -17.462  -5.098 -15.946
   52   2HG2  THR   9          2HG2      THR   9 -17.384  -5.316 -17.694
   53   3HG2  THR   9          3HG2      THR   9 -18.907  -4.861 -16.931
   54    H    ALA  10           H        ALA  10 -18.805  -3.057 -13.510
   55    HA   ALA  10           HA       ALA  10 -16.307  -4.287 -12.533
   56   1HB   ALA  10          1HB       ALA  10 -17.061  -1.575 -11.886
   57   2HB   ALA  10          2HB       ALA  10 -15.632  -2.476 -11.377
   58   3HB   ALA  10          3HB       ALA  10 -17.118  -2.570 -10.431
   59    H    GLY  11           H        GLY  11 -16.865  -6.059 -11.372
   60   1HA   GLY  11          2HA       GLY  11 -19.632  -6.678 -10.810
   61   2HA   GLY  11          1HA       GLY  11 -18.240  -7.638 -10.305
   62    H    SER  12           H        SER  12 -17.464  -7.410  -8.219
   63    HA   SER  12           HA       SER  12 -18.680  -5.273  -6.524
   64   1HB   SER  12          2HB       SER  12 -19.367  -7.982  -6.389
   65   2HB   SER  12          1HB       SER  12 -18.225  -7.758  -5.067
   66    HG   SER  12           HG       SER  12 -20.127  -7.151  -4.219
   67    H    LYS  13           H        LYS  13 -16.326  -7.973  -6.205
   68    HA   LYS  13           HA       LYS  13 -14.246  -5.977  -5.454
   69   1HB   LYS  13          2HB       LYS  13 -14.906  -8.462  -3.840
   70   2HB   LYS  13          1HB       LYS  13 -13.550  -7.377  -3.537
   71   1HG   LYS  13          2HG       LYS  13 -15.626  -5.601  -3.606
   72   2HG   LYS  13          1HG       LYS  13 -16.421  -7.021  -2.925
   73   1HD   LYS  13          2HD       LYS  13 -13.744  -6.210  -1.844
   74   2HD   LYS  13          1HD       LYS  13 -15.172  -5.305  -1.345
   75   1HE   LYS  13          2HE       LYS  13 -16.061  -7.076  -0.182
   76   2HE   LYS  13          1HE       LYS  13 -15.383  -8.275  -1.283
   77   1HZ   LYS  13          1HZ       LYS  13 -13.577  -8.487  -0.027
   78   2HZ   LYS  13          2HZ       LYS  13 -14.414  -7.635   1.181
   79   3HZ   LYS  13          3HZ       LYS  13 -13.363  -6.812   0.129
   80    H    VAL  14           H        VAL  14 -12.109  -6.689  -5.879
   81    HA   VAL  14           HA       VAL  14 -11.936  -9.116  -7.617
   82    HB   VAL  14           HB       VAL  14  -9.805  -8.004  -8.466
   83   1HG1  VAL  14          1HG1      VAL  14 -11.169  -6.201  -9.738
   84   2HG1  VAL  14          2HG1      VAL  14 -12.554  -6.823  -8.841
   85   3HG1  VAL  14          3HG1      VAL  14 -11.654  -7.886  -9.922
   86   1HG2  VAL  14          1HG2      VAL  14 -10.987  -5.536  -7.164
   87   2HG2  VAL  14          2HG2      VAL  14  -9.451  -5.672  -8.019
   88   3HG2  VAL  14          3HG2      VAL  14  -9.659  -6.451  -6.451
   89    H    THR  15           H        THR  15 -10.464 -10.713  -7.097
   90    HA   THR  15           HA       THR  15  -9.083 -10.430  -4.471
   91    HB   THR  15           HB       THR  15  -8.828 -12.947  -4.682
   92    HG1  THR  15           HG1      THR  15  -9.226 -13.671  -6.601
   93   1HG2  THR  15          1HG2      THR  15 -10.612 -11.992  -3.331
   94   2HG2  THR  15          2HG2      THR  15 -11.241 -13.384  -4.213
   95   3HG2  THR  15          3HG2      THR  15 -11.611 -11.750  -4.765
   96    H    PHE  16           H        PHE  16  -6.848 -10.843  -4.264
   97    HA   PHE  16           HA       PHE  16  -5.327 -11.155  -6.823
   98   1HB   PHE  16          2HB       PHE  16  -4.654  -9.297  -4.522
   99   2HB   PHE  16          1HB       PHE  16  -3.639  -9.572  -5.934
  100    HD1  PHE  16           HD1      PHE  16  -6.189  -7.529  -4.568
  101    HD2  PHE  16           HD2      PHE  16  -4.839  -9.239  -8.270
  102    HE1  PHE  16           HE1      PHE  16  -7.459  -5.810  -5.825
  103    HE2  PHE  16           HE2      PHE  16  -6.110  -7.520  -9.527
  104    HZ   PHE  16           HZ       PHE  16  -7.418  -5.806  -8.304
  105    H    LYS  17           H        LYS  17  -3.601 -12.538  -6.719
  106    HA   LYS  17           HA       LYS  17  -3.026 -13.817  -4.075
  107   1HB   LYS  17          2HB       LYS  17  -4.115 -15.229  -5.941
  108   2HB   LYS  17          1HB       LYS  17  -2.563 -15.106  -6.771
  109   1HG   LYS  17          2HG       LYS  17  -1.855 -15.802  -4.171
  110   2HG   LYS  17          1HG       LYS  17  -3.309 -16.752  -4.472
  111   1HD   LYS  17          2HD       LYS  17  -1.920 -18.204  -5.524
  112   2HD   LYS  17          1HD       LYS  17  -1.932 -17.034  -6.844
  113   1HE   LYS  17          2HE       LYS  17  -0.053 -16.119  -4.901
  114   2HE   LYS  17          1HE       LYS  17   0.274 -17.825  -5.197
  115   1HZ   LYS  17          1HZ       LYS  17   1.483 -16.612  -6.800
  116   2HZ   LYS  17          2HZ       LYS  17   0.153 -15.628  -7.186
  117   3HZ   LYS  17          3HZ       LYS  17   0.155 -17.270  -7.627
  118    H    ILE  18           H        ILE  18  -1.189 -12.748  -3.405
  119    HA   ILE  18           HA       ILE  18   1.027 -12.424  -5.387
  120    HB   ILE  18           HB       ILE  18   0.630 -10.975  -2.750
  121   1HG1  ILE  18          2HG1      ILE  18   0.399  -9.165  -4.870
  122   2HG1  ILE  18          1HG1      ILE  18  -0.530 -10.566  -5.402
  123   1HG2  ILE  18          1HG2      ILE  18   2.560 -10.622  -5.060
  124   2HG2  ILE  18          2HG2      ILE  18   2.958 -11.034  -3.392
  125   3HG2  ILE  18          3HG2      ILE  18   2.339  -9.429  -3.781
  126   1HD1  ILE  18          1HD1      ILE  18  -2.162 -10.191  -3.878
  127   2HD1  ILE  18          2HD1      ILE  18  -1.444  -8.593  -3.685
  128   3HD1  ILE  18          3HD1      ILE  18  -0.997  -9.897  -2.586
  129    H    THR  19           H        THR  19   2.718 -13.773  -5.141
  130    HA   THR  19           HA       THR  19   3.243 -14.935  -2.432
  131    HB   THR  19           HB       THR  19   2.403 -16.600  -4.108
  132    HG1  THR  19           HG1      THR  19   3.646 -17.932  -3.105
  133   1HG2  THR  19          1HG2      THR  19   5.024 -16.103  -5.539
  134   2HG2  THR  19          2HG2      THR  19   3.485 -15.431  -6.079
  135   3HG2  THR  19          3HG2      THR  19   3.717 -17.178  -6.033
  136    H    LEU  20           H        LEU  20   5.412 -14.948  -1.742
  137    HA   LEU  20           HA       LEU  20   7.146 -12.943  -2.856
  138   1HB   LEU  20          2HB       LEU  20   7.070 -14.541  -0.503
  139   2HB   LEU  20          1HB       LEU  20   8.642 -14.805  -1.258
  140    HG   LEU  20           HG       LEU  20   7.489 -12.036  -0.862
  141   1HD1  LEU  20          1HD1      LEU  20   9.039 -11.924   1.122
  142   2HD1  LEU  20          2HD1      LEU  20   9.254 -13.669   0.985
  143   3HD1  LEU  20          3HD1      LEU  20   7.663 -13.004   1.350
  144   1HD2  LEU  20          1HD2      LEU  20  10.257 -13.150  -1.411
  145   2HD2  LEU  20          2HD2      LEU  20   9.949 -11.464  -1.001
  146   3HD2  LEU  20          3HD2      LEU  20   9.282 -12.143  -2.485
  147    H    THR  21           H        THR  21   8.344 -13.126  -4.661
  148    HA   THR  21           HA       THR  21   9.049 -15.831  -5.672
  149    HB   THR  21           HB       THR  21   7.892 -14.222  -7.197
  150    HG1  THR  21           HG1      THR  21   8.940 -15.266  -8.657
  151   1HG2  THR  21          1HG2      THR  21   9.556 -12.332  -6.114
  152   2HG2  THR  21          2HG2      THR  21   8.663 -12.129  -7.620
  153   3HG2  THR  21          3HG2      THR  21  10.346 -12.654  -7.659
  154    H    SER  22           H        SER  22  10.529 -12.896  -4.408
  155    HA   SER  22           HA       SER  22  13.219 -13.422  -5.295
  156   1HB   SER  22          2HB       SER  22  11.878 -11.525  -3.537
  157   2HB   SER  22          1HB       SER  22  13.420 -12.044  -2.865
  158    HG   SER  22           HG       SER  22  13.120 -10.249  -4.657
  159    H    ASP  23           H        ASP  23  11.421 -14.300  -2.353
  160    HA   ASP  23           HA       ASP  23  13.673 -15.582  -1.049
  161   1HB   ASP  23          2HB       ASP  23  10.716 -15.419  -0.600
  162   2HB   ASP  23          1HB       ASP  23  11.611 -16.698   0.217
  163    HA   PRO  24           HA       PRO  24  13.538 -19.581  -2.870
  164   1HB   PRO  24          2HB       PRO  24  13.969 -21.204  -0.684
  165   2HB   PRO  24          1HB       PRO  24  15.232 -20.230  -1.455
  166   1HG   PRO  24          2HG       PRO  24  13.800 -19.754   1.121
  167   2HG   PRO  24          1HG       PRO  24  15.426 -19.247   0.629
  168   1HD   PRO  24          2HD       PRO  24  13.143 -17.593   0.683
  169   2HD   PRO  24          1HD       PRO  24  14.666 -17.230  -0.155
  170    H    LYS  25           H        LYS  25  11.384 -19.008  -0.141
  171    HA   LYS  25           HA       LYS  25   9.726 -21.375  -0.720
  172   1HB   LYS  25          2HB       LYS  25   9.862 -19.284   1.377
  173   2HB   LYS  25          1HB       LYS  25   8.251 -19.905   1.024
  174   1HG   LYS  25          2HG       LYS  25   9.173 -22.237   1.284
  175   2HG   LYS  25          1HG       LYS  25  10.684 -21.517   1.837
  176   1HD   LYS  25          2HD       LYS  25   8.015 -21.585   3.188
  177   2HD   LYS  25          1HD       LYS  25   9.619 -21.852   3.870
  178   1HE   LYS  25          2HE       LYS  25   9.904 -19.280   3.133
  179   2HE   LYS  25          1HE       LYS  25   8.162 -19.293   3.387
  180   1HZ   LYS  25          1HZ       LYS  25   8.390 -19.606   5.590
  181   2HZ   LYS  25          2HZ       LYS  25   9.900 -18.874   5.329
  182   3HZ   LYS  25          3HZ       LYS  25   9.778 -20.565   5.440
  183    H    LEU  26           H        LEU  26   7.178 -20.582  -0.549
  184    HA   LEU  26           HA       LEU  26   6.718 -18.299  -2.377
  185   1HB   LEU  26          2HB       LEU  26   6.294 -21.177  -3.040
  186   2HB   LEU  26          1HB       LEU  26   5.039 -20.047  -3.549
  187    HG   LEU  26           HG       LEU  26   7.559 -18.849  -4.146
  188   1HD1  LEU  26          1HD1      LEU  26   7.276 -21.655  -5.264
  189   2HD1  LEU  26          2HD1      LEU  26   8.435 -21.192  -4.018
  190   3HD1  LEU  26          3HD1      LEU  26   8.555 -20.501  -5.636
  191   1HD2  LEU  26          1HD2      LEU  26   6.674 -19.156  -6.510
  192   2HD2  LEU  26          2HD2      LEU  26   5.555 -18.371  -5.396
  193   3HD2  LEU  26          3HD2      LEU  26   5.338 -20.072  -5.809
  194    HA   PRO  27           HA       PRO  27   3.594 -18.811   1.017
  195   1HB   PRO  27          2HB       PRO  27   4.046 -16.344   2.159
  196   2HB   PRO  27          1HB       PRO  27   4.906 -17.819   2.636
  197   1HG   PRO  27          2HG       PRO  27   5.886 -15.517   1.019
  198   2HG   PRO  27          1HG       PRO  27   6.802 -16.661   2.011
  199   1HD   PRO  27          2HD       PRO  27   6.585 -16.716  -0.813
  200   2HD   PRO  27          1HD       PRO  27   7.224 -18.015   0.215
  201    H    PHE  28           H        PHE  28   1.922 -18.637  -0.542
  202    HA   PHE  28           HA       PHE  28   1.408 -16.249  -2.072
  203   1HB   PHE  28          2HB       PHE  28  -0.642 -17.330  -2.769
  204   2HB   PHE  28          1HB       PHE  28   0.632 -18.544  -2.723
  205    HD1  PHE  28           HD1      PHE  28  -2.440 -17.312  -1.099
  206    HD2  PHE  28           HD2      PHE  28   0.646 -20.301  -1.014
  207    HE1  PHE  28           HE1      PHE  28  -3.800 -18.674   0.464
  208    HE2  PHE  28           HE2      PHE  28  -0.714 -21.660   0.551
  209    HZ   PHE  28           HZ       PHE  28  -2.937 -20.846   1.289
  210    H    LYS  29           H        LYS  29  -0.328 -14.754  -1.837
  211    HA   LYS  29           HA       LYS  29  -1.583 -14.595   0.866
  212   1HB   LYS  29          2HB       LYS  29   0.434 -12.829  -0.227
  213   2HB   LYS  29          1HB       LYS  29  -1.070 -11.943   0.020
  214   1HG   LYS  29          2HG       LYS  29  -0.631 -13.664   2.278
  215   2HG   LYS  29          1HG       LYS  29   0.832 -12.725   1.986
  216   1HD   LYS  29          2HD       LYS  29  -0.272 -11.135   3.197
  217   2HD   LYS  29          1HD       LYS  29  -1.042 -10.792   1.650
  218   1HE   LYS  29          2HE       LYS  29  -2.508 -12.933   2.714
  219   2HE   LYS  29          1HE       LYS  29  -2.217 -11.861   4.085
  220   1HZ   LYS  29          1HZ       LYS  29  -3.019 -10.007   2.683
  221   2HZ   LYS  29          2HZ       LYS  29  -4.208 -11.183   2.984
  222   3HZ   LYS  29          3HZ       LYS  29  -3.428 -11.126   1.476
  223    H    VAL  30           H        VAL  30  -3.760 -14.364   0.623
  224    HA   VAL  30           HA       VAL  30  -4.802 -13.501  -2.028
  225    HB   VAL  30           HB       VAL  30  -6.276 -14.758   0.310
  226   1HG1  VAL  30          1HG1      VAL  30  -7.037 -14.044  -2.526
  227   2HG1  VAL  30          2HG1      VAL  30  -7.873 -13.628  -1.030
  228   3HG1  VAL  30          3HG1      VAL  30  -7.905 -15.288  -1.625
  229   1HG2  VAL  30          1HG2      VAL  30  -4.599 -16.297  -0.608
  230   2HG2  VAL  30          2HG2      VAL  30  -5.168 -15.972  -2.246
  231   3HG2  VAL  30          3HG2      VAL  30  -6.212 -16.815  -1.100
  232    H    LEU  31           H        LEU  31  -5.400 -11.416  -2.232
  233    HA   LEU  31           HA       LEU  31  -6.322  -9.946   0.208
  234   1HB   LEU  31          2HB       LEU  31  -4.330  -9.304  -1.786
  235   2HB   LEU  31          1HB       LEU  31  -5.607  -8.089  -1.804
  236    HG   LEU  31           HG       LEU  31  -4.791  -8.890   0.906
  237   1HD1  LEU  31          1HD1      LEU  31  -2.613  -7.991   0.919
  238   2HD1  LEU  31          2HD1      LEU  31  -2.830  -7.204  -0.644
  239   3HD1  LEU  31          3HD1      LEU  31  -2.641  -8.955  -0.559
  240   1HD2  LEU  31          1HD2      LEU  31  -4.638  -6.117  -0.229
  241   2HD2  LEU  31          2HD2      LEU  31  -5.209  -6.645   1.354
  242   3HD2  LEU  31          3HD2      LEU  31  -6.221  -6.877  -0.072
  243    H    SER  32           H        SER  32  -8.501  -9.723   0.143
  244    HA   SER  32           HA       SER  32  -9.849  -9.480  -2.505
  245   1HB   SER  32          2HB       SER  32 -10.534 -11.197  -0.651
  246   2HB   SER  32          1HB       SER  32 -11.290  -9.806   0.120
  247    HG   SER  32           HG       SER  32 -12.626 -11.046  -1.394
  248    H    VAL  33           H        VAL  33 -10.078  -7.398  -3.122
  249    HA   VAL  33           HA       VAL  33 -11.165  -5.443  -1.147
  250    HB   VAL  33           HB       VAL  33  -9.674  -3.688  -2.168
  251   1HG1  VAL  33          1HG1      VAL  33  -7.544  -4.604  -1.055
  252   2HG1  VAL  33          2HG1      VAL  33  -8.489  -6.052  -0.709
  253   3HG1  VAL  33          3HG1      VAL  33  -8.987  -4.496  -0.046
  254   1HG2  VAL  33          1HG2      VAL  33  -7.652  -4.522  -3.383
  255   2HG2  VAL  33          2HG2      VAL  33  -9.146  -4.802  -4.276
  256   3HG2  VAL  33          3HG2      VAL  33  -8.372  -6.132  -3.414
  257    HA   PRO  34           HA       PRO  34 -13.898  -4.403  -4.429
  258   1HB   PRO  34          2HB       PRO  34 -14.381  -1.755  -3.847
  259   2HB   PRO  34          1HB       PRO  34 -15.077  -3.107  -2.937
  260   1HG   PRO  34          2HG       PRO  34 -12.840  -1.281  -2.175
  261   2HG   PRO  34          1HG       PRO  34 -13.988  -2.144  -1.137
  262   1HD   PRO  34          2HD       PRO  34 -11.326  -2.923  -1.612
  263   2HD   PRO  34          1HD       PRO  34 -12.600  -3.963  -0.938
  264    H    GLU  35           H        GLU  35 -14.081  -3.087  -6.402
  265    HA   GLU  35           HA       GLU  35 -11.620  -2.627  -7.749
  266   1HB   GLU  35          2HB       GLU  35 -14.474  -1.841  -8.301
  267   2HB   GLU  35          1HB       GLU  35 -13.177  -1.254  -9.342
  268   1HG   GLU  35          2HG       GLU  35 -13.712  -3.237 -10.426
  269   2HG   GLU  35          1HG       GLU  35 -12.450  -3.803  -9.333
  270    H    SER  36           H        SER  36 -13.627  -0.461  -5.818
  271    HA   SER  36           HA       SER  36 -12.499   2.032  -6.643
  272   1HB   SER  36          2HB       SER  36 -14.343   1.140  -4.674
  273   2HB   SER  36          1HB       SER  36 -13.109   2.067  -3.827
  274    HG   SER  36           HG       SER  36 -15.091   3.062  -5.089
  275    H    THR  37           H        THR  37 -11.462  -0.337  -4.192
  276    HA   THR  37           HA       THR  37  -9.368   1.233  -3.035
  277    HB   THR  37           HB       THR  37  -9.591  -1.782  -3.323
  278    HG1  THR  37           HG1      THR  37 -10.351   0.043  -1.290
  279   1HG2  THR  37          1HG2      THR  37  -7.918  -1.976  -1.649
  280   2HG2  THR  37          2HG2      THR  37  -7.996  -0.258  -1.260
  281   3HG2  THR  37          3HG2      THR  37  -7.284  -0.784  -2.785
  282    HA   PRO  38           HA       PRO  38  -6.649   1.152  -6.565
  283   1HB   PRO  38          2HB       PRO  38  -4.707   2.719  -5.411
  284   2HB   PRO  38          1HB       PRO  38  -6.202   3.365  -6.108
  285   1HG   PRO  38          2HG       PRO  38  -5.457   3.044  -3.239
  286   2HG   PRO  38          1HG       PRO  38  -6.578   4.195  -3.986
  287   1HD   PRO  38          2HD       PRO  38  -7.300   1.837  -2.594
  288   2HD   PRO  38          1HD       PRO  38  -8.372   2.820  -3.614
  289    H    PHE  39           H        PHE  39  -4.365   0.467  -6.981
  290    HA   PHE  39           HA       PHE  39  -3.659  -1.915  -5.540
  291   1HB   PHE  39          2HB       PHE  39  -3.057  -1.096  -7.998
  292   2HB   PHE  39          1HB       PHE  39  -1.614  -0.479  -7.192
  293    HD1  PHE  39           HD1      PHE  39   0.215  -1.919  -7.253
  294    HD2  PHE  39           HD2      PHE  39  -3.739  -3.580  -6.988
  295    HE1  PHE  39           HE1      PHE  39   1.175  -4.204  -7.227
  296    HE2  PHE  39           HE2      PHE  39  -2.776  -5.865  -6.962
  297    HZ   PHE  39           HZ       PHE  39  -0.320  -6.177  -7.080
  298    H    THR  40           H        THR  40  -2.962   1.430  -4.949
  299    HA   THR  40           HA       THR  40  -0.464   1.222  -3.576
  300    HB   THR  40           HB       THR  40  -1.653   3.200  -2.178
  301    HG1  THR  40           HG1      THR  40  -3.267   4.130  -3.349
  302   1HG2  THR  40          1HG2      THR  40  -0.865   3.489  -5.082
  303   2HG2  THR  40          2HG2      THR  40   0.282   3.365  -3.748
  304   3HG2  THR  40          3HG2      THR  40  -0.814   4.744  -3.846
  305    H    ALA  41           H        ALA  41  -3.826   0.968  -2.405
  306    HA   ALA  41           HA       ALA  41  -3.057   0.308   0.316
  307   1HB   ALA  41          1HB       ALA  41  -5.218   1.271   0.050
  308   2HB   ALA  41          2HB       ALA  41  -5.514  -0.421   0.446
  309   3HB   ALA  41          3HB       ALA  41  -5.653   0.131  -1.223
  310    H    VAL  42           H        VAL  42  -3.954  -1.571  -2.579
  311    HA   VAL  42           HA       VAL  42  -4.122  -4.137  -1.317
  312    HB   VAL  42           HB       VAL  42  -3.229  -3.459  -4.141
  313   1HG1  VAL  42          1HG1      VAL  42  -2.886  -5.673  -4.374
  314   2HG1  VAL  42          2HG1      VAL  42  -4.584  -5.948  -3.989
  315   3HG1  VAL  42          3HG1      VAL  42  -3.378  -5.954  -2.703
  316   1HG2  VAL  42          1HG2      VAL  42  -5.766  -3.225  -2.815
  317   2HG2  VAL  42          2HG2      VAL  42  -5.871  -4.531  -3.994
  318   3HG2  VAL  42          3HG2      VAL  42  -5.386  -2.917  -4.511
  319    H    LEU  43           H        LEU  43  -1.376  -2.626  -3.061
  320    HA   LEU  43           HA       LEU  43   0.562  -4.622  -2.408
  321   1HB   LEU  43          2HB       LEU  43   0.732  -2.698  -4.123
  322   2HB   LEU  43          1HB       LEU  43   1.191  -1.683  -2.758
  323    HG   LEU  43           HG       LEU  43   2.652  -4.229  -2.843
  324   1HD1  LEU  43          1HD1      LEU  43   2.239  -3.458  -5.331
  325   2HD1  LEU  43          2HD1      LEU  43   3.854  -3.950  -4.823
  326   3HD1  LEU  43          3HD1      LEU  43   3.454  -2.237  -4.946
  327   1HD2  LEU  43          1HD2      LEU  43   3.722  -1.402  -2.936
  328   2HD2  LEU  43          2HD2      LEU  43   4.483  -2.831  -2.239
  329   3HD2  LEU  43          3HD2      LEU  43   3.082  -2.106  -1.450
  330    H    LYS  44           H        LYS  44  -0.585  -1.762  -0.681
  331    HA   LYS  44           HA       LYS  44   1.397  -1.633   1.360
  332   1HB   LYS  44          2HB       LYS  44  -1.165  -0.449   0.800
  333   2HB   LYS  44          1HB       LYS  44  -1.126  -0.958   2.486
  334   1HG   LYS  44          2HG       LYS  44   1.389   0.182   2.019
  335   2HG   LYS  44          1HG       LYS  44   0.243   1.253   1.212
  336   1HD   LYS  44          2HD       LYS  44  -1.020   1.574   3.213
  337   2HD   LYS  44          1HD       LYS  44  -0.184   0.253   4.032
  338   1HE   LYS  44          2HE       LYS  44   1.262   2.712   3.031
  339   2HE   LYS  44          1HE       LYS  44   0.582   2.607   4.654
  340   1HZ   LYS  44          1HZ       LYS  44   2.584   0.743   3.490
  341   2HZ   LYS  44          2HZ       LYS  44   1.920   0.630   5.050
  342   3HZ   LYS  44          3HZ       LYS  44   2.905   1.952   4.635
  343    H    PHE  45           H        PHE  45  -1.809  -3.228   1.400
  344    HA   PHE  45           HA       PHE  45  -1.490  -4.476   3.953
  345   1HB   PHE  45          2HB       PHE  45  -3.528  -4.259   2.088
  346   2HB   PHE  45          1HB       PHE  45  -3.140  -5.979   2.049
  347    HD1  PHE  45           HD1      PHE  45  -4.167  -7.366   3.610
  348    HD2  PHE  45           HD2      PHE  45  -3.602  -3.215   4.550
  349    HE1  PHE  45           HE1      PHE  45  -5.364  -7.689   5.758
  350    HE2  PHE  45           HE2      PHE  45  -4.799  -3.536   6.697
  351    HZ   PHE  45           HZ       PHE  45  -5.680  -5.774   7.302
  352    H    ALA  46           H        ALA  46  -0.856  -5.691   0.649
  353    HA   ALA  46           HA       ALA  46  -0.121  -8.346   1.375
  354   1HB   ALA  46          1HB       ALA  46  -0.515  -7.709  -0.957
  355   2HB   ALA  46          2HB       ALA  46   1.109  -8.375  -0.789
  356   3HB   ALA  46          3HB       ALA  46   0.881  -6.631  -0.921
  357    H    ALA  47           H        ALA  47   1.931  -5.440   0.929
  358    HA   ALA  47           HA       ALA  47   4.407  -6.685   1.630
  359   1HB   ALA  47          1HB       ALA  47   5.295  -4.474   1.801
  360   2HB   ALA  47          2HB       ALA  47   3.713  -3.791   2.171
  361   3HB   ALA  47          3HB       ALA  47   4.056  -4.392   0.549
  362    H    GLU  48           H        GLU  48   1.909  -5.112   3.616
  363    HA   GLU  48           HA       GLU  48   3.322  -5.055   6.088
  364   1HB   GLU  48          2HB       GLU  48   1.087  -3.960   5.576
  365   2HB   GLU  48          1HB       GLU  48   0.349  -5.550   5.769
  366   1HG   GLU  48          2HG       GLU  48   2.080  -5.106   8.004
  367   2HG   GLU  48          1HG       GLU  48   1.061  -3.680   7.812
  368    H    GLU  49           H        GLU  49   1.189  -7.584   4.711
  369    HA   GLU  49           HA       GLU  49   1.595  -9.420   6.920
  370   1HB   GLU  49          2HB       GLU  49   0.375  -9.587   4.187
  371   2HB   GLU  49          1HB       GLU  49   0.762 -11.085   5.031
  372   1HG   GLU  49          2HG       GLU  49  -1.330 -10.781   5.915
  373   2HG   GLU  49          1HG       GLU  49  -0.449  -9.750   7.043
  374    H    PHE  50           H        PHE  50   3.188  -8.867   3.808
  375    HA   PHE  50           HA       PHE  50   4.826 -11.264   3.896
  376   1HB   PHE  50          2HB       PHE  50   4.638  -8.825   2.205
  377   2HB   PHE  50          1HB       PHE  50   6.206  -9.629   2.241
  378    HD1  PHE  50           HD1      PHE  50   3.042  -9.579   0.673
  379    HD2  PHE  50           HD2      PHE  50   6.098 -12.280   2.017
  380    HE1  PHE  50           HE1      PHE  50   2.201 -11.307  -0.891
  381    HE2  PHE  50           HE2      PHE  50   5.255 -14.007   0.450
  382    HZ   PHE  50           HZ       PHE  50   3.310 -13.521  -1.003
  383    H    LYS  51           H        LYS  51   4.915  -8.432   5.742
  384    HA   LYS  51           HA       LYS  51   6.458  -7.654   7.302
  385   1HB   LYS  51          2HB       LYS  51   7.023 -10.354   7.095
  386   2HB   LYS  51          1HB       LYS  51   8.585  -9.603   6.767
  387   1HG   LYS  51          2HG       LYS  51   7.998  -8.103   8.833
  388   2HG   LYS  51          1HG       LYS  51   6.871  -9.401   9.227
  389   1HD   LYS  51          2HD       LYS  51   8.543 -10.891   9.707
  390   2HD   LYS  51          1HD       LYS  51   9.626 -10.232   8.479
  391   1HE   LYS  51          2HE       LYS  51   9.970  -8.224   9.926
  392   2HE   LYS  51          1HE       LYS  51   8.993  -8.998  11.174
  393   1HZ   LYS  51          1HZ       LYS  51  11.281  -9.431  11.619
  394   2HZ   LYS  51          2HZ       LYS  51  11.549  -9.991  10.037
  395   3HZ   LYS  51          3HZ       LYS  51  10.571 -10.883  11.103
  396    H    VAL  52           H        VAL  52   6.458  -6.641   4.631
  397    HA   VAL  52           HA       VAL  52   9.292  -5.725   4.457
  398    HB   VAL  52           HB       VAL  52   9.017  -5.690   1.935
  399   1HG1  VAL  52          1HG1      VAL  52   9.510  -7.935   3.700
  400   2HG1  VAL  52          2HG1      VAL  52  10.310  -7.513   2.187
  401   3HG1  VAL  52          3HG1      VAL  52   8.841  -8.489   2.165
  402   1HG2  VAL  52          1HG2      VAL  52   6.625  -5.830   1.712
  403   2HG2  VAL  52          2HG2      VAL  52   6.560  -7.305   2.678
  404   3HG2  VAL  52          3HG2      VAL  52   7.284  -7.334   1.072
  405    HA   PRO  53           HA       PRO  53   7.467  -1.733   4.245
  406   1HB   PRO  53          2HB       PRO  53   9.407  -0.390   2.832
  407   2HB   PRO  53          1HB       PRO  53   9.560  -0.849   4.536
  408   1HG   PRO  53          2HG       PRO  53  10.851  -2.071   2.138
  409   2HG   PRO  53          1HG       PRO  53  11.417  -2.031   3.816
  410   1HD   PRO  53          2HD       PRO  53  10.208  -4.242   2.543
  411   2HD   PRO  53          1HD       PRO  53  10.441  -4.052   4.295
  412    H    ALA  54           H        ALA  54   5.799  -1.118   2.980
  413    HA   ALA  54           HA       ALA  54   5.504  -1.945   0.224
  414   1HB   ALA  54          1HB       ALA  54   3.689   0.152   0.699
  415   2HB   ALA  54          2HB       ALA  54   3.880  -0.660   2.254
  416   3HB   ALA  54          3HB       ALA  54   3.368  -1.577   0.838
  417    H    ALA  55           H        ALA  55   6.618   1.021   1.788
  418    HA   ALA  55           HA       ALA  55   6.461   2.810  -0.411
  419   1HB   ALA  55          1HB       ALA  55   8.568   2.682   1.770
  420   2HB   ALA  55          2HB       ALA  55   7.029   3.538   1.877
  421   3HB   ALA  55          3HB       ALA  55   8.258   4.071   0.728
  422    H    THR  56           H        THR  56   8.966   0.422   0.445
  423    HA   THR  56           HA       THR  56  10.268   0.979  -2.191
  424    HB   THR  56           HB       THR  56  12.316  -0.057  -1.148
  425    HG1  THR  56           HG1      THR  56  12.107  -0.941   0.723
  426   1HG2  THR  56          1HG2      THR  56  11.404   2.246   0.555
  427   2HG2  THR  56          2HG2      THR  56  11.660   2.468  -1.176
  428   3HG2  THR  56          3HG2      THR  56  12.994   1.948  -0.148
  429    H    SER  57           H        SER  57   8.028  -0.641  -2.210
  430    HA   SER  57           HA       SER  57   9.229  -3.285  -2.866
  431   1HB   SER  57          2HB       SER  57   7.066  -2.740  -0.896
  432   2HB   SER  57          1HB       SER  57   6.852  -4.134  -1.946
  433    HG   SER  57           HG       SER  57   8.069  -4.410   0.114
  434    H    ALA  58           H        ALA  58   7.950  -4.501  -4.411
  435    HA   ALA  58           HA       ALA  58   5.772  -3.020  -5.787
  436   1HB   ALA  58          1HB       ALA  58   7.739  -2.352  -7.030
  437   2HB   ALA  58          2HB       ALA  58   6.868  -3.540  -7.999
  438   3HB   ALA  58          3HB       ALA  58   8.312  -4.019  -7.108
  439    H    ILE  59           H        ILE  59   4.687  -4.485  -7.442
  440    HA   ILE  59           HA       ILE  59   4.916  -7.360  -6.638
  441    HB   ILE  59           HB       ILE  59   2.491  -5.597  -6.893
  442   1HG1  ILE  59          2HG1      ILE  59   3.064  -7.882  -4.993
  443   2HG1  ILE  59          1HG1      ILE  59   3.653  -6.246  -4.697
  444   1HG2  ILE  59          1HG2      ILE  59   2.703  -8.512  -7.591
  445   2HG2  ILE  59          2HG2      ILE  59   1.733  -7.251  -8.351
  446   3HG2  ILE  59          3HG2      ILE  59   1.243  -7.921  -6.795
  447   1HD1  ILE  59          1HD1      ILE  59   1.285  -5.427  -4.903
  448   2HD1  ILE  59          2HD1      ILE  59   1.540  -6.511  -3.536
  449   3HD1  ILE  59          3HD1      ILE  59   0.762  -7.109  -5.001
  450    H    ILE  60           H        ILE  60   5.455  -8.591  -8.372
  451    HA   ILE  60           HA       ILE  60   4.941  -7.505 -11.095
  452    HB   ILE  60           HB       ILE  60   6.535  -9.228 -11.871
  453   1HG1  ILE  60          2HG1      ILE  60   7.570  -9.972  -9.258
  454   2HG1  ILE  60          1HG1      ILE  60   5.889 -10.473  -9.431
  455   1HG2  ILE  60          1HG2      ILE  60   7.885  -7.448 -11.487
  456   2HG2  ILE  60          2HG2      ILE  60   8.426  -8.353 -10.075
  457   3HG2  ILE  60          3HG2      ILE  60   7.168  -7.128  -9.908
  458   1HD1  ILE  60          1HD1      ILE  60   6.390 -11.654 -11.491
  459   2HD1  ILE  60          2HD1      ILE  60   7.530 -12.188 -10.255
  460   3HD1  ILE  60          3HD1      ILE  60   8.042 -11.036 -11.488
  461    H    THR  61           H        THR  61   4.408  -9.328 -12.763
  462    HA   THR  61           HA       THR  61   2.125 -10.888 -11.648
  463    HB   THR  61           HB       THR  61   2.735 -10.299 -14.562
  464    HG1  THR  61           HG1      THR  61   1.403  -8.563 -14.351
  465   1HG2  THR  61          1HG2      THR  61   1.189 -12.199 -14.055
  466   2HG2  THR  61          2HG2      THR  61   0.394 -10.874 -14.904
  467   3HG2  THR  61          3HG2      THR  61   0.157 -11.077 -13.169
  468    H    ASN  62           H        ASN  62   1.847 -13.115 -12.334
  469    HA   ASN  62           HA       ASN  62   4.153 -14.741 -12.168
  470   1HB   ASN  62          2HB       ASN  62   1.318 -15.186 -13.001
  471   2HB   ASN  62          1HB       ASN  62   2.492 -16.449 -13.367
  472   1HD2  ASN  62          1HD2      ASN  62   3.012 -17.861 -11.668
  473   2HD2  ASN  62          2HD2      ASN  62   2.626 -17.586 -10.038
  474    H    ASP  63           H        ASP  63   2.723 -13.192 -14.976
  475    HA   ASP  63           HA       ASP  63   4.146 -14.851 -16.920
  476   1HB   ASP  63          2HB       ASP  63   2.679 -12.207 -17.187
  477   2HB   ASP  63          1HB       ASP  63   3.367 -13.098 -18.545
  478    H    GLY  64           H        GLY  64   4.490 -11.484 -15.726
  479   1HA   GLY  64          2HA       GLY  64   7.085 -11.157 -15.241
  480   2HA   GLY  64          1HA       GLY  64   7.174 -11.336 -16.993
  481    H    VAL  65           H        VAL  65   5.033  -9.549 -14.732
  482    HA   VAL  65           HA       VAL  65   5.647  -7.061 -16.269
  483    HB   VAL  65           HB       VAL  65   2.893  -7.855 -15.271
  484   1HG1  VAL  65          1HG1      VAL  65   4.095  -5.378 -16.264
  485   2HG1  VAL  65          2HG1      VAL  65   2.550  -5.627 -15.451
  486   3HG1  VAL  65          3HG1      VAL  65   2.676  -5.861 -17.194
  487   1HG2  VAL  65          1HG2      VAL  65   4.152  -7.952 -18.023
  488   2HG2  VAL  65          2HG2      VAL  65   2.406  -7.957 -17.777
  489   3HG2  VAL  65          3HG2      VAL  65   3.389  -9.275 -17.139
  490    H    GLY  66           H        GLY  66   6.547  -5.652 -14.856
  491   1HA   GLY  66          2HA       GLY  66   6.356  -5.978 -11.984
  492   2HA   GLY  66          1HA       GLY  66   7.156  -4.648 -12.822
  493    H    VAL  67           H        VAL  67   4.074  -5.817 -11.609
  494    HA   VAL  67           HA       VAL  67   2.534  -3.480 -12.356
  495    HB   VAL  67           HB       VAL  67   1.931  -5.392 -10.081
  496   1HG1  VAL  67          1HG1      VAL  67   0.639  -3.105 -10.852
  497   2HG1  VAL  67          2HG1      VAL  67  -0.149  -4.472 -10.063
  498   3HG1  VAL  67          3HG1      VAL  67  -0.200  -4.318 -11.819
  499   1HG2  VAL  67          1HG2      VAL  67   0.519  -6.026 -12.498
  500   2HG2  VAL  67          2HG2      VAL  67   1.620  -7.048 -11.578
  501   3HG2  VAL  67          3HG2      VAL  67   2.246  -6.001 -12.850
  502    H    ASN  68           H        ASN  68   2.422  -1.542 -11.338
  503    HA   ASN  68           HA       ASN  68   3.851  -1.247  -8.730
  504   1HB   ASN  68          2HB       ASN  68   3.377   0.597 -11.059
  505   2HB   ASN  68          1HB       ASN  68   3.693   1.270  -9.460
  506   1HD2  ASN  68          1HD2      ASN  68   5.843   1.055  -8.587
  507   2HD2  ASN  68          2HD2      ASN  68   7.131   0.412  -9.485
  508    HA   PRO  69           HA       PRO  69   0.091  -0.103  -6.751
  509   1HB   PRO  69          2HB       PRO  69   1.076   1.617  -4.841
  510   2HB   PRO  69          1HB       PRO  69   1.266  -0.142  -4.767
  511   1HG   PRO  69          2HG       PRO  69   3.291   1.936  -5.447
  512   2HG   PRO  69          1HG       PRO  69   3.528   0.315  -4.772
  513   1HD   PRO  69          2HD       PRO  69   3.926   1.072  -7.476
  514   2HD   PRO  69          1HD       PRO  69   3.864  -0.589  -6.850
  515    H    ALA  70           H        ALA  70  -0.188   1.153  -8.987
  516    HA   ALA  70           HA       ALA  70  -0.760   4.003  -8.308
  517   1HB   ALA  70          1HB       ALA  70   1.378   3.603  -9.729
  518   2HB   ALA  70          2HB       ALA  70   0.230   4.827 -10.271
  519   3HB   ALA  70          3HB       ALA  70   0.252   3.240 -11.039
  520    H    GLN  71           H        GLN  71  -1.712   1.087 -10.008
  521    HA   GLN  71           HA       GLN  71  -3.974   2.474 -11.334
  522   1HB   GLN  71          2HB       GLN  71  -2.909  -0.357 -11.475
  523   2HB   GLN  71          1HB       GLN  71  -4.383   0.155 -12.294
  524   1HG   GLN  71          2HG       GLN  71  -3.237   1.245 -13.917
  525   2HG   GLN  71          1HG       GLN  71  -2.105   1.951 -12.760
  526   1HE2  GLN  71          1HE2      GLN  71  -0.178   0.686 -12.189
  527   2HE2  GLN  71          2HE2      GLN  71   0.318  -0.630 -13.138
  528    HA   PRO  72           HA       PRO  72  -6.960   1.122  -8.390
  529   1HB   PRO  72          2HB       PRO  72  -9.124   0.665 -10.027
  530   2HB   PRO  72          1HB       PRO  72  -8.544   2.283  -9.592
  531   1HG   PRO  72          2HG       PRO  72  -8.245   0.810 -12.169
  532   2HG   PRO  72          1HG       PRO  72  -8.282   2.556 -11.872
  533   1HD   PRO  72          2HD       PRO  72  -5.963   1.016 -12.352
  534   2HD   PRO  72          1HD       PRO  72  -5.997   2.671 -11.708
  535    H    ALA  73           H        ALA  73  -8.008  -0.777  -7.553
  536    HA   ALA  73           HA       ALA  73  -6.850  -3.285  -8.135
  537   1HB   ALA  73          1HB       ALA  73  -9.039  -4.154  -6.971
  538   2HB   ALA  73          2HB       ALA  73  -9.350  -2.441  -6.698
  539   3HB   ALA  73          3HB       ALA  73  -7.889  -3.188  -6.049
  540    H    GLY  74           H        GLY  74  -9.893  -1.885  -9.373
  541   1HA   GLY  74          2HA       GLY  74 -10.868  -4.177 -10.741
  542   2HA   GLY  74          1HA       GLY  74 -11.226  -2.512 -11.198
  543    H    ASN  75           H        ASN  75  -8.731  -1.554 -11.917
  544    HA   ASN  75           HA       ASN  75  -8.385  -2.683 -14.551
  545   1HB   ASN  75          2HB       ASN  75  -7.892  -0.262 -13.639
  546   2HB   ASN  75          1HB       ASN  75  -6.305  -0.937 -13.266
  547   1HD2  ASN  75          1HD2      ASN  75  -4.855  -1.286 -15.018
  548   2HD2  ASN  75          2HD2      ASN  75  -5.251  -0.967 -16.637
  549    H    ILE  76           H        ILE  76  -6.561  -2.974 -11.509
  550    HA   ILE  76           HA       ILE  76  -4.293  -4.363 -12.552
  551    HB   ILE  76           HB       ILE  76  -5.596  -4.500  -9.814
  552   1HG1  ILE  76          2HG1      ILE  76  -4.700  -2.271 -10.634
  553   2HG1  ILE  76          1HG1      ILE  76  -3.943  -2.871  -9.162
  554   1HG2  ILE  76          1HG2      ILE  76  -2.986  -5.134  -9.397
  555   2HG2  ILE  76          2HG2      ILE  76  -3.240  -5.881 -10.973
  556   3HG2  ILE  76          3HG2      ILE  76  -4.255  -6.341  -9.608
  557   1HD1  ILE  76          1HD1      ILE  76  -2.327  -1.976 -10.898
  558   2HD1  ILE  76          2HD1      ILE  76  -2.788  -3.335 -11.924
  559   3HD1  ILE  76          3HD1      ILE  76  -2.006  -3.629 -10.372
  560    H    PHE  77           H        PHE  77  -7.436  -5.553 -11.353
  561    HA   PHE  77           HA       PHE  77  -6.762  -8.355 -11.725
  562   1HB   PHE  77          2HB       PHE  77  -8.577  -7.368 -10.185
  563   2HB   PHE  77          1HB       PHE  77  -9.561  -7.215 -11.640
  564    HD1  PHE  77           HD1      PHE  77  -7.849  -9.603  -9.385
  565    HD2  PHE  77           HD2      PHE  77 -10.474  -9.157 -12.755
  566    HE1  PHE  77           HE1      PHE  77  -8.457 -12.003  -9.230
  567    HE2  PHE  77           HE2      PHE  77 -11.082 -11.555 -12.598
  568    HZ   PHE  77           HZ       PHE  77 -10.073 -12.978 -10.836
  569    H    LEU  78           H        LEU  78  -8.482  -5.905 -13.661
  570    HA   LEU  78           HA       LEU  78  -9.364  -7.677 -15.741
  571   1HB   LEU  78          2HB       LEU  78  -8.848  -4.700 -15.640
  572   2HB   LEU  78          1HB       LEU  78  -9.385  -5.496 -17.120
  573    HG   LEU  78           HG       LEU  78 -10.850  -5.851 -14.500
  574   1HD1  LEU  78          1HD1      LEU  78 -12.395  -4.085 -15.253
  575   2HD1  LEU  78          2HD1      LEU  78 -11.371  -3.781 -16.656
  576   3HD1  LEU  78          3HD1      LEU  78 -10.768  -3.438 -15.035
  577   1HD2  LEU  78          1HD2      LEU  78 -12.735  -6.324 -16.124
  578   2HD2  LEU  78          2HD2      LEU  78 -11.412  -7.487 -16.191
  579   3HD2  LEU  78          3HD2      LEU  78 -11.550  -6.237 -17.428
  580    H    LYS  79           H        LYS  79  -6.315  -5.953 -15.211
  581    HA   LYS  79           HA       LYS  79  -5.287  -6.755 -17.863
  582   1HB   LYS  79          2HB       LYS  79  -4.365  -4.975 -15.649
  583   2HB   LYS  79          1HB       LYS  79  -3.152  -5.642 -16.743
  584   1HG   LYS  79          2HG       LYS  79  -5.457  -4.688 -18.227
  585   2HG   LYS  79          1HG       LYS  79  -4.781  -3.405 -17.220
  586   1HD   LYS  79          2HD       LYS  79  -2.515  -4.591 -18.241
  587   2HD   LYS  79          1HD       LYS  79  -3.644  -4.717 -19.592
  588   1HE   LYS  79          2HE       LYS  79  -3.771  -2.435 -19.874
  589   2HE   LYS  79          1HE       LYS  79  -3.575  -2.114 -18.153
  590   1HZ   LYS  79          1HZ       LYS  79  -1.455  -1.685 -18.545
  591   2HZ   LYS  79          2HZ       LYS  79  -1.619  -2.104 -20.182
  592   3HZ   LYS  79          3HZ       LYS  79  -1.214  -3.290 -19.033
  593    H    HIS  80           H        HIS  80  -4.120  -7.141 -14.492
  594    HA   HIS  80           HA       HIS  80  -2.461  -9.425 -15.354
  595   1HB   HIS  80          2HB       HIS  80  -2.716  -8.373 -12.534
  596   2HB   HIS  80          1HB       HIS  80  -1.364  -9.243 -13.258
  597    HD1  HIS  80           HD1      HIS  80  -0.267  -7.866 -15.431
  598    HD2  HIS  80           HD2      HIS  80  -2.341  -5.637 -12.583
  599    HE1  HIS  80           HE1      HIS  80   0.432  -5.455 -15.759
  600    H    GLY  81           H        GLY  81  -5.023  -8.848 -12.902
  601   1HA   GLY  81          2HA       GLY  81  -6.859 -10.453 -12.640
  602   2HA   GLY  81          1HA       GLY  81  -5.770 -11.725 -13.190
  603    H    SER  82           H        SER  82  -5.406 -13.086 -11.505
  604    HA   SER  82           HA       SER  82  -5.015 -11.905  -8.786
  605   1HB   SER  82          2HB       SER  82  -6.790 -13.830  -9.492
  606   2HB   SER  82          1HB       SER  82  -5.405 -14.834  -9.071
  607    HG   SER  82           HG       SER  82  -6.867 -14.247  -7.305
  608    H    GLU  83           H        GLU  83  -3.611 -14.136 -11.174
  609    HA   GLU  83           HA       GLU  83  -1.490 -15.153  -9.566
  610   1HB   GLU  83          2HB       GLU  83  -2.141 -15.031 -12.433
  611   2HB   GLU  83          1HB       GLU  83  -0.408 -15.056 -12.099
  612   1HG   GLU  83          2HG       GLU  83  -0.915 -17.338 -12.162
  613   2HG   GLU  83          1HG       GLU  83  -1.025 -16.989 -10.437
  614    H    LEU  84           H        LEU  84  -0.332 -13.672  -8.383
  615    HA   LEU  84           HA       LEU  84   1.323 -11.729  -9.917
  616   1HB   LEU  84          2HB       LEU  84  -0.420 -11.107  -7.522
  617   2HB   LEU  84          1HB       LEU  84   0.930 -10.078  -8.001
  618    HG   LEU  84           HG       LEU  84  -0.995 -10.851 -10.141
  619   1HD1  LEU  84          1HD1      LEU  84  -1.737  -9.356  -7.694
  620   2HD1  LEU  84          2HD1      LEU  84  -2.762 -10.206  -8.851
  621   3HD1  LEU  84          3HD1      LEU  84  -2.181  -8.581  -9.214
  622   1HD2  LEU  84          1HD2      LEU  84   0.782  -8.550  -9.404
  623   2HD2  LEU  84          2HD2      LEU  84  -0.585  -8.252 -10.476
  624   3HD2  LEU  84          3HD2      LEU  84   0.657  -9.418 -10.934
  625    H    ARG  85           H        ARG  85   3.118 -10.848  -8.446
  626    HA   ARG  85           HA       ARG  85   3.919 -12.788  -6.327
  627   1HB   ARG  85          2HB       ARG  85   5.327 -12.173  -8.884
  628   2HB   ARG  85          1HB       ARG  85   6.323 -12.352  -7.440
  629   1HG   ARG  85          2HG       ARG  85   5.964 -14.587  -7.326
  630   2HG   ARG  85          1HG       ARG  85   4.249 -14.420  -7.709
  631   1HD   ARG  85          2HD       ARG  85   4.811 -14.096 -10.091
  632   2HD   ARG  85          1HD       ARG  85   6.524 -14.270  -9.711
  633    HE   ARG  85           HE       ARG  85   4.604 -16.495  -9.167
  634   1HH1  ARG  85          2HH1      ARG  85   5.798 -16.213 -11.965
  635   2HH1  ARG  85          1HH1      ARG  85   7.161 -17.277 -11.855
  636   1HH2  ARG  85          1HH2      ARG  85   7.092 -17.425  -8.381
  637   2HH2  ARG  85          2HH2      ARG  85   7.895 -17.965  -9.817
  638    H    LEU  86           H        LEU  86   5.590 -11.895  -4.875
  639    HA   LEU  86           HA       LEU  86   5.454  -8.914  -4.774
  640   1HB   LEU  86          2HB       LEU  86   4.595 -10.374  -2.824
  641   2HB   LEU  86          1HB       LEU  86   6.297 -10.697  -2.490
  642    HG   LEU  86           HG       LEU  86   6.107  -7.910  -2.908
  643   1HD1  LEU  86          1HD1      LEU  86   3.583  -8.561  -2.389
  644   2HD1  LEU  86          2HD1      LEU  86   4.311  -7.120  -1.680
  645   3HD1  LEU  86          3HD1      LEU  86   4.174  -8.597  -0.728
  646   1HD2  LEU  86          1HD2      LEU  86   6.498  -9.716  -0.523
  647   2HD2  LEU  86          2HD2      LEU  86   6.513  -7.963  -0.343
  648   3HD2  LEU  86          3HD2      LEU  86   7.699  -8.750  -1.383
  649    H    ILE  87           H        ILE  87   7.277  -7.795  -5.160
  650    HA   ILE  87           HA       ILE  87   9.916  -9.134  -4.760
  651    HB   ILE  87           HB       ILE  87   9.441  -9.191  -7.157
  652   1HG1  ILE  87          2HG1      ILE  87  11.325  -6.863  -6.795
  653   2HG1  ILE  87          1HG1      ILE  87  11.751  -8.466  -6.198
  654   1HG2  ILE  87          1HG2      ILE  87   9.124  -7.028  -8.393
  655   2HG2  ILE  87          2HG2      ILE  87   8.952  -6.215  -6.839
  656   3HG2  ILE  87          3HG2      ILE  87   7.778  -7.436  -7.328
  657   1HD1  ILE  87          1HD1      ILE  87  12.364  -7.693  -8.684
  658   2HD1  ILE  87          2HD1      ILE  87  10.726  -8.270  -8.996
  659   3HD1  ILE  87          3HD1      ILE  87  11.932  -9.363  -8.314
  660    HA   PRO  88           HA       PRO  88  10.559  -5.386  -2.474
  661   1HB   PRO  88          2HB       PRO  88  13.193  -5.888  -1.838
  662   2HB   PRO  88          1HB       PRO  88  11.816  -6.632  -1.007
  663   1HG   PRO  88          2HG       PRO  88  13.677  -7.836  -3.006
  664   2HG   PRO  88          1HG       PRO  88  12.762  -8.621  -1.709
  665   1HD   PRO  88          2HD       PRO  88  12.066  -8.636  -4.440
  666   2HD   PRO  88          1HD       PRO  88  10.992  -9.073  -3.094
  667    H    ARG  89           H        ARG  89  10.411  -3.918  -4.279
  668    HA   ARG  89           HA       ARG  89  12.959  -3.338  -5.728
  669   1HB   ARG  89          2HB       ARG  89  10.076  -2.613  -6.321
  670   2HB   ARG  89          1HB       ARG  89  11.446  -1.976  -7.231
  671   1HG   ARG  89          2HG       ARG  89  11.347  -4.927  -6.853
  672   2HG   ARG  89          1HG       ARG  89  10.163  -4.226  -7.956
  673   1HD   ARG  89          2HD       ARG  89  13.096  -3.532  -8.128
  674   2HD   ARG  89          1HD       ARG  89  12.427  -4.928  -8.969
  675    HE   ARG  89           HE       ARG  89  12.042  -2.132  -9.714
  676   1HH1  ARG  89          1HH2      ARG  89  11.858  -5.227 -10.859
  677   2HH1  ARG  89          2HH2      ARG  89  10.412  -5.020 -11.790
  678   1HH2  ARG  89          2HH1      ARG  89   9.693  -1.884 -10.471
  679   2HH2  ARG  89          1HH1      ARG  89   9.185  -3.120 -11.572
  680    H    ASP  90           H        ASP  90  14.096  -1.892  -4.521
  681    HA   ASP  90           HA       ASP  90  12.879   0.084  -2.795
  682   1HB   ASP  90          2HB       ASP  90  15.463  -0.959  -3.226
  683   2HB   ASP  90          1HB       ASP  90  15.576   0.772  -3.539
  684    H    ARG  91           H        ARG  91  13.650   0.064  -6.190
  685    HA   ARG  91           HA       ARG  91  13.151   3.022  -6.298
  686   1HB   ARG  91          2HB       ARG  91  15.250   1.356  -7.488
  687   2HB   ARG  91          1HB       ARG  91  14.429   2.379  -8.661
  688   1HG   ARG  91          2HG       ARG  91  15.822   4.012  -7.967
  689   2HG   ARG  91          1HG       ARG  91  14.790   4.094  -6.544
  690   1HD   ARG  91          2HD       ARG  91  17.430   3.720  -6.334
  691   2HD   ARG  91          1HD       ARG  91  16.294   2.984  -5.207
  692    HE   ARG  91           HE       ARG  91  17.501   1.520  -7.521
  693   1HH1  ARG  91          2HH1      ARG  91  18.252   1.459  -4.473
  694   2HH1  ARG  91          1HH1      ARG  91  17.567  -0.067  -4.032
  695   1HH2  ARG  91          1HH2      ARG  91  15.661  -0.338  -6.921
  696   2HH2  ARG  91          2HH2      ARG  91  16.104  -1.089  -5.425
  697    H    VAL  92           H        VAL  92  12.556   3.551  -8.755
  698    HA   VAL  92           HA       VAL  92  10.106   2.012  -9.335
  699    HB   VAL  92           HB       VAL  92   9.636   3.788 -10.969
  700   1HG1  VAL  92          1HG1      VAL  92   9.381   5.617  -9.426
  701   2HG1  VAL  92          2HG1      VAL  92  10.717   5.038  -8.432
  702   3HG1  VAL  92          3HG1      VAL  92   9.207   4.128  -8.496
  703   1HG2  VAL  92          1HG2      VAL  92  11.220   5.660 -11.262
  704   2HG2  VAL  92          2HG2      VAL  92  11.967   4.138 -11.743
  705   3HG2  VAL  92          3HG2      VAL  92  12.370   4.863 -10.188
  706    H    GLY  93           H        GLY  93  13.383   2.155 -10.436
  707   1HA   GLY  93          2HA       GLY  93  12.695   0.886 -13.036
  708   2HA   GLY  93          1HA       GLY  93  14.278   1.523 -12.592
  709    H    HIS  94           HN       HIS  94  15.330   0.348 -10.680
  710    HA   HIS  94           HA       HIS  94  14.633  -2.552 -10.632
  711   1HB   HIS  94          2HB       HIS  94  16.948  -1.345 -11.888
  712   2HB   HIS  94          1HB       HIS  94  17.457  -2.394 -10.566
  713    HD1  HIS  94           HD1      HIS  94  15.336  -2.486 -13.719
  714    HD2  HIS  94           HD2      HIS  94  17.258  -5.111 -11.114
  715    HE1  HIS  94           HE1      HIS  94  15.187  -4.781 -14.776
  Start of MODEL   11
    1   1H    MET   1          1H        MET   1 -15.997   0.943 -13.128
    2   2H    MET   1          2H        MET   1 -15.498   2.260 -14.078
    3   3H    MET   1          3H        MET   1 -16.706   1.208 -14.644
    4    HA   MET   1           HA       MET   1 -17.746   3.212 -13.901
    5   1HB   MET   1          2HB       MET   1 -18.489   0.703 -13.199
    6   2HB   MET   1          1HB       MET   1 -18.351   1.436 -11.602
    7   1HG   MET   1          2HG       MET   1 -20.300   2.517 -11.906
    8   2HG   MET   1          1HG       MET   1 -19.663   3.290 -13.358
    9   1HE   MET   1          1HE       MET   1 -22.451   2.248 -15.444
   10   2HE   MET   1          2HE       MET   1 -21.004   3.238 -15.295
   11   3HE   MET   1          3HE       MET   1 -22.233   3.289 -14.034
   12    H    SER   2           H        SER   2 -16.505   1.684 -10.897
   13    HA   SER   2           HA       SER   2 -15.945   4.431  -9.876
   14   1HB   SER   2          2HB       SER   2 -15.817   3.172  -7.626
   15   2HB   SER   2          1HB       SER   2 -17.405   3.359  -8.359
   16    HG   SER   2           HG       SER   2 -16.069   1.114  -7.750
   17    H    GLY   3           H        GLY   3 -13.866   5.042  -9.832
   18   1HA   GLY   3          2HA       GLY   3 -11.559   4.762  -9.156
   19   2HA   GLY   3          1HA       GLY   3 -11.753   3.015  -9.316
   20    H    GLY   4           H        GLY   4 -12.277   2.279 -11.636
   21   1HA   GLY   4          2HA       GLY   4 -11.217   4.036 -13.758
   22   2HA   GLY   4          1HA       GLY   4 -10.274   2.584 -13.424
   23    H    THR   5           H        THR   5 -11.136   0.551 -13.968
   24    HA   THR   5           HA       THR   5 -13.445   0.659 -15.854
   25    HB   THR   5           HB       THR   5 -11.730  -1.777 -15.609
   26    HG1  THR   5           HG1      THR   5 -10.004  -0.668 -16.007
   27   1HG2  THR   5          1HG2      THR   5 -12.552  -0.380 -18.135
   28   2HG2  THR   5          2HG2      THR   5 -13.752  -1.274 -17.205
   29   3HG2  THR   5          3HG2      THR   5 -12.333  -2.106 -17.837
   30    H    ALA   6           H        ALA   6 -12.152  -1.128 -13.054
   31    HA   ALA   6           HA       ALA   6 -13.271  -2.319 -11.376
   32   1HB   ALA   6          1HB       ALA   6 -15.028  -0.402 -11.877
   33   2HB   ALA   6          2HB       ALA   6 -15.486  -1.797 -10.899
   34   3HB   ALA   6          3HB       ALA   6 -15.943  -1.723 -12.601
   35    H    ALA   7           H        ALA   7 -12.670  -4.397 -11.923
   36    HA   ALA   7           HA       ALA   7 -14.248  -5.806 -14.022
   37   1HB   ALA   7          1HB       ALA   7 -12.152  -6.455 -14.581
   38   2HB   ALA   7          2HB       ALA   7 -12.294  -7.568 -13.223
   39   3HB   ALA   7          3HB       ALA   7 -11.494  -6.010 -13.008
   40    H    THR   8           H        THR   8 -15.916  -7.005 -13.306
   41    HA   THR   8           HA       THR   8 -16.162  -7.740 -10.483
   42    HB   THR   8           HB       THR   8 -17.900  -8.488 -12.860
   43    HG1  THR   8           HG1      THR   8 -18.405  -6.463 -12.716
   44   1HG2  THR   8          1HG2      THR   8 -19.551  -8.559 -10.747
   45   2HG2  THR   8          2HG2      THR   8 -18.048  -8.982  -9.926
   46   3HG2  THR   8          3HG2      THR   8 -18.630  -9.972 -11.264
   47    H    THR   9           H        THR   9 -15.097  -9.491  -9.701
   48    HA   THR   9           HA       THR   9 -14.359 -11.690 -11.552
   49    HB   THR   9           HB       THR   9 -13.566 -11.234  -8.656
   50    HG1  THR   9           HG1      THR   9 -11.629 -10.517  -9.578
   51   1HG2  THR   9          1HG2      THR   9 -12.188 -13.084  -8.827
   52   2HG2  THR   9          2HG2      THR   9 -12.040 -12.944 -10.578
   53   3HG2  THR   9          3HG2      THR   9 -13.512 -13.605  -9.868
   54    H    ALA  10           H        ALA  10 -15.856 -11.346  -8.302
   55    HA   ALA  10           HA       ALA  10 -17.317 -13.903  -8.850
   56   1HB   ALA  10          1HB       ALA  10 -16.473 -12.721  -6.186
   57   2HB   ALA  10          2HB       ALA  10 -15.737 -14.114  -6.977
   58   3HB   ALA  10          3HB       ALA  10 -17.399 -14.208  -6.393
   59    H    GLY  11           H        GLY  11 -17.623 -10.916  -6.877
   60   1HA   GLY  11          2HA       GLY  11 -20.482 -10.768  -7.735
   61   2HA   GLY  11          1HA       GLY  11 -20.063 -10.607  -6.029
   62    H    SER  12           H        SER  12 -18.462  -8.828  -5.516
   63    HA   SER  12           HA       SER  12 -18.465  -6.594  -7.474
   64   1HB   SER  12          2HB       SER  12 -20.196  -6.740  -5.182
   65   2HB   SER  12          1HB       SER  12 -19.028  -5.448  -4.926
   66    HG   SER  12           HG       SER  12 -20.418  -4.415  -6.156
   67    H    LYS  13           H        LYS  13 -16.316  -8.279  -6.634
   68    HA   LYS  13           HA       LYS  13 -14.482  -6.234  -5.600
   69   1HB   LYS  13          2HB       LYS  13 -13.624  -7.793  -3.788
   70   2HB   LYS  13          1HB       LYS  13 -15.208  -7.092  -3.476
   71   1HG   LYS  13          2HG       LYS  13 -16.113  -9.146  -3.331
   72   2HG   LYS  13          1HG       LYS  13 -15.568  -9.518  -4.967
   73   1HD   LYS  13          2HD       LYS  13 -13.223  -9.750  -3.617
   74   2HD   LYS  13          1HD       LYS  13 -14.359 -10.241  -2.360
   75   1HE   LYS  13          2HE       LYS  13 -14.504 -12.264  -3.333
   76   2HE   LYS  13          1HE       LYS  13 -15.228 -11.495  -4.746
   77   1HZ   LYS  13          1HZ       LYS  13 -13.406 -11.948  -5.890
   78   2HZ   LYS  13          2HZ       LYS  13 -12.715 -12.701  -4.539
   79   3HZ   LYS  13          3HZ       LYS  13 -12.459 -11.045  -4.812
   80    H    VAL  14           H        VAL  14 -12.199  -7.074  -5.585
   81    HA   VAL  14           HA       VAL  14 -11.813  -9.253  -7.600
   82    HB   VAL  14           HB       VAL  14  -9.709  -7.913  -8.244
   83   1HG1  VAL  14          1HG1      VAL  14 -12.300  -6.492  -8.859
   84   2HG1  VAL  14          2HG1      VAL  14 -11.949  -8.096  -9.501
   85   3HG1  VAL  14          3HG1      VAL  14 -10.907  -6.735  -9.914
   86   1HG2  VAL  14          1HG2      VAL  14  -9.957  -6.401  -6.185
   87   2HG2  VAL  14          2HG2      VAL  14 -11.278  -5.614  -7.048
   88   3HG2  VAL  14          3HG2      VAL  14  -9.645  -5.583  -7.716
   89    H    THR  15           H        THR  15 -10.448 -10.850  -6.947
   90    HA   THR  15           HA       THR  15  -9.013 -10.466  -4.366
   91    HB   THR  15           HB       THR  15 -10.604 -12.399  -4.642
   92    HG1  THR  15           HG1      THR  15  -7.910 -13.206  -4.305
   93   1HG2  THR  15          1HG2      THR  15  -9.399 -12.703  -7.106
   94   2HG2  THR  15          2HG2      THR  15 -10.416 -13.908  -6.318
   95   3HG2  THR  15          3HG2      THR  15  -8.662 -13.996  -6.159
   96    H    PHE  16           H        PHE  16  -6.762 -10.983  -4.180
   97    HA   PHE  16           HA       PHE  16  -5.292 -11.439  -6.741
   98   1HB   PHE  16          2HB       PHE  16  -4.472  -9.378  -4.674
   99   2HB   PHE  16          1HB       PHE  16  -3.665  -9.715  -6.201
  100    HD1  PHE  16           HD1      PHE  16  -5.066  -9.432  -8.363
  101    HD2  PHE  16           HD2      PHE  16  -6.161  -7.747  -4.570
  102    HE1  PHE  16           HE1      PHE  16  -6.537  -7.803  -9.514
  103    HE2  PHE  16           HE2      PHE  16  -7.634  -6.117  -5.719
  104    HZ   PHE  16           HZ       PHE  16  -7.822  -6.145  -8.191
  105    H    LYS  17           H        LYS  17  -3.634 -12.862  -6.537
  106    HA   LYS  17           HA       LYS  17  -2.919 -13.809  -3.790
  107   1HB   LYS  17          2HB       LYS  17  -2.631 -15.197  -6.475
  108   2HB   LYS  17          1HB       LYS  17  -2.150 -15.876  -4.922
  109   1HG   LYS  17          2HG       LYS  17  -4.361 -16.125  -4.196
  110   2HG   LYS  17          1HG       LYS  17  -4.974 -14.920  -5.333
  111   1HD   LYS  17          2HD       LYS  17  -4.654 -16.390  -7.202
  112   2HD   LYS  17          1HD       LYS  17  -3.731 -17.531  -6.224
  113   1HE   LYS  17          2HE       LYS  17  -6.036 -18.336  -6.598
  114   2HE   LYS  17          1HE       LYS  17  -5.741 -18.029  -4.889
  115   1HZ   LYS  17          1HZ       LYS  17  -7.886 -17.147  -5.867
  116   2HZ   LYS  17          2HZ       LYS  17  -6.941 -15.983  -6.662
  117   3HZ   LYS  17          3HZ       LYS  17  -6.958 -16.054  -4.965
  118    H    ILE  18           H        ILE  18  -1.010 -12.938  -3.132
  119    HA   ILE  18           HA       ILE  18   1.098 -12.461  -5.204
  120    HB   ILE  18           HB       ILE  18   0.606 -10.920  -2.634
  121   1HG1  ILE  18          2HG1      ILE  18   0.446  -9.254  -4.907
  122   2HG1  ILE  18          1HG1      ILE  18  -0.503 -10.689  -5.301
  123   1HG2  ILE  18          1HG2      ILE  18   2.257  -9.357  -4.036
  124   2HG2  ILE  18          2HG2      ILE  18   2.773 -10.912  -4.688
  125   3HG2  ILE  18          3HG2      ILE  18   2.867 -10.608  -2.954
  126   1HD1  ILE  18          1HD1      ILE  18  -0.962  -8.630  -3.204
  127   2HD1  ILE  18          2HD1      ILE  18  -1.342 -10.297  -2.769
  128   3HD1  ILE  18          3HD1      ILE  18  -2.131  -9.546  -4.156
  129    H    THR  19           H        THR  19   2.800 -13.784  -4.965
  130    HA   THR  19           HA       THR  19   3.415 -14.867  -2.244
  131    HB   THR  19           HB       THR  19   2.734 -16.533  -4.029
  132    HG1  THR  19           HG1      THR  19   3.870 -17.581  -2.604
  133   1HG2  THR  19          1HG2      THR  19   3.980 -16.860  -5.948
  134   2HG2  THR  19          2HG2      THR  19   5.453 -16.206  -5.232
  135   3HG2  THR  19          3HG2      THR  19   4.170 -15.118  -5.758
  136    H    LEU  20           H        LEU  20   5.671 -14.956  -1.639
  137    HA   LEU  20           HA       LEU  20   7.219 -12.693  -2.536
  138   1HB   LEU  20          2HB       LEU  20   7.296 -14.493  -0.359
  139   2HB   LEU  20          1HB       LEU  20   8.846 -14.663  -1.183
  140    HG   LEU  20           HG       LEU  20   7.716 -11.929  -0.614
  141   1HD1  LEU  20          1HD1      LEU  20   8.108 -12.083   1.598
  142   2HD1  LEU  20          2HD1      LEU  20   9.716 -12.749   1.314
  143   3HD1  LEU  20          3HD1      LEU  20   8.319 -13.822   1.389
  144   1HD2  LEU  20          1HD2      LEU  20  10.612 -12.690  -0.523
  145   2HD2  LEU  20          2HD2      LEU  20   9.865 -11.191  -1.076
  146   3HD2  LEU  20          3HD2      LEU  20   9.821 -12.627  -2.098
  147    H    THR  21           H        THR  21   8.730 -12.562  -4.129
  148    HA   THR  21           HA       THR  21   9.213 -14.923  -5.826
  149    HB   THR  21           HB       THR  21  10.495 -13.280  -7.242
  150    HG1  THR  21           HG1      THR  21  11.095 -11.551  -6.242
  151   1HG2  THR  21          1HG2      THR  21   8.545 -12.786  -8.254
  152   2HG2  THR  21          2HG2      THR  21   8.002 -11.812  -6.888
  153   3HG2  THR  21          3HG2      THR  21   7.749 -13.557  -6.883
  154    H    SER  22           H        SER  22  11.118 -12.713  -3.770
  155    HA   SER  22           HA       SER  22  13.684 -13.852  -4.268
  156   1HB   SER  22          2HB       SER  22  12.738 -11.773  -2.729
  157   2HB   SER  22          1HB       SER  22  13.224 -12.938  -1.502
  158    HG   SER  22           HG       SER  22  14.930 -11.528  -2.206
  159    H    ASP  23           H        ASP  23  11.178 -14.683  -1.873
  160    HA   ASP  23           HA       ASP  23  12.770 -16.794  -0.649
  161   1HB   ASP  23          2HB       ASP  23   9.942 -15.825  -0.420
  162   2HB   ASP  23          1HB       ASP  23  10.337 -17.429   0.195
  163    HA   PRO  24           HA       PRO  24  11.796 -20.074  -3.405
  164   1HB   PRO  24          2HB       PRO  24  11.874 -22.196  -1.652
  165   2HB   PRO  24          1HB       PRO  24  13.317 -21.357  -2.246
  166   1HG   PRO  24          2HG       PRO  24  12.026 -21.197   0.437
  167   2HG   PRO  24          1HG       PRO  24  13.717 -20.917  -0.015
  168   1HD   PRO  24          2HD       PRO  24  11.788 -18.913   0.510
  169   2HD   PRO  24          1HD       PRO  24  13.371 -18.665  -0.257
  170    H    LYS  25           H        LYS  25   9.644 -19.733  -4.047
  171    HA   LYS  25           HA       LYS  25   7.364 -20.161  -4.236
  172   1HB   LYS  25          2HB       LYS  25   8.477 -22.515  -2.904
  173   2HB   LYS  25          1HB       LYS  25   6.787 -22.242  -2.478
  174   1HG   LYS  25          2HG       LYS  25   7.645 -22.039  -5.350
  175   2HG   LYS  25          1HG       LYS  25   7.361 -23.626  -4.633
  176   1HD   LYS  25          2HD       LYS  25   5.147 -23.341  -4.914
  177   2HD   LYS  25          1HD       LYS  25   5.204 -21.941  -3.841
  178   1HE   LYS  25          2HE       LYS  25   6.288 -21.119  -6.338
  179   2HE   LYS  25          1HE       LYS  25   4.796 -21.994  -6.684
  180   1HZ   LYS  25          1HZ       LYS  25   3.612 -20.593  -5.162
  181   2HZ   LYS  25          2HZ       LYS  25   4.453 -19.605  -6.258
  182   3HZ   LYS  25          3HZ       LYS  25   5.040 -19.816  -4.678
  183    H    LEU  26           H        LEU  26   7.411 -21.293  -0.872
  184    HA   LEU  26           HA       LEU  26   6.497 -20.376   1.075
  185   1HB   LEU  26          2HB       LEU  26   7.625 -18.117  -0.366
  186   2HB   LEU  26          1HB       LEU  26   6.192 -17.634   0.540
  187    HG   LEU  26           HG       LEU  26   7.210 -18.900   2.526
  188   1HD1  LEU  26          1HD1      LEU  26   9.084 -20.078   2.106
  189   2HD1  LEU  26          2HD1      LEU  26   9.927 -18.550   1.853
  190   3HD1  LEU  26          3HD1      LEU  26   9.204 -19.395   0.484
  191   1HD2  LEU  26          1HD2      LEU  26   8.389 -16.386   1.338
  192   2HD2  LEU  26          2HD2      LEU  26   8.889 -16.976   2.922
  193   3HD2  LEU  26          3HD2      LEU  26   7.207 -16.531   2.638
  194    HA   PRO  27           HA       PRO  27   2.190 -19.985   0.323
  195   1HB   PRO  27          2HB       PRO  27   1.368 -18.687   2.606
  196   2HB   PRO  27          1HB       PRO  27   1.847 -20.392   2.563
  197   1HG   PRO  27          2HG       PRO  27   3.350 -18.048   3.632
  198   2HG   PRO  27          1HG       PRO  27   3.447 -19.753   4.101
  199   1HD   PRO  27          2HD       PRO  27   5.290 -18.388   2.450
  200   2HD   PRO  27          1HD       PRO  27   5.175 -20.150   2.648
  201    H    PHE  28           H        PHE  28   0.919 -18.595  -0.851
  202    HA   PHE  28           HA       PHE  28   1.776 -15.789  -1.136
  203   1HB   PHE  28          2HB       PHE  28  -0.010 -15.723  -2.921
  204   2HB   PHE  28          1HB       PHE  28   1.251 -16.917  -3.200
  205    HD1  PHE  28           HD1      PHE  28  -2.246 -16.457  -2.009
  206    HD2  PHE  28           HD2      PHE  28   0.763 -19.259  -3.257
  207    HE1  PHE  28           HE1      PHE  28  -3.957 -18.250  -2.114
  208    HE2  PHE  28           HE2      PHE  28  -0.948 -21.050  -3.359
  209    HZ   PHE  28           HZ       PHE  28  -3.307 -20.547  -2.787
  210    H    LYS  29           H        LYS  29   0.315 -13.993  -0.873
  211    HA   LYS  29           HA       LYS  29  -1.664 -14.445   1.302
  212   1HB   LYS  29          2HB       LYS  29   0.008 -12.150   0.391
  213   2HB   LYS  29          1HB       LYS  29  -1.569 -11.759   1.076
  214   1HG   LYS  29          2HG       LYS  29  -0.486 -11.886   3.072
  215   2HG   LYS  29          1HG       LYS  29  -0.670 -13.628   2.862
  216   1HD   LYS  29          2HD       LYS  29   1.561 -13.381   1.466
  217   2HD   LYS  29          1HD       LYS  29   1.749 -11.912   2.426
  218   1HE   LYS  29          2HE       LYS  29   2.399 -13.117   4.209
  219   2HE   LYS  29          1HE       LYS  29   0.907 -14.057   4.148
  220   1HZ   LYS  29          1HZ       LYS  29   2.681 -15.568   3.871
  221   2HZ   LYS  29          2HZ       LYS  29   3.445 -14.591   2.711
  222   3HZ   LYS  29          3HZ       LYS  29   1.988 -15.379   2.335
  223    H    VAL  30           H        VAL  30  -3.833 -14.207   0.945
  224    HA   VAL  30           HA       VAL  30  -4.706 -13.488  -1.808
  225    HB   VAL  30           HB       VAL  30  -6.309 -14.706   0.468
  226   1HG1  VAL  30          1HG1      VAL  30  -6.861 -14.201  -2.463
  227   2HG1  VAL  30          2HG1      VAL  30  -7.813 -13.684  -1.072
  228   3HG1  VAL  30          3HG1      VAL  30  -7.774 -15.387  -1.531
  229   1HG2  VAL  30          1HG2      VAL  30  -5.535 -16.284  -1.940
  230   2HG2  VAL  30          2HG2      VAL  30  -5.720 -16.806  -0.265
  231   3HG2  VAL  30          3HG2      VAL  30  -4.258 -15.960  -0.768
  232    H    LEU  31           H        LEU  31  -5.262 -11.388  -2.084
  233    HA   LEU  31           HA       LEU  31  -6.413  -9.904   0.243
  234   1HB   LEU  31          2HB       LEU  31  -4.495  -9.183  -1.896
  235   2HB   LEU  31          1HB       LEU  31  -5.699  -7.951  -1.514
  236    HG   LEU  31           HG       LEU  31  -4.418  -9.286   0.811
  237   1HD1  LEU  31          1HD1      LEU  31  -2.786  -8.315  -1.286
  238   2HD1  LEU  31          2HD1      LEU  31  -2.286  -8.721   0.355
  239   3HD1  LEU  31          3HD1      LEU  31  -2.765  -7.070  -0.038
  240   1HD2  LEU  31          1HD2      LEU  31  -5.972  -7.545   1.279
  241   2HD2  LEU  31          2HD2      LEU  31  -5.299  -6.500   0.027
  242   3HD2  LEU  31          3HD2      LEU  31  -4.387  -6.807   1.502
  243    H    SER  32           H        SER  32  -8.588  -9.825   0.057
  244    HA   SER  32           HA       SER  32  -9.795  -9.540  -2.658
  245   1HB   SER  32          2HB       SER  32 -10.771 -10.660  -0.049
  246   2HB   SER  32          1HB       SER  32 -11.946 -10.018  -1.193
  247    HG   SER  32           HG       SER  32 -11.681 -12.113  -1.763
  248    H    VAL  33           H        VAL  33 -10.218  -7.463  -3.184
  249    HA   VAL  33           HA       VAL  33 -11.298  -5.648  -1.066
  250    HB   VAL  33           HB       VAL  33 -10.075  -3.777  -2.253
  251   1HG1  VAL  33          1HG1      VAL  33  -9.270  -4.985  -0.156
  252   2HG1  VAL  33          2HG1      VAL  33  -8.022  -4.160  -1.090
  253   3HG1  VAL  33          3HG1      VAL  33  -8.201  -5.910  -1.210
  254   1HG2  VAL  33          1HG2      VAL  33  -8.514  -4.196  -3.930
  255   2HG2  VAL  33          2HG2      VAL  33  -9.726  -5.420  -4.308
  256   3HG2  VAL  33          3HG2      VAL  33  -8.267  -5.867  -3.424
  257    HA   PRO  34           HA       PRO  34 -14.483  -4.783  -3.960
  258   1HB   PRO  34          2HB       PRO  34 -15.093  -2.190  -3.268
  259   2HB   PRO  34          1HB       PRO  34 -15.557  -3.602  -2.302
  260   1HG   PRO  34          2HG       PRO  34 -13.396  -1.605  -1.794
  261   2HG   PRO  34          1HG       PRO  34 -14.323  -2.575  -0.637
  262   1HD   PRO  34          2HD       PRO  34 -11.689  -3.117  -1.479
  263   2HD   PRO  34          1HD       PRO  34 -12.767  -4.263  -0.652
  264    H    GLU  35           H        GLU  35 -14.862  -3.757  -5.979
  265    HA   GLU  35           HA       GLU  35 -12.578  -2.791  -7.417
  266   1HB   GLU  35          2HB       GLU  35 -15.531  -2.930  -8.005
  267   2HB   GLU  35          1HB       GLU  35 -14.442  -2.095  -9.116
  268   1HG   GLU  35          2HG       GLU  35 -13.447  -4.032  -9.809
  269   2HG   GLU  35          1HG       GLU  35 -13.529  -4.765  -8.208
  270    H    SER  36           H        SER  36 -11.859  -1.065  -6.047
  271    HA   SER  36           HA       SER  36 -12.572   1.557  -6.901
  272   1HB   SER  36          2HB       SER  36 -14.374   0.555  -4.985
  273   2HB   SER  36          1HB       SER  36 -13.294   1.611  -4.081
  274    HG   SER  36           HG       SER  36 -15.039   2.765  -4.990
  275    H    THR  37           H        THR  37 -11.303  -0.427  -4.225
  276    HA   THR  37           HA       THR  37  -9.496   1.535  -3.169
  277    HB   THR  37           HB       THR  37  -8.271  -0.485  -2.246
  278    HG1  THR  37           HG1      THR  37  -8.605  -2.218  -3.370
  279   1HG2  THR  37          1HG2      THR  37 -10.288   0.661  -1.180
  280   2HG2  THR  37          2HG2      THR  37  -9.984  -0.999  -0.669
  281   3HG2  THR  37          3HG2      THR  37 -11.260  -0.657  -1.836
  282    HA   PRO  38           HA       PRO  38  -6.499   1.547  -6.418
  283   1HB   PRO  38          2HB       PRO  38  -4.565   2.953  -5.064
  284   2HB   PRO  38          1HB       PRO  38  -6.011   3.698  -5.767
  285   1HG   PRO  38          2HG       PRO  38  -5.399   3.122  -2.905
  286   2HG   PRO  38          1HG       PRO  38  -6.451   4.367  -3.599
  287   1HD   PRO  38          2HD       PRO  38  -7.308   1.935  -2.434
  288   2HD   PRO  38          1HD       PRO  38  -8.301   3.025  -3.425
  289    H    PHE  39           H        PHE  39  -4.333   0.709  -6.883
  290    HA   PHE  39           HA       PHE  39  -3.693  -1.735  -5.518
  291   1HB   PHE  39          2HB       PHE  39  -3.138  -1.008  -7.960
  292   2HB   PHE  39          1HB       PHE  39  -1.715  -0.253  -7.245
  293    HD1  PHE  39           HD1      PHE  39   0.196  -1.569  -7.467
  294    HD2  PHE  39           HD2      PHE  39  -3.573  -3.480  -6.692
  295    HE1  PHE  39           HE1      PHE  39   1.326  -3.774  -7.403
  296    HE2  PHE  39           HE2      PHE  39  -2.441  -5.685  -6.627
  297    HZ   PHE  39           HZ       PHE  39   0.008  -5.832  -6.982
  298    H    THR  40           H        THR  40  -2.834   1.566  -4.883
  299    HA   THR  40           HA       THR  40  -0.319   1.213  -3.569
  300    HB   THR  40           HB       THR  40  -1.003   3.298  -2.284
  301    HG1  THR  40           HG1      THR  40  -3.010   3.874  -2.338
  302   1HG2  THR  40          1HG2      THR  40  -1.187   3.170  -5.295
  303   2HG2  THR  40          2HG2      THR  40   0.195   3.641  -4.306
  304   3HG2  THR  40          3HG2      THR  40  -1.210   4.700  -4.417
  305    H    ALA  41           H        ALA  41  -3.672   1.005  -2.382
  306    HA   ALA  41           HA       ALA  41  -2.885   0.338   0.343
  307   1HB   ALA  41          1HB       ALA  41  -5.484   0.359  -1.181
  308   2HB   ALA  41          2HB       ALA  41  -5.014   1.327   0.214
  309   3HB   ALA  41          3HB       ALA  41  -5.393  -0.382   0.417
  310    H    VAL  42           H        VAL  42  -3.954  -1.489  -2.532
  311    HA   VAL  42           HA       VAL  42  -4.141  -4.063  -1.299
  312    HB   VAL  42           HB       VAL  42  -3.321  -3.371  -4.144
  313   1HG1  VAL  42          1HG1      VAL  42  -3.155  -5.587  -4.508
  314   2HG1  VAL  42          2HG1      VAL  42  -4.773  -5.840  -3.855
  315   3HG1  VAL  42          3HG1      VAL  42  -3.374  -5.865  -2.781
  316   1HG2  VAL  42          1HG2      VAL  42  -5.476  -2.804  -4.478
  317   2HG2  VAL  42          2HG2      VAL  42  -5.786  -3.018  -2.756
  318   3HG2  VAL  42          3HG2      VAL  42  -6.000  -4.372  -3.865
  319    H    LEU  43           H        LEU  43  -1.412  -2.546  -3.049
  320    HA   LEU  43           HA       LEU  43   0.498  -4.619  -2.579
  321   1HB   LEU  43          2HB       LEU  43   0.675  -2.631  -4.197
  322   2HB   LEU  43          1HB       LEU  43   1.163  -1.674  -2.799
  323    HG   LEU  43           HG       LEU  43   2.583  -4.247  -3.063
  324   1HD1  LEU  43          1HD1      LEU  43   3.610  -3.943  -5.073
  325   2HD1  LEU  43          2HD1      LEU  43   3.659  -2.189  -4.894
  326   3HD1  LEU  43          3HD1      LEU  43   2.184  -2.978  -5.450
  327   1HD2  LEU  43          1HD2      LEU  43   3.945  -1.597  -2.985
  328   2HD2  LEU  43          2HD2      LEU  43   4.274  -3.058  -2.053
  329   3HD2  LEU  43          3HD2      LEU  43   2.932  -2.007  -1.601
  330    H    LYS  44           H        LYS  44  -0.494  -1.816  -0.662
  331    HA   LYS  44           HA       LYS  44   1.585  -1.873   1.286
  332   1HB   LYS  44          2HB       LYS  44  -0.725  -0.374   0.846
  333   2HB   LYS  44          1HB       LYS  44  -1.029  -1.173   2.388
  334   1HG   LYS  44          2HG       LYS  44   1.367  -0.425   3.018
  335   2HG   LYS  44          1HG       LYS  44   1.239   0.670   1.643
  336   1HD   LYS  44          2HD       LYS  44   0.215   2.109   3.049
  337   2HD   LYS  44          1HD       LYS  44  -1.175   1.026   2.978
  338   1HE   LYS  44          2HE       LYS  44   0.806   0.007   4.836
  339   2HE   LYS  44          1HE       LYS  44   0.363   1.662   5.252
  340   1HZ   LYS  44          1HZ       LYS  44  -1.068  -0.551   5.885
  341   2HZ   LYS  44          2HZ       LYS  44  -1.894   0.036   4.519
  342   3HZ   LYS  44          3HZ       LYS  44  -1.669   1.036   5.874
  343    H    PHE  45           H        PHE  45  -1.645  -3.409   1.311
  344    HA   PHE  45           HA       PHE  45  -1.332  -4.757   3.815
  345   1HB   PHE  45          2HB       PHE  45  -3.145  -4.996   1.460
  346   2HB   PHE  45          1HB       PHE  45  -3.058  -6.378   2.552
  347    HD1  PHE  45           HD1      PHE  45  -4.375  -3.060   2.055
  348    HD2  PHE  45           HD2      PHE  45  -3.405  -5.978   5.052
  349    HE1  PHE  45           HE1      PHE  45  -5.844  -1.885   3.672
  350    HE2  PHE  45           HE2      PHE  45  -4.873  -4.806   6.671
  351    HZ   PHE  45           HZ       PHE  45  -6.095  -2.758   5.981
  352    H    ALA  46           H        ALA  46  -0.693  -5.838   0.462
  353    HA   ALA  46           HA       ALA  46   0.064  -8.514   1.080
  354   1HB   ALA  46          1HB       ALA  46   1.373  -8.381  -1.076
  355   2HB   ALA  46          2HB       ALA  46   0.970  -6.665  -1.146
  356   3HB   ALA  46          3HB       ALA  46  -0.310  -7.875  -1.222
  357    H    ALA  47           H        ALA  47   2.060  -5.552   0.838
  358    HA   ALA  47           HA       ALA  47   4.547  -6.837   1.506
  359   1HB   ALA  47          1HB       ALA  47   4.282  -4.549   0.444
  360   2HB   ALA  47          2HB       ALA  47   5.421  -4.608   1.789
  361   3HB   ALA  47          3HB       ALA  47   3.806  -3.946   2.031
  362    H    GLU  48           H        GLU  48   2.045  -5.224   3.460
  363    HA   GLU  48           HA       GLU  48   3.395  -5.272   5.971
  364   1HB   GLU  48          2HB       GLU  48   1.267  -4.034   5.495
  365   2HB   GLU  48          1HB       GLU  48   0.415  -5.578   5.480
  366   1HG   GLU  48          2HG       GLU  48   2.046  -5.378   7.860
  367   2HG   GLU  48          1HG       GLU  48   0.994  -3.969   7.731
  368    H    GLU  49           H        GLU  49   1.282  -7.691   4.409
  369    HA   GLU  49           HA       GLU  49   1.415  -9.586   6.593
  370   1HB   GLU  49          2HB       GLU  49   0.416  -9.583   3.786
  371   2HB   GLU  49          1HB       GLU  49   0.805 -11.156   4.485
  372   1HG   GLU  49          2HG       GLU  49  -1.347 -11.000   5.261
  373   2HG   GLU  49          1HG       GLU  49  -0.562 -10.095   6.554
  374    H    PHE  50           H        PHE  50   3.462  -8.887   3.823
  375    HA   PHE  50           HA       PHE  50   4.993 -11.390   4.101
  376   1HB   PHE  50          2HB       PHE  50   4.919  -9.099   2.207
  377   2HB   PHE  50          1HB       PHE  50   6.473  -9.905   2.402
  378    HD1  PHE  50           HD1      PHE  50   6.192 -12.625   2.551
  379    HD2  PHE  50           HD2      PHE  50   3.567  -9.911   0.502
  380    HE1  PHE  50           HE1      PHE  50   5.407 -14.477   1.100
  381    HE2  PHE  50           HE2      PHE  50   2.783 -11.763  -0.946
  382    HZ   PHE  50           HZ       PHE  50   3.703 -14.046  -0.646
  383    H    LYS  51           H        LYS  51   4.932  -8.653   5.934
  384    HA   LYS  51           HA       LYS  51   6.419  -7.712   7.468
  385   1HB   LYS  51          2HB       LYS  51   7.870 -10.266   6.761
  386   2HB   LYS  51          1HB       LYS  51   8.576  -9.089   7.869
  387   1HG   LYS  51          2HG       LYS  51   7.103  -9.580   9.534
  388   2HG   LYS  51          1HG       LYS  51   5.749  -9.756   8.417
  389   1HD   LYS  51          2HD       LYS  51   7.532 -11.880   7.844
  390   2HD   LYS  51          1HD       LYS  51   7.385 -11.813   9.599
  391   1HE   LYS  51          2HE       LYS  51   5.488 -13.023   9.249
  392   2HE   LYS  51          1HE       LYS  51   4.783 -11.455   8.855
  393   1HZ   LYS  51          1HZ       LYS  51   5.923 -12.137   6.525
  394   2HZ   LYS  51          2HZ       LYS  51   4.300 -12.442   6.920
  395   3HZ   LYS  51          3HZ       LYS  51   5.466 -13.662   7.112
  396    H    VAL  52           H        VAL  52   6.457  -6.840   4.711
  397    HA   VAL  52           HA       VAL  52   9.255  -5.802   4.589
  398    HB   VAL  52           HB       VAL  52   9.069  -5.881   2.075
  399   1HG1  VAL  52          1HG1      VAL  52  10.155  -7.667   3.618
  400   2HG1  VAL  52          2HG1      VAL  52   9.844  -8.098   1.936
  401   3HG1  VAL  52          3HG1      VAL  52   8.755  -8.656   3.206
  402   1HG2  VAL  52          1HG2      VAL  52   6.860  -7.890   2.451
  403   2HG2  VAL  52          2HG2      VAL  52   7.318  -7.001   0.999
  404   3HG2  VAL  52          3HG2      VAL  52   6.470  -6.177   2.306
  405    HA   PRO  53           HA       PRO  53   7.334  -1.879   4.159
  406   1HB   PRO  53          2HB       PRO  53   9.259  -0.558   2.707
  407   2HB   PRO  53          1HB       PRO  53   9.409  -0.941   4.429
  408   1HG   PRO  53          2HG       PRO  53  10.742  -2.238   2.094
  409   2HG   PRO  53          1HG       PRO  53  11.295  -2.110   3.772
  410   1HD   PRO  53          2HD       PRO  53  10.141  -4.400   2.589
  411   2HD   PRO  53          1HD       PRO  53  10.362  -4.129   4.331
  412    H    ALA  54           H        ALA  54   5.692  -1.278   2.837
  413    HA   ALA  54           HA       ALA  54   5.450  -2.271   0.119
  414   1HB   ALA  54          1HB       ALA  54   3.787  -0.141   1.493
  415   2HB   ALA  54          2HB       ALA  54   3.509  -1.875   1.657
  416   3HB   ALA  54          3HB       ALA  54   3.326  -1.097   0.085
  417    H    ALA  55           H        ALA  55   6.387   0.820   1.566
  418    HA   ALA  55           HA       ALA  55   6.262   2.410  -0.815
  419   1HB   ALA  55          1HB       ALA  55   8.089   2.726   1.587
  420   2HB   ALA  55          2HB       ALA  55   6.453   3.373   1.460
  421   3HB   ALA  55          3HB       ALA  55   7.723   3.974   0.394
  422    H    THR  56           H        THR  56   8.726   0.196   0.424
  423    HA   THR  56           HA       THR  56  10.488   0.930  -1.877
  424    HB   THR  56           HB       THR  56  11.912  -0.807  -0.180
  425    HG1  THR  56           HG1      THR  56  11.498  -0.204   1.811
  426   1HG2  THR  56          1HG2      THR  56  13.423   0.936  -0.115
  427   2HG2  THR  56          2HG2      THR  56  12.166   2.159   0.082
  428   3HG2  THR  56          3HG2      THR  56  12.444   1.426  -1.498
  429    H    SER  57           H        SER  57   8.080  -0.959  -1.860
  430    HA   SER  57           HA       SER  57   9.531  -3.261  -3.073
  431   1HB   SER  57          2HB       SER  57   8.053  -4.864  -2.039
  432   2HB   SER  57          1HB       SER  57   8.720  -3.855  -0.761
  433    HG   SER  57           HG       SER  57   6.314  -4.279  -0.890
  434    H    ALA  58           H        ALA  58   8.333  -4.361  -4.723
  435    HA   ALA  58           HA       ALA  58   5.931  -2.899  -5.744
  436   1HB   ALA  58          1HB       ALA  58   8.026  -2.334  -7.027
  437   2HB   ALA  58          2HB       ALA  58   6.774  -3.095  -8.008
  438   3HB   ALA  58          3HB       ALA  58   8.158  -4.039  -7.456
  439    H    ILE  59           H        ILE  59   4.819  -4.347  -7.498
  440    HA   ILE  59           HA       ILE  59   4.990  -7.213  -6.647
  441    HB   ILE  59           HB       ILE  59   2.593  -5.415  -6.925
  442   1HG1  ILE  59          2HG1      ILE  59   3.210  -7.669  -4.994
  443   2HG1  ILE  59          1HG1      ILE  59   3.701  -5.998  -4.716
  444   1HG2  ILE  59          1HG2      ILE  59   1.458  -7.892  -6.707
  445   2HG2  ILE  59          2HG2      ILE  59   2.797  -8.236  -7.799
  446   3HG2  ILE  59          3HG2      ILE  59   1.606  -7.009  -8.227
  447   1HD1  ILE  59          1HD1      ILE  59   1.384  -5.256  -4.752
  448   2HD1  ILE  59          2HD1      ILE  59   1.536  -6.584  -3.600
  449   3HD1  ILE  59          3HD1      ILE  59   0.837  -6.873  -5.194
  450    H    ILE  60           H        ILE  60   5.493  -8.489  -8.349
  451    HA   ILE  60           HA       ILE  60   5.027  -7.448 -11.099
  452    HB   ILE  60           HB       ILE  60   6.523  -9.328 -11.804
  453   1HG1  ILE  60          2HG1      ILE  60   7.549  -9.799  -9.094
  454   2HG1  ILE  60          1HG1      ILE  60   5.901 -10.385  -9.315
  455   1HG2  ILE  60          1HG2      ILE  60   8.376  -8.057 -11.428
  456   2HG2  ILE  60          2HG2      ILE  60   8.101  -7.984  -9.691
  457   3HG2  ILE  60          3HG2      ILE  60   7.208  -6.914 -10.767
  458   1HD1  ILE  60          1HD1      ILE  60   6.620 -12.118 -10.561
  459   2HD1  ILE  60          2HD1      ILE  60   8.273 -11.647 -10.165
  460   3HD1  ILE  60          3HD1      ILE  60   7.510 -11.035 -11.632
  461    H    THR  61           H        THR  61   4.435  -9.288 -12.721
  462    HA   THR  61           HA       THR  61   2.082 -10.729 -11.599
  463    HB   THR  61           HB       THR  61   2.798 -10.383 -14.525
  464    HG1  THR  61           HG1      THR  61   1.194  -8.737 -12.859
  465   1HG2  THR  61          1HG2      THR  61   0.251 -11.038 -13.025
  466   2HG2  THR  61          2HG2      THR  61   1.127 -12.081 -14.145
  467   3HG2  THR  61          3HG2      THR  61   0.297 -10.646 -14.743
  468    H    ASN  62           H        ASN  62   1.730 -12.984 -12.267
  469    HA   ASN  62           HA       ASN  62   3.976 -14.674 -11.887
  470   1HB   ASN  62          2HB       ASN  62   1.148 -14.996 -12.508
  471   2HB   ASN  62          1HB       ASN  62   2.133 -16.205 -13.332
  472   1HD2  ASN  62          1HD2      ASN  62   1.623 -14.772 -10.061
  473   2HD2  ASN  62          2HD2      ASN  62   2.059 -16.177  -9.216
  474    H    ASP  63           H        ASP  63   2.726 -13.211 -14.826
  475    HA   ASP  63           HA       ASP  63   4.214 -14.974 -16.623
  476   1HB   ASP  63          2HB       ASP  63   2.764 -12.345 -17.050
  477   2HB   ASP  63          1HB       ASP  63   3.563 -13.234 -18.346
  478    H    GLY  64           H        GLY  64   4.537 -11.543 -15.606
  479   1HA   GLY  64          2HA       GLY  64   7.118 -11.248 -14.979
  480   2HA   GLY  64          1HA       GLY  64   7.288 -11.493 -16.717
  481    H    VAL  65           H        VAL  65   5.066  -9.592 -14.634
  482    HA   VAL  65           HA       VAL  65   5.786  -7.178 -16.248
  483    HB   VAL  65           HB       VAL  65   2.995  -7.807 -15.238
  484   1HG1  VAL  65          1HG1      VAL  65   3.669  -5.398 -15.558
  485   2HG1  VAL  65          2HG1      VAL  65   2.337  -5.912 -16.591
  486   3HG1  VAL  65          3HG1      VAL  65   3.962  -5.764 -17.259
  487   1HG2  VAL  65          1HG2      VAL  65   4.156  -8.078 -18.032
  488   2HG2  VAL  65          2HG2      VAL  65   2.450  -8.251 -17.620
  489   3HG2  VAL  65          3HG2      VAL  65   3.628  -9.408 -17.001
  490    H    GLY  66           H        GLY  66   6.630  -5.669 -14.907
  491   1HA   GLY  66          2HA       GLY  66   6.448  -5.897 -12.025
  492   2HA   GLY  66          1HA       GLY  66   7.248  -4.601 -12.908
  493    H    VAL  67           H        VAL  67   4.214  -5.703 -11.579
  494    HA   VAL  67           HA       VAL  67   2.650  -3.400 -12.420
  495    HB   VAL  67           HB       VAL  67   2.039  -5.232 -10.084
  496   1HG1  VAL  67          1HG1      VAL  67   0.310  -3.626 -11.991
  497   2HG1  VAL  67          2HG1      VAL  67   0.614  -3.249 -10.295
  498   3HG1  VAL  67          3HG1      VAL  67  -0.300  -4.694 -10.727
  499   1HG2  VAL  67          1HG2      VAL  67   0.941  -6.734 -11.631
  500   2HG2  VAL  67          2HG2      VAL  67   2.594  -6.509 -12.199
  501   3HG2  VAL  67          3HG2      VAL  67   1.269  -5.656 -12.986
  502    H    ASN  68           H        ASN  68   2.465  -1.453 -11.421
  503    HA   ASN  68           HA       ASN  68   3.860  -1.090  -8.799
  504   1HB   ASN  68          2HB       ASN  68   3.453   0.787 -11.139
  505   2HB   ASN  68          1HB       ASN  68   3.979   1.351  -9.554
  506   1HD2  ASN  68          1HD2      ASN  68   5.039  -0.169 -12.493
  507   2HD2  ASN  68          2HD2      ASN  68   6.638  -0.466 -12.008
  508    HA   PRO  69           HA       PRO  69   0.059   0.273  -7.048
  509   1HB   PRO  69          2HB       PRO  69   0.997   2.089  -5.204
  510   2HB   PRO  69          1HB       PRO  69   1.153   0.335  -5.020
  511   1HG   PRO  69          2HG       PRO  69   3.240   2.338  -5.741
  512   2HG   PRO  69          1HG       PRO  69   3.423   0.761  -4.957
  513   1HD   PRO  69          2HD       PRO  69   3.946   1.336  -7.681
  514   2HD   PRO  69          1HD       PRO  69   3.824  -0.281  -6.957
  515    H    ALA  70           H        ALA  70  -0.044   1.428  -9.402
  516    HA   ALA  70           HA       ALA  70  -0.544   4.334  -8.887
  517   1HB   ALA  70          1HB       ALA  70   0.951   3.005 -11.111
  518   2HB   ALA  70          2HB       ALA  70   1.306   4.509 -10.265
  519   3HB   ALA  70          3HB       ALA  70   0.024   4.460 -11.475
  520    H    GLN  71           H        GLN  71  -1.960   1.400  -9.754
  521    HA   GLN  71           HA       GLN  71  -4.186   2.830 -11.151
  522   1HB   GLN  71          2HB       GLN  71  -4.595   0.786 -12.459
  523   2HB   GLN  71          1HB       GLN  71  -2.949   1.357 -12.714
  524   1HG   GLN  71          2HG       GLN  71  -2.484  -0.276 -10.636
  525   2HG   GLN  71          1HG       GLN  71  -3.913  -1.078 -11.289
  526   1HE2  GLN  71          1HE2      GLN  71  -0.535  -0.264 -11.957
  527   2HE2  GLN  71          2HE2      GLN  71  -0.395  -1.219 -13.353
  528    HA   PRO  72           HA       PRO  72  -6.885   1.134  -8.133
  529   1HB   PRO  72          2HB       PRO  72  -9.137   0.611  -9.624
  530   2HB   PRO  72          1HB       PRO  72  -8.621   2.239  -9.152
  531   1HG   PRO  72          2HG       PRO  72  -8.431   0.907 -11.814
  532   2HG   PRO  72          1HG       PRO  72  -8.554   2.631 -11.429
  533   1HD   PRO  72          2HD       PRO  72  -6.190   1.275 -12.157
  534   2HD   PRO  72          1HD       PRO  72  -6.274   2.887 -11.418
  535    H    ALA  73           H        ALA  73  -8.016  -0.822  -7.407
  536    HA   ALA  73           HA       ALA  73  -6.701  -3.262  -8.039
  537   1HB   ALA  73          1HB       ALA  73  -7.720  -3.753  -6.092
  538   2HB   ALA  73          2HB       ALA  73  -9.225  -3.946  -6.989
  539   3HB   ALA  73          3HB       ALA  73  -8.822  -2.388  -6.273
  540    H    GLY  74           H        GLY  74  -9.789  -1.926  -9.221
  541   1HA   GLY  74          2HA       GLY  74 -10.720  -4.209 -10.636
  542   2HA   GLY  74          1HA       GLY  74 -11.109  -2.542 -11.061
  543    H    ASN  75           H        ASN  75  -8.511  -1.597 -11.639
  544    HA   ASN  75           HA       ASN  75  -8.155  -2.565 -14.342
  545   1HB   ASN  75          2HB       ASN  75  -7.489  -0.257 -13.021
  546   2HB   ASN  75          1HB       ASN  75  -5.921  -1.056 -13.130
  547   1HD2  ASN  75          1HD2      ASN  75  -4.965  -1.307 -15.241
  548   2HD2  ASN  75          2HD2      ASN  75  -5.639  -0.610 -16.634
  549    H    ILE  76           H        ILE  76  -6.499  -3.160 -11.263
  550    HA   ILE  76           HA       ILE  76  -4.188  -4.499 -12.254
  551    HB   ILE  76           HB       ILE  76  -5.748  -4.862  -9.677
  552   1HG1  ILE  76          2HG1      ILE  76  -4.621  -2.636 -10.203
  553   2HG1  ILE  76          1HG1      ILE  76  -4.106  -3.413  -8.709
  554   1HG2  ILE  76          1HG2      ILE  76  -4.507  -6.895  -9.988
  555   2HG2  ILE  76          2HG2      ILE  76  -3.585  -5.907  -8.855
  556   3HG2  ILE  76          3HG2      ILE  76  -3.084  -6.013 -10.543
  557   1HD1  ILE  76          1HD1      ILE  76  -2.517  -2.692 -11.003
  558   2HD1  ILE  76          2HD1      ILE  76  -2.431  -4.434 -10.758
  559   3HD1  ILE  76          3HD1      ILE  76  -1.982  -3.336  -9.453
  560    H    PHE  77           H        PHE  77  -7.419  -5.761 -11.394
  561    HA   PHE  77           HA       PHE  77  -6.777  -8.508 -12.032
  562   1HB   PHE  77          2HB       PHE  77  -8.766  -7.440 -10.627
  563   2HB   PHE  77          1HB       PHE  77  -9.589  -7.491 -12.186
  564    HD1  PHE  77           HD1      PHE  77  -9.823  -9.677 -13.403
  565    HD2  PHE  77           HD2      PHE  77  -8.330  -9.439  -9.382
  566    HE1  PHE  77           HE1      PHE  77 -10.238 -12.103 -13.105
  567    HE2  PHE  77           HE2      PHE  77  -8.746 -11.865  -9.084
  568    HZ   PHE  77           HZ       PHE  77  -9.699 -13.198 -10.945
  569    H    LEU  78           H        LEU  78  -8.255  -5.833 -13.866
  570    HA   LEU  78           HA       LEU  78  -8.987  -7.403 -16.164
  571   1HB   LEU  78          2HB       LEU  78  -8.450  -4.452 -15.776
  572   2HB   LEU  78          1HB       LEU  78  -8.925  -5.124 -17.336
  573    HG   LEU  78           HG       LEU  78 -10.520  -5.758 -14.869
  574   1HD1  LEU  78          1HD1      LEU  78 -11.421  -3.521 -16.604
  575   2HD1  LEU  78          2HD1      LEU  78 -10.101  -3.169 -15.489
  576   3HD1  LEU  78          3HD1      LEU  78 -11.643  -3.762 -14.872
  577   1HD2  LEU  78          1HD2      LEU  78 -11.200  -7.065 -16.710
  578   2HD2  LEU  78          2HD2      LEU  78 -10.956  -5.745 -17.854
  579   3HD2  LEU  78          3HD2      LEU  78 -12.328  -5.710 -16.745
  580    H    LYS  79           H        LYS  79  -6.049  -5.564 -15.345
  581    HA   LYS  79           HA       LYS  79  -4.773  -6.114 -17.907
  582   1HB   LYS  79          2HB       LYS  79  -4.247  -4.498 -15.578
  583   2HB   LYS  79          1HB       LYS  79  -2.810  -5.432 -15.991
  584   1HG   LYS  79          2HG       LYS  79  -2.795  -4.581 -18.235
  585   2HG   LYS  79          1HG       LYS  79  -4.390  -3.853 -18.033
  586   1HD   LYS  79          2HD       LYS  79  -3.546  -2.023 -17.000
  587   2HD   LYS  79          1HD       LYS  79  -2.447  -2.985 -16.010
  588   1HE   LYS  79          2HE       LYS  79  -0.995  -3.281 -18.047
  589   2HE   LYS  79          1HE       LYS  79  -2.032  -2.123 -18.882
  590   1HZ   LYS  79          1HZ       LYS  79  -0.053  -1.679 -16.811
  591   2HZ   LYS  79          2HZ       LYS  79  -1.496  -0.800 -16.624
  592   3HZ   LYS  79          3HZ       LYS  79  -0.584  -0.646 -18.045
  593    H    HIS  80           H        HIS  80  -4.109  -7.227 -14.557
  594    HA   HIS  80           HA       HIS  80  -2.573  -9.502 -15.730
  595   1HB   HIS  80          2HB       HIS  80  -2.564  -8.703 -12.816
  596   2HB   HIS  80          1HB       HIS  80  -1.340  -9.603 -13.712
  597    HD1  HIS  80           HD1      HIS  80  -0.144  -8.137 -15.719
  598    HD2  HIS  80           HD2      HIS  80  -2.054  -5.977 -12.707
  599    HE1  HIS  80           HE1      HIS  80   0.713  -5.760 -15.886
  600    H    GLY  81           H        GLY  81  -4.715  -8.944 -12.893
  601   1HA   GLY  81          2HA       GLY  81  -6.837 -10.361 -12.917
  602   2HA   GLY  81          1HA       GLY  81  -5.779 -11.709 -13.330
  603    H    SER  82           H        SER  82  -5.601 -13.002 -11.576
  604    HA   SER  82           HA       SER  82  -5.395 -11.735  -8.880
  605   1HB   SER  82          2HB       SER  82  -6.035 -13.972  -8.010
  606   2HB   SER  82          1HB       SER  82  -7.246 -13.319  -9.106
  607    HG   SER  82           HG       SER  82  -6.938 -15.316  -9.869
  608    H    GLU  83           H        GLU  83  -3.793 -14.008 -11.087
  609    HA   GLU  83           HA       GLU  83  -1.793 -14.917  -9.239
  610   1HB   GLU  83          2HB       GLU  83  -2.225 -15.031 -12.166
  611   2HB   GLU  83          1HB       GLU  83  -0.542 -15.129 -11.650
  612   1HG   GLU  83          2HG       GLU  83  -1.358 -17.381 -11.683
  613   2HG   GLU  83          1HG       GLU  83  -1.277 -16.911  -9.986
  614    H    LEU  84           H        LEU  84  -0.540 -13.475  -8.179
  615    HA   LEU  84           HA       LEU  84   1.062 -11.551  -9.796
  616   1HB   LEU  84          2HB       LEU  84  -0.618 -10.929  -7.362
  617   2HB   LEU  84          1HB       LEU  84   0.753  -9.920  -7.819
  618    HG   LEU  84           HG       LEU  84  -1.277 -10.623  -9.911
  619   1HD1  LEU  84          1HD1      LEU  84  -2.764  -9.873  -8.221
  620   2HD1  LEU  84          2HD1      LEU  84  -2.451  -8.442  -9.203
  621   3HD1  LEU  84          3HD1      LEU  84  -1.631  -8.647  -7.655
  622   1HD2  LEU  84          1HD2      LEU  84   1.032  -9.095  -9.847
  623   2HD2  LEU  84          2HD2      LEU  84  -0.236  -7.884  -9.663
  624   3HD2  LEU  84          3HD2      LEU  84  -0.240  -8.959 -11.060
  625    H    ARG  85           H        ARG  85   2.879 -10.627  -8.315
  626    HA   ARG  85           HA       ARG  85   3.770 -12.590  -6.263
  627   1HB   ARG  85          2HB       ARG  85   4.975 -12.130  -8.924
  628   2HB   ARG  85          1HB       ARG  85   6.116 -12.114  -7.579
  629   1HG   ARG  85          2HG       ARG  85   5.890 -14.339  -7.211
  630   2HG   ARG  85          1HG       ARG  85   4.139 -14.286  -7.423
  631   1HD   ARG  85          2HD       ARG  85   4.329 -14.379  -9.804
  632   2HD   ARG  85          1HD       ARG  85   6.068 -14.081  -9.743
  633    HE   ARG  85           HE       ARG  85   4.758 -16.623  -8.874
  634   1HH1  ARG  85          1HH2      ARG  85   7.533 -15.797  -7.779
  635   2HH1  ARG  85          2HH2      ARG  85   8.568 -16.687  -8.844
  636   1HH2  ARG  85          2HH1      ARG  85   6.067 -17.332 -11.168
  637   2HH2  ARG  85          1HH1      ARG  85   7.736 -17.559 -10.766
  638    H    LEU  86           H        LEU  86   5.333 -11.704  -4.786
  639    HA   LEU  86           HA       LEU  86   5.374  -8.725  -4.790
  640   1HB   LEU  86          2HB       LEU  86   4.505 -10.113  -2.781
  641   2HB   LEU  86          1HB       LEU  86   6.205 -10.462  -2.471
  642    HG   LEU  86           HG       LEU  86   6.079  -7.691  -2.979
  643   1HD1  LEU  86          1HD1      LEU  86   3.618  -7.891  -2.581
  644   2HD1  LEU  86          2HD1      LEU  86   4.427  -6.884  -1.380
  645   3HD1  LEU  86          3HD1      LEU  86   3.962  -8.537  -0.977
  646   1HD2  LEU  86          1HD2      LEU  86   7.622  -8.793  -1.430
  647   2HD2  LEU  86          2HD2      LEU  86   6.280  -9.248  -0.380
  648   3HD2  LEU  86          3HD2      LEU  86   6.712  -7.549  -0.573
  649    H    ILE  87           H        ILE  87   7.197  -7.841  -5.567
  650    HA   ILE  87           HA       ILE  87   9.782  -9.278  -5.127
  651    HB   ILE  87           HB       ILE  87   9.170  -9.135  -7.516
  652   1HG1  ILE  87          2HG1      ILE  87  11.387  -7.153  -6.929
  653   2HG1  ILE  87          1HG1      ILE  87  11.571  -8.891  -6.686
  654   1HG2  ILE  87          1HG2      ILE  87   8.490  -6.397  -6.740
  655   2HG2  ILE  87          2HG2      ILE  87   7.977  -7.321  -8.145
  656   3HG2  ILE  87          3HG2      ILE  87   9.508  -6.451  -8.175
  657   1HD1  ILE  87          1HD1      ILE  87  10.844  -7.547  -9.305
  658   2HD1  ILE  87          2HD1      ILE  87  11.016  -9.285  -9.059
  659   3HD1  ILE  87          3HD1      ILE  87  12.419  -8.228  -8.901
  660    HA   PRO  88           HA       PRO  88  10.835  -5.707  -2.731
  661   1HB   PRO  88          2HB       PRO  88  13.486  -6.363  -2.380
  662   2HB   PRO  88          1HB       PRO  88  12.163  -7.096  -1.460
  663   1HG   PRO  88          2HG       PRO  88  13.775  -8.252  -3.688
  664   2HG   PRO  88          1HG       PRO  88  12.939  -9.077  -2.361
  665   1HD   PRO  88          2HD       PRO  88  12.010  -8.884  -5.018
  666   2HD   PRO  88          1HD       PRO  88  11.040  -9.369  -3.611
  667    H    ARG  89           H        ARG  89  10.501  -4.412  -4.785
  668    HA   ARG  89           HA       ARG  89  12.884  -3.824  -6.414
  669   1HB   ARG  89          2HB       ARG  89   9.987  -3.256  -6.533
  670   2HB   ARG  89          1HB       ARG  89  11.004  -1.926  -7.084
  671   1HG   ARG  89          2HG       ARG  89  12.250  -3.898  -8.382
  672   2HG   ARG  89          1HG       ARG  89  10.664  -4.660  -8.241
  673   1HD   ARG  89          2HD       ARG  89   9.912  -2.178  -9.014
  674   2HD   ARG  89          1HD       ARG  89  11.485  -2.269  -9.802
  675    HE   ARG  89           HE       ARG  89  10.661  -4.289 -10.996
  676   1HH1  ARG  89          2HH1      ARG  89   8.890  -2.113 -11.938
  677   2HH1  ARG  89          1HH1      ARG  89   7.304  -2.755 -11.664
  678   1HH2  ARG  89          1HH2      ARG  89   8.393  -5.230  -9.486
  679   2HH2  ARG  89          2HH2      ARG  89   7.024  -4.523 -10.273
  680    H    ASP  90           H        ASP  90  14.391  -2.725  -5.175
  681    HA   ASP  90           HA       ASP  90  13.715   0.016  -4.310
  682   1HB   ASP  90          2HB       ASP  90  14.520  -0.300  -2.014
  683   2HB   ASP  90          1HB       ASP  90  13.172  -1.391  -2.323
  684    H    ARG  91           H        ARG  91  15.845   0.998  -3.282
  685    HA   ARG  91           HA       ARG  91  17.993   0.539  -5.226
  686   1HB   ARG  91          2HB       ARG  91  17.331   2.590  -3.166
  687   2HB   ARG  91          1HB       ARG  91  19.045   2.361  -3.521
  688   1HG   ARG  91          2HG       ARG  91  17.337   2.474  -5.919
  689   2HG   ARG  91          1HG       ARG  91  17.345   3.963  -4.976
  690   1HD   ARG  91          2HD       ARG  91  19.238   4.428  -6.137
  691   2HD   ARG  91          1HD       ARG  91  20.012   3.339  -4.985
  692    HE   ARG  91           HE       ARG  91  19.000   2.438  -7.657
  693   1HH1  ARG  91          1HH2      ARG  91  20.331   1.171  -4.898
  694   2HH1  ARG  91          2HH2      ARG  91  21.715   0.463  -5.657
  695   1HH2  ARG  91          2HH1      ARG  91  21.187   2.060  -8.692
  696   2HH2  ARG  91          1HH1      ARG  91  22.206   0.972  -7.809
  697    H    VAL  92           H        VAL  92  18.040   0.799  -1.635
  698    HA   VAL  92           HA       VAL  92  19.990  -1.471  -1.626
  699    HB   VAL  92           HB       VAL  92  21.289   0.528  -1.246
  700   1HG1  VAL  92          1HG1      VAL  92  20.567   1.910   0.884
  701   2HG1  VAL  92          2HG1      VAL  92  18.974   1.243   0.534
  702   3HG1  VAL  92          3HG1      VAL  92  19.798   2.233  -0.669
  703   1HG2  VAL  92          1HG2      VAL  92  20.644  -0.746   1.436
  704   2HG2  VAL  92          2HG2      VAL  92  22.118   0.135   1.038
  705   3HG2  VAL  92          3HG2      VAL  92  21.772  -1.406   0.252
  706    H    GLY  93           H        GLY  93  19.963  -2.772   0.279
  707   1HA   GLY  93          2HA       GLY  93  19.024  -3.015   2.615
  708   2HA   GLY  93          1HA       GLY  93  17.477  -2.517   1.923
  709    H    HIS  94           HN       HIS  94  16.584  -3.927   0.199
  710    HA   HIS  94           HA       HIS  94  17.626  -6.606  -0.176
  711   1HB   HIS  94          2HB       HIS  94  15.704  -7.767   0.980
  712   2HB   HIS  94          1HB       HIS  94  16.808  -6.953   2.087
  713    HD1  HIS  94           HD1      HIS  94  15.990  -4.466   2.894
  714    HD2  HIS  94           HD2      HIS  94  13.061  -6.887   1.172
  715    HE1  HIS  94           HE1      HIS  94  13.760  -3.431   3.491
  Start of MODEL   12
    1   1H    MET   1          1H        MET   1 -37.913  -0.624 -23.781
    2   2H    MET   1          2H        MET   1 -38.080   0.974 -24.332
    3   3H    MET   1          3H        MET   1 -39.110  -0.243 -24.919
    4    HA   MET   1           HA       MET   1 -40.363   0.993 -23.370
    5   1HB   MET   1          2HB       MET   1 -40.835  -0.714 -21.635
    6   2HB   MET   1          1HB       MET   1 -40.682  -1.435 -23.233
    7   1HG   MET   1          2HG       MET   1 -38.651  -2.452 -22.727
    8   2HG   MET   1          1HG       MET   1 -38.246  -1.267 -21.491
    9   1HE   MET   1          1HE       MET   1 -38.750  -3.092 -18.457
   10   2HE   MET   1          2HE       MET   1 -38.283  -1.604 -19.280
   11   3HE   MET   1          3HE       MET   1 -37.516  -3.127 -19.724
   12    H    SER   2           H        SER   2 -37.164   0.136 -22.094
   13    HA   SER   2           HA       SER   2 -37.552   2.093 -19.877
   14   1HB   SER   2          2HB       SER   2 -36.340  -0.468 -19.971
   15   2HB   SER   2          1HB       SER   2 -35.032   0.691 -19.750
   16    HG   SER   2           HG       SER   2 -35.890   0.149 -17.748
   17    H    GLY   3           H        GLY   3 -35.340   1.257 -22.561
   18   1HA   GLY   3          2HA       GLY   3 -34.157   2.815 -23.923
   19   2HA   GLY   3          1HA       GLY   3 -34.575   4.095 -22.786
   20    H    GLY   4           H        GLY   4 -33.350   4.200 -20.763
   21   1HA   GLY   4          2HA       GLY   4 -30.598   3.080 -21.085
   22   2HA   GLY   4          1HA       GLY   4 -30.969   4.586 -20.248
   23    H    THR   5           H        THR   5 -30.930   1.102 -19.993
   24    HA   THR   5           HA       THR   5 -31.961   1.186 -17.212
   25    HB   THR   5           HB       THR   5 -31.088  -1.141 -18.962
   26    HG1  THR   5           HG1      THR   5 -32.995  -0.733 -19.747
   27   1HG2  THR   5          1HG2      THR   5 -32.784  -1.549 -16.561
   28   2HG2  THR   5          2HG2      THR   5 -31.092  -1.160 -16.256
   29   3HG2  THR   5          3HG2      THR   5 -31.512  -2.570 -17.231
   30    H    ALA   6           H        ALA   6 -30.484   1.639 -15.638
   31    HA   ALA   6           HA       ALA   6 -27.603   1.201 -16.141
   32   1HB   ALA   6          1HB       ALA   6 -28.626   2.209 -13.520
   33   2HB   ALA   6          2HB       ALA   6 -28.828   3.243 -14.936
   34   3HB   ALA   6          3HB       ALA   6 -27.216   2.723 -14.446
   35    H    ALA   7           H        ALA   7 -26.476  -0.504 -15.311
   36    HA   ALA   7           HA       ALA   7 -27.892  -2.590 -13.840
   37   1HB   ALA   7          1HB       ALA   7 -25.049  -2.248 -14.801
   38   2HB   ALA   7          2HB       ALA   7 -26.270  -3.382 -15.380
   39   3HB   ALA   7          3HB       ALA   7 -25.527  -3.618 -13.797
   40    H    THR   8           H        THR   8 -28.100  -2.641 -11.658
   41    HA   THR   8           HA       THR   8 -26.476  -0.819  -9.990
   42    HB   THR   8           HB       THR   8 -28.769  -2.671  -9.251
   43    HG1  THR   8           HG1      THR   8 -29.825  -1.150 -10.236
   44   1HG2  THR   8          1HG2      THR   8 -27.296  -2.137  -7.342
   45   2HG2  THR   8          2HG2      THR   8 -28.864  -1.346  -7.178
   46   3HG2  THR   8          3HG2      THR   8 -27.459  -0.418  -7.701
   47    H    THR   9           H        THR   9 -24.607  -1.541  -9.087
   48    HA   THR   9           HA       THR   9 -24.076  -4.450  -8.947
   49    HB   THR   9           HB       THR   9 -22.249  -2.122  -8.266
   50    HG1  THR   9           HG1      THR   9 -22.369  -1.885 -10.356
   51   1HG2  THR   9          1HG2      THR   9 -21.486  -4.189  -7.259
   52   2HG2  THR   9          2HG2      THR   9 -20.475  -3.854  -8.664
   53   3HG2  THR   9          3HG2      THR   9 -21.749  -5.068  -8.765
   54    H    ALA  10           H        ALA  10 -24.404  -5.570  -7.089
   55    HA   ALA  10           HA       ALA  10 -25.158  -4.190  -4.629
   56   1HB   ALA  10          1HB       ALA  10 -25.312  -6.519  -3.702
   57   2HB   ALA  10          2HB       ALA  10 -24.717  -7.127  -5.248
   58   3HB   ALA  10          3HB       ALA  10 -26.264  -6.284  -5.168
   59    H    GLY  11           H        GLY  11 -22.399  -6.280  -5.601
   60   1HA   GLY  11          2HA       GLY  11 -20.541  -4.760  -3.992
   61   2HA   GLY  11          1HA       GLY  11 -20.959  -6.277  -3.196
   62    H    SER  12           H        SER  12 -19.601  -4.927  -6.202
   63    HA   SER  12           HA       SER  12 -18.528  -7.592  -6.942
   64   1HB   SER  12          2HB       SER  12 -17.750  -6.436  -9.007
   65   2HB   SER  12          1HB       SER  12 -19.483  -6.255  -8.757
   66    HG   SER  12           HG       SER  12 -17.815  -4.344  -9.153
   67    H    LYS  13           H        LYS  13 -16.503  -8.186  -6.338
   68    HA   LYS  13           HA       LYS  13 -14.490  -6.046  -5.810
   69   1HB   LYS  13          2HB       LYS  13 -14.974  -8.462  -4.038
   70   2HB   LYS  13          1HB       LYS  13 -13.735  -7.230  -3.799
   71   1HG   LYS  13          2HG       LYS  13 -15.420  -5.513  -3.473
   72   2HG   LYS  13          1HG       LYS  13 -16.709  -6.643  -3.879
   73   1HD   LYS  13          2HD       LYS  13 -16.350  -7.921  -1.891
   74   2HD   LYS  13          1HD       LYS  13 -14.817  -7.112  -1.565
   75   1HE   LYS  13          2HE       LYS  13 -16.149  -4.943  -1.375
   76   2HE   LYS  13          1HE       LYS  13 -17.603  -5.940  -1.385
   77   1HZ   LYS  13          1HZ       LYS  13 -16.330  -5.285   0.834
   78   2HZ   LYS  13          2HZ       LYS  13 -15.491  -6.719   0.471
   79   3HZ   LYS  13          3HZ       LYS  13 -17.178  -6.742   0.666
   80    H    VAL  14           H        VAL  14 -12.262  -6.802  -5.945
   81    HA   VAL  14           HA       VAL  14 -11.971  -9.194  -7.719
   82    HB   VAL  14           HB       VAL  14  -9.821  -8.033  -8.459
   83   1HG1  VAL  14          1HG1      VAL  14 -12.424  -7.795  -9.349
   84   2HG1  VAL  14          2HG1      VAL  14 -11.001  -7.213 -10.213
   85   3HG1  VAL  14          3HG1      VAL  14 -11.922  -6.112  -9.189
   86   1HG2  VAL  14          1HG2      VAL  14  -9.410  -5.799  -7.887
   87   2HG2  VAL  14          2HG2      VAL  14  -9.994  -6.462  -6.362
   88   3HG2  VAL  14          3HG2      VAL  14 -11.075  -5.516  -7.384
   89    H    THR  15           H        THR  15 -10.515 -10.770  -7.132
   90    HA   THR  15           HA       THR  15  -9.237 -10.488  -4.455
   91    HB   THR  15           HB       THR  15  -8.825 -13.089  -5.085
   92    HG1  THR  15           HG1      THR  15 -10.401 -13.860  -6.352
   93   1HG2  THR  15          1HG2      THR  15 -11.575 -12.736  -4.202
   94   2HG2  THR  15          2HG2      THR  15 -10.477 -11.627  -3.379
   95   3HG2  THR  15          3HG2      THR  15 -10.186 -13.366  -3.316
   96    H    PHE  16           H        PHE  16  -7.004 -10.939  -4.170
   97    HA   PHE  16           HA       PHE  16  -5.393 -11.217  -6.669
   98   1HB   PHE  16          2HB       PHE  16  -4.843  -9.276  -4.402
   99   2HB   PHE  16          1HB       PHE  16  -3.775  -9.563  -5.773
  100    HD1  PHE  16           HD1      PHE  16  -4.866  -9.289  -8.155
  101    HD2  PHE  16           HD2      PHE  16  -6.463  -7.583  -4.548
  102    HE1  PHE  16           HE1      PHE  16  -6.139  -7.639  -9.498
  103    HE2  PHE  16           HE2      PHE  16  -7.734  -5.934  -5.895
  104    HZ   PHE  16           HZ       PHE  16  -7.573  -5.963  -8.367
  105    H    LYS  17           H        LYS  17  -3.595 -12.512  -6.459
  106    HA   LYS  17           HA       LYS  17  -3.078 -13.700  -3.759
  107   1HB   LYS  17          2HB       LYS  17  -3.173 -14.943  -6.501
  108   2HB   LYS  17          1HB       LYS  17  -2.150 -15.653  -5.253
  109   1HG   LYS  17          2HG       LYS  17  -3.966 -16.700  -4.437
  110   2HG   LYS  17          1HG       LYS  17  -4.623 -15.122  -4.002
  111   1HD   LYS  17          2HD       LYS  17  -5.682 -14.911  -6.186
  112   2HD   LYS  17          1HD       LYS  17  -4.943 -16.418  -6.724
  113   1HE   LYS  17          2HE       LYS  17  -6.266 -17.727  -5.266
  114   2HE   LYS  17          1HE       LYS  17  -6.708 -16.335  -4.279
  115   1HZ   LYS  17          1HZ       LYS  17  -7.755 -15.486  -6.463
  116   2HZ   LYS  17          2HZ       LYS  17  -8.577 -16.665  -5.558
  117   3HZ   LYS  17          3HZ       LYS  17  -7.698 -17.112  -6.942
  118    H    ILE  18           H        ILE  18  -1.311 -12.524  -3.115
  119    HA   ILE  18           HA       ILE  18   0.884 -12.056  -5.062
  120    HB   ILE  18           HB       ILE  18   0.466 -10.986  -2.249
  121   1HG1  ILE  18          2HG1      ILE  18   0.349  -8.856  -3.972
  122   2HG1  ILE  18          1HG1      ILE  18  -0.415 -10.119  -4.938
  123   1HG2  ILE  18          1HG2      ILE  18   2.865 -11.209  -3.240
  124   2HG2  ILE  18          2HG2      ILE  18   2.375  -9.655  -2.568
  125   3HG2  ILE  18          3HG2      ILE  18   2.371  -9.900  -4.314
  126   1HD1  ILE  18          1HD1      ILE  18  -2.132 -10.454  -3.370
  127   2HD1  ILE  18          2HD1      ILE  18  -1.905  -8.706  -3.329
  128   3HD1  ILE  18          3HD1      ILE  18  -1.210  -9.715  -2.061
  129    H    THR  19           H        THR  19   2.632 -13.360  -5.050
  130    HA   THR  19           HA       THR  19   3.241 -14.919  -2.566
  131    HB   THR  19           HB       THR  19   3.746 -15.849  -5.414
  132    HG1  THR  19           HG1      THR  19   1.726 -16.369  -5.402
  133   1HG2  THR  19          1HG2      THR  19   4.770 -17.644  -4.487
  134   2HG2  THR  19          2HG2      THR  19   3.541 -17.803  -3.233
  135   3HG2  THR  19          3HG2      THR  19   4.872 -16.665  -3.025
  136    H    LEU  20           H        LEU  20   5.239 -14.449  -1.763
  137    HA   LEU  20           HA       LEU  20   6.971 -12.515  -2.870
  138   1HB   LEU  20          2HB       LEU  20   6.881 -13.915  -0.506
  139   2HB   LEU  20          1HB       LEU  20   8.335 -14.570  -1.258
  140    HG   LEU  20           HG       LEU  20   8.190 -11.685  -1.593
  141   1HD1  LEU  20          1HD1      LEU  20   8.860 -11.588   1.039
  142   2HD1  LEU  20          2HD1      LEU  20   7.603 -12.825   1.079
  143   3HD1  LEU  20          3HD1      LEU  20   7.245 -11.224   0.432
  144   1HD2  LEU  20          1HD2      LEU  20  10.388 -12.279  -0.033
  145   2HD2  LEU  20          2HD2      LEU  20  10.356 -12.336  -1.796
  146   3HD2  LEU  20          3HD2      LEU  20  10.092 -13.807  -0.861
  147    H    THR  21           H        THR  21   8.683 -12.594  -4.284
  148    HA   THR  21           HA       THR  21   8.877 -14.734  -6.168
  149    HB   THR  21           HB       THR  21  11.069 -13.549  -6.814
  150    HG1  THR  21           HG1      THR  21  11.735 -12.008  -5.566
  151   1HG2  THR  21          1HG2      THR  21   9.693 -11.380  -7.399
  152   2HG2  THR  21          2HG2      THR  21   8.338 -12.305  -6.751
  153   3HG2  THR  21          3HG2      THR  21   9.251 -12.925  -8.127
  154    H    SER  22           H        SER  22  10.961 -13.877  -3.385
  155    HA   SER  22           HA       SER  22  12.864 -15.996  -3.779
  156   1HB   SER  22          2HB       SER  22  12.129 -14.173  -1.532
  157   2HB   SER  22          1HB       SER  22  13.046 -15.622  -1.133
  158    HG   SER  22           HG       SER  22  14.177 -13.556  -1.821
  159    H    ASP  23           H        ASP  23   9.898 -15.775  -1.804
  160    HA   ASP  23           HA       ASP  23  10.118 -18.459  -0.734
  161   1HB   ASP  23          2HB       ASP  23   7.941 -16.382  -0.857
  162   2HB   ASP  23          1HB       ASP  23   7.558 -18.021  -0.337
  163    HA   PRO  24           HA       PRO  24   8.392 -20.787  -4.052
  164   1HB   PRO  24          2HB       PRO  24   7.092 -22.759  -2.637
  165   2HB   PRO  24          1HB       PRO  24   8.851 -22.684  -2.829
  166   1HG   PRO  24          2HG       PRO  24   7.193 -22.021  -0.439
  167   2HG   PRO  24          1HG       PRO  24   8.870 -22.585  -0.520
  168   1HD   PRO  24          2HD       PRO  24   8.052 -19.921  -0.072
  169   2HD   PRO  24          1HD       PRO  24   9.690 -20.443  -0.518
  170    H    LYS  25           H        LYS  25   6.014 -22.124  -4.313
  171    HA   LYS  25           HA       LYS  25   4.068 -19.927  -4.474
  172   1HB   LYS  25          2HB       LYS  25   4.401 -22.618  -5.652
  173   2HB   LYS  25          1HB       LYS  25   2.729 -22.132  -5.367
  174   1HG   LYS  25          2HG       LYS  25   3.267 -19.950  -6.534
  175   2HG   LYS  25          1HG       LYS  25   4.823 -20.650  -6.980
  176   1HD   LYS  25          2HD       LYS  25   3.895 -21.859  -8.646
  177   2HD   LYS  25          1HD       LYS  25   2.618 -22.459  -7.590
  178   1HE   LYS  25          2HE       LYS  25   1.605 -21.160  -9.387
  179   2HE   LYS  25          1HE       LYS  25   1.416 -20.286  -7.871
  180   1HZ   LYS  25          1HZ       LYS  25   2.873 -18.689  -8.500
  181   2HZ   LYS  25          2HZ       LYS  25   2.345 -19.143 -10.047
  182   3HZ   LYS  25          3HZ       LYS  25   3.819 -19.734  -9.441
  183    H    LEU  26           H        LEU  26   4.588 -22.748  -2.437
  184    HA   LEU  26           HA       LEU  26   2.005 -23.225  -1.448
  185   1HB   LEU  26          2HB       LEU  26   4.735 -23.729  -0.531
  186   2HB   LEU  26          1HB       LEU  26   3.609 -23.488   0.806
  187    HG   LEU  26           HG       LEU  26   2.327 -25.109  -1.180
  188   1HD1  LEU  26          1HD1      LEU  26   4.729 -25.591  -1.822
  189   2HD1  LEU  26          2HD1      LEU  26   3.801 -27.003  -1.320
  190   3HD1  LEU  26          3HD1      LEU  26   4.954 -26.263  -0.208
  191   1HD2  LEU  26          1HD2      LEU  26   1.804 -26.413   0.672
  192   2HD2  LEU  26          2HD2      LEU  26   2.208 -24.891   1.465
  193   3HD2  LEU  26          3HD2      LEU  26   3.394 -26.195   1.404
  194    HA   PRO  27           HA       PRO  27   2.489 -19.782   1.814
  195   1HB   PRO  27          2HB       PRO  27   4.790 -18.278   1.815
  196   2HB   PRO  27          1HB       PRO  27   4.607 -19.787   2.726
  197   1HG   PRO  27          2HG       PRO  27   6.144 -19.283   0.225
  198   2HG   PRO  27          1HG       PRO  27   6.390 -20.527   1.461
  199   1HD   PRO  27          2HD       PRO  27   5.149 -20.893  -1.067
  200   2HD   PRO  27          1HD       PRO  27   5.165 -22.051   0.279
  201    H    PHE  28           H        PHE  28   0.974 -18.402   0.893
  202    HA   PHE  28           HA       PHE  28   1.975 -16.127  -0.711
  203   1HB   PHE  28          2HB       PHE  28   0.277 -16.394  -2.460
  204   2HB   PHE  28          1HB       PHE  28   1.313 -17.817  -2.401
  205    HD1  PHE  28           HD1      PHE  28   0.472 -19.962  -1.614
  206    HD2  PHE  28           HD2      PHE  28  -2.047 -16.484  -1.646
  207    HE1  PHE  28           HE1      PHE  28  -1.517 -21.400  -1.265
  208    HE2  PHE  28           HE2      PHE  28  -4.035 -17.923  -1.297
  209    HZ   PHE  28           HZ       PHE  28  -3.771 -20.380  -1.106
  210    H    LYS  29           H        LYS  29   0.358 -14.363  -0.836
  211    HA   LYS  29           HA       LYS  29  -1.527 -14.464   1.487
  212   1HB   LYS  29          2HB       LYS  29   0.400 -12.459   0.534
  213   2HB   LYS  29          1HB       LYS  29  -1.196 -11.789   0.876
  214   1HG   LYS  29          2HG       LYS  29  -0.392 -11.699   3.013
  215   2HG   LYS  29          1HG       LYS  29  -0.886 -13.390   3.043
  216   1HD   LYS  29          2HD       LYS  29   1.505 -13.817   2.039
  217   2HD   LYS  29          1HD       LYS  29   1.869 -12.232   2.721
  218   1HE   LYS  29          2HE       LYS  29   2.071 -13.144   4.766
  219   2HE   LYS  29          1HE       LYS  29   0.417 -13.744   4.676
  220   1HZ   LYS  29          1HZ       LYS  29   2.887 -15.093   3.744
  221   2HZ   LYS  29          2HZ       LYS  29   1.327 -15.630   3.330
  222   3HZ   LYS  29          3HZ       LYS  29   1.818 -15.607   4.957
  223    H    VAL  30           H        VAL  30  -3.661 -13.924   1.162
  224    HA   VAL  30           HA       VAL  30  -4.495 -13.345  -1.651
  225    HB   VAL  30           HB       VAL  30  -6.134 -14.502   0.631
  226   1HG1  VAL  30          1HG1      VAL  30  -7.692 -13.523  -0.816
  227   2HG1  VAL  30          2HG1      VAL  30  -7.562 -15.154  -1.475
  228   3HG1  VAL  30          3HG1      VAL  30  -6.701 -13.820  -2.244
  229   1HG2  VAL  30          1HG2      VAL  30  -6.000 -16.570  -0.927
  230   2HG2  VAL  30          2HG2      VAL  30  -4.577 -16.188   0.044
  231   3HG2  VAL  30          3HG2      VAL  30  -4.621 -15.754  -1.665
  232    H    LEU  31           H        LEU  31  -5.317 -11.345  -2.043
  233    HA   LEU  31           HA       LEU  31  -6.260  -9.730   0.297
  234   1HB   LEU  31          2HB       LEU  31  -4.341  -9.142  -1.808
  235   2HB   LEU  31          1HB       LEU  31  -5.649  -7.960  -1.797
  236    HG   LEU  31           HG       LEU  31  -4.683  -8.652   0.892
  237   1HD1  LEU  31          1HD1      LEU  31  -2.569  -8.797  -0.473
  238   2HD1  LEU  31          2HD1      LEU  31  -2.554  -7.511   0.734
  239   3HD1  LEU  31          3HD1      LEU  31  -2.836  -7.124  -0.964
  240   1HD2  LEU  31          1HD2      LEU  31  -5.432  -6.234  -0.717
  241   2HD2  LEU  31          2HD2      LEU  31  -4.472  -6.007   0.744
  242   3HD2  LEU  31          3HD2      LEU  31  -6.054  -6.777   0.842
  243    H    SER  32           H        SER  32  -8.442  -9.578   0.241
  244    HA   SER  32           HA       SER  32  -9.814  -9.535  -2.411
  245   1HB   SER  32          2HB       SER  32 -11.214  -9.871   0.242
  246   2HB   SER  32          1HB       SER  32 -11.750 -10.378  -1.357
  247    HG   SER  32           HG       SER  32 -10.815 -12.009   0.177
  248    H    VAL  33           H        VAL  33 -10.149  -7.481  -3.089
  249    HA   VAL  33           HA       VAL  33 -11.366  -5.542  -1.184
  250    HB   VAL  33           HB       VAL  33  -9.893  -3.738  -2.204
  251   1HG1  VAL  33          1HG1      VAL  33  -9.501  -4.691   0.056
  252   2HG1  VAL  33          2HG1      VAL  33  -7.995  -4.232  -0.737
  253   3HG1  VAL  33          3HG1      VAL  33  -8.469  -5.928  -0.663
  254   1HG2  VAL  33          1HG2      VAL  33  -7.941  -4.331  -3.416
  255   2HG2  VAL  33          2HG2      VAL  33  -9.217  -5.308  -4.139
  256   3HG2  VAL  33          3HG2      VAL  33  -8.094  -6.036  -2.992
  257    HA   PRO  34           HA       PRO  34 -13.958  -4.612  -4.607
  258   1HB   PRO  34          2HB       PRO  34 -14.589  -1.993  -4.037
  259   2HB   PRO  34          1HB       PRO  34 -15.268  -3.381  -3.170
  260   1HG   PRO  34          2HG       PRO  34 -13.168  -1.455  -2.284
  261   2HG   PRO  34          1HG       PRO  34 -14.316  -2.390  -1.311
  262   1HD   PRO  34          2HD       PRO  34 -11.591  -3.017  -1.678
  263   2HD   PRO  34          1HD       PRO  34 -12.832  -4.121  -1.046
  264    H    GLU  35           H        GLU  35 -14.112  -3.241  -6.566
  265    HA   GLU  35           HA       GLU  35 -11.612  -2.691  -7.797
  266   1HB   GLU  35          2HB       GLU  35 -14.458  -1.958  -8.448
  267   2HB   GLU  35          1HB       GLU  35 -13.134  -1.314  -9.419
  268   1HG   GLU  35          2HG       GLU  35 -13.460  -3.265 -10.588
  269   2HG   GLU  35          1HG       GLU  35 -12.382  -3.901  -9.346
  270    H    SER  36           H        SER  36 -13.698  -0.637  -5.842
  271    HA   SER  36           HA       SER  36 -12.648   1.913  -6.585
  272   1HB   SER  36          2HB       SER  36 -14.241   0.809  -4.372
  273   2HB   SER  36          1HB       SER  36 -13.245   2.184  -3.906
  274    HG   SER  36           HG       SER  36 -15.374   2.689  -4.787
  275    H    THR  37           H        THR  37 -11.553  -0.465  -4.158
  276    HA   THR  37           HA       THR  37  -9.484   1.156  -3.012
  277    HB   THR  37           HB       THR  37  -9.804  -1.853  -3.226
  278    HG1  THR  37           HG1      THR  37 -11.288  -0.925  -1.881
  279   1HG2  THR  37          1HG2      THR  37  -7.571  -0.192  -2.181
  280   2HG2  THR  37          2HG2      THR  37  -7.553  -1.843  -2.800
  281   3HG2  THR  37          3HG2      THR  37  -8.100  -1.525  -1.154
  282    HA   PRO  38           HA       PRO  38  -6.789   1.087  -6.558
  283   1HB   PRO  38          2HB       PRO  38  -4.865   2.696  -5.432
  284   2HB   PRO  38          1HB       PRO  38  -6.375   3.308  -6.129
  285   1HG   PRO  38          2HG       PRO  38  -5.609   3.032  -3.261
  286   2HG   PRO  38          1HG       PRO  38  -6.751   4.157  -4.014
  287   1HD   PRO  38          2HD       PRO  38  -7.431   1.807  -2.591
  288   2HD   PRO  38          1HD       PRO  38  -8.522   2.759  -3.621
  289    H    PHE  39           H        PHE  39  -4.514   0.438  -7.004
  290    HA   PHE  39           HA       PHE  39  -3.733  -1.915  -5.552
  291   1HB   PHE  39          2HB       PHE  39  -3.208  -1.170  -8.026
  292   2HB   PHE  39          1HB       PHE  39  -1.787  -0.428  -7.291
  293    HD1  PHE  39           HD1      PHE  39   0.136  -1.740  -7.210
  294    HD2  PHE  39           HD2      PHE  39  -3.705  -3.656  -7.036
  295    HE1  PHE  39           HE1      PHE  39   1.245  -3.954  -7.122
  296    HE2  PHE  39           HE2      PHE  39  -2.595  -5.871  -6.949
  297    HZ   PHE  39           HZ       PHE  39  -0.121  -6.020  -6.992
  298    H    THR  40           H        THR  40  -3.122   1.439  -4.980
  299    HA   THR  40           HA       THR  40  -0.572   1.314  -3.700
  300    HB   THR  40           HB       THR  40  -1.412   3.341  -2.415
  301    HG1  THR  40           HG1      THR  40  -3.464   3.706  -2.408
  302   1HG2  THR  40          1HG2      THR  40  -1.766   4.715  -4.536
  303   2HG2  THR  40          2HG2      THR  40  -1.662   3.193  -5.422
  304   3HG2  THR  40          3HG2      THR  40  -0.287   3.756  -4.474
  305    H    ALA  41           H        ALA  41  -3.880   0.926  -2.406
  306    HA   ALA  41           HA       ALA  41  -2.970   0.273   0.280
  307   1HB   ALA  41          1HB       ALA  41  -5.665  -0.331  -0.971
  308   2HB   ALA  41          2HB       ALA  41  -5.240   1.236  -0.283
  309   3HB   ALA  41          3HB       ALA  41  -5.296  -0.195   0.747
  310    H    VAL  42           H        VAL  42  -3.997  -1.587  -2.585
  311    HA   VAL  42           HA       VAL  42  -4.040  -4.175  -1.372
  312    HB   VAL  42           HB       VAL  42  -3.288  -3.430  -4.222
  313   1HG1  VAL  42          1HG1      VAL  42  -4.624  -6.003  -3.609
  314   2HG1  VAL  42          2HG1      VAL  42  -2.956  -5.872  -3.052
  315   3HG1  VAL  42          3HG1      VAL  42  -3.335  -5.649  -4.759
  316   1HG2  VAL  42          1HG2      VAL  42  -5.469  -2.956  -4.533
  317   2HG2  VAL  42          2HG2      VAL  42  -5.743  -3.171  -2.804
  318   3HG2  VAL  42          3HG2      VAL  42  -5.924  -4.539  -3.904
  319    H    LEU  43           H        LEU  43  -1.387  -2.422  -3.006
  320    HA   LEU  43           HA       LEU  43   0.604  -4.464  -2.615
  321   1HB   LEU  43          2HB       LEU  43   0.695  -2.491  -4.245
  322   2HB   LEU  43          1HB       LEU  43   1.137  -1.494  -2.860
  323    HG   LEU  43           HG       LEU  43   2.711  -3.955  -2.995
  324   1HD1  LEU  43          1HD1      LEU  43   2.852  -3.943  -5.291
  325   2HD1  LEU  43          2HD1      LEU  43   4.074  -2.717  -4.956
  326   3HD1  LEU  43          3HD1      LEU  43   2.441  -2.232  -5.413
  327   1HD2  LEU  43          1HD2      LEU  43   4.504  -2.445  -2.510
  328   2HD2  LEU  43          2HD2      LEU  43   3.102  -1.817  -1.643
  329   3HD2  LEU  43          3HD2      LEU  43   3.611  -1.069  -3.156
  330    H    LYS  44           H        LYS  44  -0.383  -1.628  -0.708
  331    HA   LYS  44           HA       LYS  44   1.702  -1.692   1.230
  332   1HB   LYS  44          2HB       LYS  44  -0.788  -0.319   0.862
  333   2HB   LYS  44          1HB       LYS  44  -0.737  -0.935   2.511
  334   1HG   LYS  44          2HG       LYS  44   0.743   0.652   3.101
  335   2HG   LYS  44          1HG       LYS  44   1.842   0.150   1.817
  336   1HD   LYS  44          2HD       LYS  44  -0.517   1.667   0.887
  337   2HD   LYS  44          1HD       LYS  44   0.593   2.586   1.905
  338   1HE   LYS  44          2HE       LYS  44   2.353   2.394   0.402
  339   2HE   LYS  44          1HE       LYS  44   1.738   0.893  -0.289
  340   1HZ   LYS  44          1HZ       LYS  44   1.061   3.651  -0.934
  341   2HZ   LYS  44          2HZ       LYS  44  -0.222   2.538  -0.957
  342   3HZ   LYS  44          3HZ       LYS  44   1.141   2.289  -1.942
  343    H    PHE  45           H        PHE  45  -1.474  -3.330   1.181
  344    HA   PHE  45           HA       PHE  45  -1.091  -4.645   3.735
  345   1HB   PHE  45          2HB       PHE  45  -3.073  -4.762   1.518
  346   2HB   PHE  45          1HB       PHE  45  -2.956  -6.190   2.544
  347    HD1  PHE  45           HD1      PHE  45  -4.212  -2.829   2.266
  348    HD2  PHE  45           HD2      PHE  45  -3.084  -5.863   5.091
  349    HE1  PHE  45           HE1      PHE  45  -5.507  -1.667   4.033
  350    HE2  PHE  45           HE2      PHE  45  -4.380  -4.699   6.855
  351    HZ   PHE  45           HZ       PHE  45  -5.591  -2.603   6.327
  352    H    ALA  46           H        ALA  46  -0.604  -5.637   0.342
  353    HA   ALA  46           HA       ALA  46   0.039  -8.373   0.844
  354   1HB   ALA  46          1HB       ALA  46  -0.427  -7.385  -1.414
  355   2HB   ALA  46          2HB       ALA  46   1.036  -8.367  -1.375
  356   3HB   ALA  46          3HB       ALA  46   1.154  -6.608  -1.357
  357    H    ALA  47           H        ALA  47   2.206  -5.532   0.501
  358    HA   ALA  47           HA       ALA  47   4.635  -6.964   1.053
  359   1HB   ALA  47          1HB       ALA  47   4.190  -4.527   0.103
  360   2HB   ALA  47          2HB       ALA  47   5.676  -4.891   0.980
  361   3HB   ALA  47          3HB       ALA  47   4.343  -4.077   1.802
  362    H    GLU  48           H        GLU  48   2.389  -5.164   3.157
  363    HA   GLU  48           HA       GLU  48   3.938  -5.432   5.571
  364   1HB   GLU  48          2HB       GLU  48   1.274  -4.483   4.813
  365   2HB   GLU  48          1HB       GLU  48   1.271  -5.306   6.370
  366   1HG   GLU  48          2HG       GLU  48   3.357  -3.223   5.720
  367   2HG   GLU  48          1HG       GLU  48   1.774  -2.763   6.345
  368    H    GLU  49           H        GLU  49   1.354  -7.397   4.112
  369    HA   GLU  49           HA       GLU  49   1.035  -9.241   6.276
  370   1HB   GLU  49          2HB       GLU  49   0.396  -9.272   3.348
  371   2HB   GLU  49          1HB       GLU  49   0.304 -10.782   4.252
  372   1HG   GLU  49          2HG       GLU  49  -1.324  -9.895   5.762
  373   2HG   GLU  49          1HG       GLU  49  -1.063  -8.248   5.184
  374    H    PHE  50           H        PHE  50   3.341  -9.158   3.569
  375    HA   PHE  50           HA       PHE  50   4.343 -11.844   4.159
  376   1HB   PHE  50          2HB       PHE  50   4.880  -9.735   2.142
  377   2HB   PHE  50          1HB       PHE  50   6.260 -10.748   2.567
  378    HD1  PHE  50           HD1      PHE  50   3.439 -10.491   0.471
  379    HD2  PHE  50           HD2      PHE  50   5.691 -13.357   2.746
  380    HE1  PHE  50           HE1      PHE  50   2.518 -12.321  -0.921
  381    HE2  PHE  50           HE2      PHE  50   4.767 -15.188   1.351
  382    HZ   PHE  50           HZ       PHE  50   3.181 -14.670  -0.482
  383    H    LYS  51           H        LYS  51   6.404  -8.971   3.832
  384    HA   LYS  51           HA       LYS  51   7.177  -8.623   6.532
  385   1HB   LYS  51          2HB       LYS  51   8.271 -11.030   5.289
  386   2HB   LYS  51          1HB       LYS  51   9.547  -9.941   5.830
  387   1HG   LYS  51          2HG       LYS  51   7.600  -9.963   7.887
  388   2HG   LYS  51          1HG       LYS  51   7.841 -11.644   7.412
  389   1HD   LYS  51          2HD       LYS  51   9.864 -11.700   8.397
  390   2HD   LYS  51          1HD       LYS  51  10.380 -10.259   7.520
  391   1HE   LYS  51          2HE       LYS  51   8.456  -9.618   9.617
  392   2HE   LYS  51          1HE       LYS  51   9.887 -10.422  10.260
  393   1HZ   LYS  51          1HZ       LYS  51  10.105  -7.982  10.107
  394   2HZ   LYS  51          2HZ       LYS  51   9.965  -8.094   8.418
  395   3HZ   LYS  51          3HZ       LYS  51  11.284  -8.811   9.214
  396    H    VAL  52           H        VAL  52   6.893  -7.068   4.084
  397    HA   VAL  52           HA       VAL  52   9.568  -5.769   4.086
  398    HB   VAL  52           HB       VAL  52   9.341  -5.437   1.575
  399   1HG1  VAL  52          1HG1      VAL  52   9.534  -8.366   1.914
  400   2HG1  VAL  52          2HG1      VAL  52  10.551  -7.423   3.004
  401   3HG1  VAL  52          3HG1      VAL  52  10.708  -7.225   1.260
  402   1HG2  VAL  52          1HG2      VAL  52   6.838  -6.229   1.747
  403   2HG2  VAL  52          2HG2      VAL  52   7.536  -7.843   1.610
  404   3HG2  VAL  52          3HG2      VAL  52   7.790  -6.660   0.326
  405    HA   PRO  53           HA       PRO  53   7.152  -2.098   4.246
  406   1HB   PRO  53          2HB       PRO  53   8.999  -0.316   3.256
  407   2HB   PRO  53          1HB       PRO  53   9.074  -1.008   4.885
  408   1HG   PRO  53          2HG       PRO  53  10.728  -1.662   2.491
  409   2HG   PRO  53          1HG       PRO  53  11.132  -1.817   4.209
  410   1HD   PRO  53          2HD       PRO  53  10.355  -3.929   2.492
  411   2HD   PRO  53          1HD       PRO  53  10.438  -4.001   4.266
  412    H    ALA  54           H        ALA  54   5.577  -1.374   2.888
  413    HA   ALA  54           HA       ALA  54   5.573  -1.952   0.064
  414   1HB   ALA  54          1HB       ALA  54   3.418  -0.973   0.027
  415   2HB   ALA  54          2HB       ALA  54   3.782   0.083   1.391
  416   3HB   ALA  54          3HB       ALA  54   3.559  -1.648   1.650
  417    H    ALA  55           H        ALA  55   6.542   0.865   1.935
  418    HA   ALA  55           HA       ALA  55   6.437   2.877  -0.055
  419   1HB   ALA  55          1HB       ALA  55   7.326   2.744   2.548
  420   2HB   ALA  55          2HB       ALA  55   7.514   4.144   1.491
  421   3HB   ALA  55          3HB       ALA  55   8.830   2.982   1.657
  422    H    THR  56           H        THR  56   8.918   0.392   0.545
  423    HA   THR  56           HA       THR  56  10.220   1.219  -2.023
  424    HB   THR  56           HB       THR  56  12.325   0.209  -1.024
  425    HG1  THR  56           HG1      THR  56  12.018  -0.821   0.763
  426   1HG2  THR  56          1HG2      THR  56  12.378   2.531  -1.027
  427   2HG2  THR  56          2HG2      THR  56  12.520   2.194   0.699
  428   3HG2  THR  56          3HG2      THR  56  10.964   2.667   0.018
  429    H    SER  57           H        SER  57   8.087  -0.533  -2.138
  430    HA   SER  57           HA       SER  57   9.445  -3.041  -2.974
  431   1HB   SER  57          2HB       SER  57   7.369  -2.792  -0.857
  432   2HB   SER  57          1HB       SER  57   7.193  -4.132  -1.983
  433    HG   SER  57           HG       SER  57   8.609  -4.288   0.045
  434    H    ALA  58           H        ALA  58   8.169  -4.281  -4.509
  435    HA   ALA  58           HA       ALA  58   5.866  -2.830  -5.730
  436   1HB   ALA  58          1HB       ALA  58   8.503  -3.129  -6.870
  437   2HB   ALA  58          2HB       ALA  58   7.106  -2.284  -7.530
  438   3HB   ALA  58          3HB       ALA  58   7.328  -4.002  -7.852
  439    H    ILE  59           H        ILE  59   4.783  -4.332  -7.421
  440    HA   ILE  59           HA       ILE  59   4.996  -7.185  -6.540
  441    HB   ILE  59           HB       ILE  59   2.566  -5.427  -6.805
  442   1HG1  ILE  59          2HG1      ILE  59   3.222  -7.661  -4.864
  443   2HG1  ILE  59          1HG1      ILE  59   3.713  -5.988  -4.603
  444   1HG2  ILE  59          1HG2      ILE  59   1.863  -7.143  -8.257
  445   2HG2  ILE  59          2HG2      ILE  59   1.280  -7.694  -6.687
  446   3HG2  ILE  59          3HG2      ILE  59   2.750  -8.383  -7.372
  447   1HD1  ILE  59          1HD1      ILE  59   1.577  -5.288  -4.151
  448   2HD1  ILE  59          2HD1      ILE  59   1.374  -6.976  -3.688
  449   3HD1  ILE  59          3HD1      ILE  59   0.851  -6.431  -5.280
  450    H    ILE  60           H        ILE  60   5.603  -8.394  -8.262
  451    HA   ILE  60           HA       ILE  60   5.022  -7.378 -10.996
  452    HB   ILE  60           HB       ILE  60   6.644  -9.096 -11.754
  453   1HG1  ILE  60          2HG1      ILE  60   7.736  -9.712  -9.125
  454   2HG1  ILE  60          1HG1      ILE  60   6.074 -10.280  -9.269
  455   1HG2  ILE  60          1HG2      ILE  60   7.562  -7.279  -9.512
  456   2HG2  ILE  60          2HG2      ILE  60   7.525  -6.908 -11.234
  457   3HG2  ILE  60          3HG2      ILE  60   8.658  -8.108 -10.616
  458   1HD1  ILE  60          1HD1      ILE  60   7.808 -10.784 -11.622
  459   2HD1  ILE  60          2HD1      ILE  60   6.597 -11.823 -10.872
  460   3HD1  ILE  60          3HD1      ILE  60   8.208 -11.696 -10.166
  461    H    THR  61           H        THR  61   4.530  -9.254 -12.623
  462    HA   THR  61           HA       THR  61   2.298 -10.852 -11.453
  463    HB   THR  61           HB       THR  61   2.830 -10.348 -14.393
  464    HG1  THR  61           HG1      THR  61   1.388  -8.624 -14.183
  465   1HG2  THR  61          1HG2      THR  61   0.201 -10.861 -12.999
  466   2HG2  THR  61          2HG2      THR  61   1.229 -12.184 -13.550
  467   3HG2  THR  61          3HG2      THR  61   0.583 -11.028 -14.713
  468    H    ASN  62           H        ASN  62   2.075 -13.097 -12.099
  469    HA   ASN  62           HA       ASN  62   4.437 -14.644 -11.961
  470   1HB   ASN  62          2HB       ASN  62   1.628 -15.256 -12.863
  471   2HB   ASN  62          1HB       ASN  62   2.889 -16.488 -12.950
  472   1HD2  ASN  62          1HD2      ASN  62   3.989 -17.067 -10.860
  473   2HD2  ASN  62          2HD2      ASN  62   3.168 -16.826  -9.394
  474    H    ASP  63           H        ASP  63   2.918 -13.161 -14.755
  475    HA   ASP  63           HA       ASP  63   4.339 -14.813 -16.708
  476   1HB   ASP  63          2HB       ASP  63   2.148 -13.111 -16.825
  477   2HB   ASP  63          1HB       ASP  63   3.410 -12.190 -17.643
  478    H    GLY  64           H        GLY  64   4.645 -11.446 -15.507
  479   1HA   GLY  64          2HA       GLY  64   7.226 -11.047 -15.063
  480   2HA   GLY  64          1HA       GLY  64   7.310 -11.252 -16.813
  481    H    VAL  65           H        VAL  65   5.096  -9.489 -14.603
  482    HA   VAL  65           HA       VAL  65   5.671  -7.005 -16.169
  483    HB   VAL  65           HB       VAL  65   2.926  -7.751 -15.119
  484   1HG1  VAL  65          1HG1      VAL  65   2.174  -5.894 -16.463
  485   2HG1  VAL  65          2HG1      VAL  65   3.770  -5.706 -17.191
  486   3HG1  VAL  65          3HG1      VAL  65   3.526  -5.322 -15.487
  487   1HG2  VAL  65          1HG2      VAL  65   3.437  -9.361 -16.843
  488   2HG2  VAL  65          2HG2      VAL  65   4.140  -8.114 -17.875
  489   3HG2  VAL  65          3HG2      VAL  65   2.403  -8.134 -17.574
  490    H    GLY  66           H        GLY  66   6.488  -5.510 -14.799
  491   1HA   GLY  66          2HA       GLY  66   6.341  -5.802 -11.918
  492   2HA   GLY  66          1HA       GLY  66   7.091  -4.462 -12.783
  493    H    VAL  67           H        VAL  67   4.060  -5.708 -11.521
  494    HA   VAL  67           HA       VAL  67   2.442  -3.424 -12.277
  495    HB   VAL  67           HB       VAL  67   1.922  -5.330  -9.975
  496   1HG1  VAL  67          1HG1      VAL  67  -0.027  -4.226  -9.807
  497   2HG1  VAL  67          2HG1      VAL  67  -0.377  -4.543 -11.506
  498   3HG1  VAL  67          3HG1      VAL  67   0.523  -3.098 -11.046
  499   1HG2  VAL  67          1HG2      VAL  67   0.510  -6.501 -11.823
  500   2HG2  VAL  67          2HG2      VAL  67   2.247  -6.800 -11.793
  501   3HG2  VAL  67          3HG2      VAL  67   1.570  -5.659 -12.954
  502    H    ASN  68           H        ASN  68   2.321  -1.471 -11.295
  503    HA   ASN  68           HA       ASN  68   3.740  -1.115  -8.687
  504   1HB   ASN  68          2HB       ASN  68   3.194   0.762 -10.996
  505   2HB   ASN  68          1HB       ASN  68   3.702   1.354  -9.415
  506   1HD2  ASN  68          1HD2      ASN  68   4.867   0.136 -12.393
  507   2HD2  ASN  68          2HD2      ASN  68   6.463  -0.175 -11.909
  508    HA   PRO  69           HA       PRO  69  -0.023   0.101  -6.752
  509   1HB   PRO  69          2HB       PRO  69   0.938   1.933  -4.935
  510   2HB   PRO  69          1HB       PRO  69   1.160   0.183  -4.772
  511   1HG   PRO  69          2HG       PRO  69   3.145   2.259  -5.569
  512   2HG   PRO  69          1HG       PRO  69   3.414   0.681  -4.810
  513   1HD   PRO  69          2HD       PRO  69   3.792   1.298  -7.550
  514   2HD   PRO  69          1HD       PRO  69   3.756  -0.328  -6.838
  515    H    ALA  70           H        ALA  70  -0.341   1.233  -9.042
  516    HA   ALA  70           HA       ALA  70  -0.906   4.122  -8.522
  517   1HB   ALA  70          1HB       ALA  70   0.634   4.663 -10.078
  518   2HB   ALA  70          2HB       ALA  70  -0.424   3.916 -11.275
  519   3HB   ALA  70          3HB       ALA  70   0.863   2.972 -10.524
  520    H    GLN  71           H        GLN  71  -1.696   1.222 -10.445
  521    HA   GLN  71           HA       GLN  71  -4.156   2.426 -11.499
  522   1HB   GLN  71          2HB       GLN  71  -3.120  -0.425 -11.611
  523   2HB   GLN  71          1HB       GLN  71  -4.518   0.181 -12.496
  524   1HG   GLN  71          2HG       GLN  71  -3.058   0.679 -14.153
  525   2HG   GLN  71          1HG       GLN  71  -2.546   2.022 -13.130
  526   1HE2  GLN  71          1HE2      GLN  71  -1.835  -1.459 -13.738
  527   2HE2  GLN  71          2HE2      GLN  71  -0.200  -1.354 -13.297
  528    HA   PRO  72           HA       PRO  72  -6.901   1.051  -8.339
  529   1HB   PRO  72          2HB       PRO  72  -9.169   0.622  -9.834
  530   2HB   PRO  72          1HB       PRO  72  -8.558   2.232  -9.418
  531   1HG   PRO  72          2HG       PRO  72  -8.433   0.793 -12.028
  532   2HG   PRO  72          1HG       PRO  72  -8.449   2.534 -11.707
  533   1HD   PRO  72          2HD       PRO  72  -6.170   1.001 -12.361
  534   2HD   PRO  72          1HD       PRO  72  -6.160   2.646 -11.694
  535    H    ALA  73           H        ALA  73  -8.092  -0.847  -7.549
  536    HA   ALA  73           HA       ALA  73  -6.926  -3.357  -8.120
  537   1HB   ALA  73          1HB       ALA  73  -9.286  -2.405  -6.608
  538   2HB   ALA  73          2HB       ALA  73  -8.017  -3.530  -6.125
  539   3HB   ALA  73          3HB       ALA  73  -9.356  -4.087  -7.125
  540    H    GLY  74           H        GLY  74  -9.908  -1.908  -9.438
  541   1HA   GLY  74          2HA       GLY  74 -10.859  -4.175 -10.867
  542   2HA   GLY  74          1HA       GLY  74 -11.198  -2.501 -11.303
  543    H    ASN  75           H        ASN  75  -8.674  -1.544 -11.932
  544    HA   ASN  75           HA       ASN  75  -8.261  -2.617 -14.579
  545   1HB   ASN  75          2HB       ASN  75  -7.815  -0.239 -13.934
  546   2HB   ASN  75          1HB       ASN  75  -6.435  -0.790 -12.984
  547   1HD2  ASN  75          1HD2      ASN  75  -7.722  -0.832 -16.349
  548   2HD2  ASN  75          2HD2      ASN  75  -6.196  -0.895 -17.090
  549    H    ILE  76           H        ILE  76  -6.519  -2.996 -11.496
  550    HA   ILE  76           HA       ILE  76  -4.240  -4.389 -12.503
  551    HB   ILE  76           HB       ILE  76  -5.629  -4.600  -9.813
  552   1HG1  ILE  76          2HG1      ILE  76  -4.743  -2.344 -10.477
  553   2HG1  ILE  76          1HG1      ILE  76  -3.940  -3.019  -9.063
  554   1HG2  ILE  76          1HG2      ILE  76  -3.188  -5.894 -10.930
  555   2HG2  ILE  76          2HG2      ILE  76  -4.301  -6.472  -9.690
  556   3HG2  ILE  76          3HG2      ILE  76  -3.077  -5.269  -9.285
  557   1HD1  ILE  76          1HD1      ILE  76  -2.067  -3.770 -10.457
  558   2HD1  ILE  76          2HD1      ILE  76  -2.321  -2.039 -10.673
  559   3HD1  ILE  76          3HD1      ILE  76  -2.880  -3.173 -11.902
  560    H    PHE  77           H        PHE  77  -7.406  -5.596 -11.377
  561    HA   PHE  77           HA       PHE  77  -6.763  -8.389 -11.818
  562   1HB   PHE  77          2HB       PHE  77  -8.623  -7.360 -10.326
  563   2HB   PHE  77          1HB       PHE  77  -9.558  -7.246 -11.815
  564    HD1  PHE  77           HD1      PHE  77  -8.180  -9.489  -9.277
  565    HD2  PHE  77           HD2      PHE  77 -10.148  -9.298 -13.091
  566    HE1  PHE  77           HE1      PHE  77  -8.784 -11.886  -9.087
  567    HE2  PHE  77           HE2      PHE  77 -10.748 -11.696 -12.901
  568    HZ   PHE  77           HZ       PHE  77 -10.067 -12.990 -10.899
  569    H    LEU  78           H        LEU  78  -8.278  -5.838 -13.761
  570    HA   LEU  78           HA       LEU  78  -9.170  -7.552 -15.903
  571   1HB   LEU  78          2HB       LEU  78  -9.011  -4.674 -15.355
  572   2HB   LEU  78          1HB       LEU  78  -8.743  -5.066 -17.051
  573    HG   LEU  78           HG       LEU  78 -11.153  -4.671 -16.485
  574   1HD1  LEU  78          1HD1      LEU  78  -9.985  -6.943 -17.866
  575   2HD1  LEU  78          2HD1      LEU  78 -11.381  -5.963 -18.317
  576   3HD1  LEU  78          3HD1      LEU  78 -11.584  -7.344 -17.240
  577   1HD2  LEU  78          1HD2      LEU  78 -10.752  -5.918 -14.184
  578   2HD2  LEU  78          2HD2      LEU  78 -11.182  -7.347 -15.124
  579   3HD2  LEU  78          3HD2      LEU  78 -12.323  -6.011 -14.981
  580    H    LYS  79           H        LYS  79  -6.157  -5.742 -15.331
  581    HA   LYS  79           HA       LYS  79  -5.080  -6.492 -17.960
  582   1HB   LYS  79          2HB       LYS  79  -4.534  -4.478 -16.053
  583   2HB   LYS  79          1HB       LYS  79  -3.083  -5.477 -16.137
  584   1HG   LYS  79          2HG       LYS  79  -3.598  -5.295 -18.767
  585   2HG   LYS  79          1HG       LYS  79  -4.345  -3.785 -18.244
  586   1HD   LYS  79          2HD       LYS  79  -1.669  -4.369 -17.093
  587   2HD   LYS  79          1HD       LYS  79  -1.702  -4.007 -18.819
  588   1HE   LYS  79          2HE       LYS  79  -2.057  -1.817 -18.422
  589   2HE   LYS  79          1HE       LYS  79  -3.418  -2.176 -17.360
  590   1HZ   LYS  79          1HZ       LYS  79  -0.554  -2.286 -16.578
  591   2HZ   LYS  79          2HZ       LYS  79  -1.880  -2.582 -15.557
  592   3HZ   LYS  79          3HZ       LYS  79  -1.626  -1.028 -16.196
  593    H    HIS  80           H        HIS  80  -4.166  -7.176 -14.551
  594    HA   HIS  80           HA       HIS  80  -2.499  -9.439 -15.524
  595   1HB   HIS  80          2HB       HIS  80  -2.706  -8.475 -12.666
  596   2HB   HIS  80          1HB       HIS  80  -1.395  -9.382 -13.420
  597    HD1  HIS  80           HD1      HIS  80  -0.319  -7.953 -15.615
  598    HD2  HIS  80           HD2      HIS  80  -2.118  -5.786 -12.543
  599    HE1  HIS  80           HE1      HIS  80   0.522  -5.574 -15.828
  600    H    GLY  81           H        GLY  81  -4.808  -8.908 -12.814
  601   1HA   GLY  81          2HA       GLY  81  -6.823 -10.460 -12.829
  602   2HA   GLY  81          1HA       GLY  81  -5.676 -11.754 -13.175
  603    H    SER  82           H        SER  82  -5.404 -12.976 -11.377
  604    HA   SER  82           HA       SER  82  -5.258 -11.582  -8.732
  605   1HB   SER  82          2HB       SER  82  -5.974 -13.760  -7.750
  606   2HB   SER  82          1HB       SER  82  -7.173 -13.088  -8.848
  607    HG   SER  82           HG       SER  82  -6.847 -15.271  -9.307
  608    H    GLU  83           H        GLU  83  -3.893 -14.297 -10.627
  609    HA   GLU  83           HA       GLU  83  -1.856 -15.020  -8.773
  610   1HB   GLU  83          2HB       GLU  83  -2.493 -15.576 -11.571
  611   2HB   GLU  83          1HB       GLU  83  -0.755 -15.503 -11.288
  612   1HG   GLU  83          2HG       GLU  83  -1.385 -17.769 -10.867
  613   2HG   GLU  83          1HG       GLU  83  -1.151 -17.034  -9.281
  614    H    LEU  84           H        LEU  84  -0.490 -13.524  -7.940
  615    HA   LEU  84           HA       LEU  84   1.156 -11.918  -9.834
  616   1HB   LEU  84          2HB       LEU  84  -0.489 -10.896  -7.523
  617   2HB   LEU  84          1HB       LEU  84   0.978 -10.049  -8.014
  618    HG   LEU  84           HG       LEU  84  -0.794 -10.779 -10.256
  619   1HD1  LEU  84          1HD1      LEU  84  -2.502  -9.138  -9.802
  620   2HD1  LEU  84          2HD1      LEU  84  -1.682  -8.614  -8.330
  621   3HD1  LEU  84          3HD1      LEU  84  -2.422 -10.213  -8.406
  622   1HD2  LEU  84          1HD2      LEU  84  -0.202  -8.550 -10.994
  623   2HD2  LEU  84          2HD2      LEU  84   1.252  -9.299 -10.338
  624   3HD2  LEU  84          3HD2      LEU  84   0.363  -8.114  -9.381
  625    H    ARG  85           H        ARG  85   3.116 -10.997  -8.654
  626    HA   ARG  85           HA       ARG  85   3.996 -12.807  -6.437
  627   1HB   ARG  85          2HB       ARG  85   5.390 -12.007  -8.980
  628   2HB   ARG  85          1HB       ARG  85   6.337 -12.412  -7.549
  629   1HG   ARG  85          2HG       ARG  85   4.353 -14.415  -7.768
  630   2HG   ARG  85          1HG       ARG  85   5.000 -14.185  -9.393
  631   1HD   ARG  85          2HD       ARG  85   7.305 -14.411  -8.480
  632   2HD   ARG  85          1HD       ARG  85   6.620 -14.725  -6.884
  633    HE   ARG  85           HE       ARG  85   6.227 -16.523  -9.245
  634   1HH1  ARG  85          2HH1      ARG  85   8.189 -17.152  -6.997
  635   2HH1  ARG  85          1HH1      ARG  85   7.255 -18.243  -6.030
  636   1HH2  ARG  85          1HH2      ARG  85   4.233 -17.382  -7.512
  637   2HH2  ARG  85          2HH2      ARG  85   5.009 -18.376  -6.326
  638    H    LEU  86           H        LEU  86   5.488 -11.848  -4.925
  639    HA   LEU  86           HA       LEU  86   5.373  -8.865  -4.892
  640   1HB   LEU  86          2HB       LEU  86   4.513 -10.364  -2.927
  641   2HB   LEU  86          1HB       LEU  86   6.224 -10.556  -2.549
  642    HG   LEU  86           HG       LEU  86   5.617  -7.777  -3.109
  643   1HD1  LEU  86          1HD1      LEU  86   3.483  -7.821  -2.258
  644   2HD1  LEU  86          2HD1      LEU  86   4.367  -7.700  -0.737
  645   3HD1  LEU  86          3HD1      LEU  86   3.781  -9.267  -1.294
  646   1HD2  LEU  86          1HD2      LEU  86   7.598  -8.641  -1.893
  647   2HD2  LEU  86          2HD2      LEU  86   6.545  -9.208  -0.597
  648   3HD2  LEU  86          3HD2      LEU  86   6.696  -7.480  -0.919
  649    H    ILE  87           H        ILE  87   7.228  -7.738  -5.185
  650    HA   ILE  87           HA       ILE  87   9.835  -9.150  -4.811
  651    HB   ILE  87           HB       ILE  87   9.340  -9.065  -7.216
  652   1HG1  ILE  87          2HG1      ILE  87  11.381  -6.910  -6.640
  653   2HG1  ILE  87          1HG1      ILE  87  11.685  -8.607  -6.270
  654   1HG2  ILE  87          1HG2      ILE  87   9.467  -6.479  -8.050
  655   2HG2  ILE  87          2HG2      ILE  87   8.581  -6.281  -6.541
  656   3HG2  ILE  87          3HG2      ILE  87   7.955  -7.348  -7.793
  657   1HD1  ILE  87          1HD1      ILE  87  10.744  -8.784  -8.838
  658   2HD1  ILE  87          2HD1      ILE  87  12.452  -8.710  -8.405
  659   3HD1  ILE  87          3HD1      ILE  87  11.602  -7.243  -8.884
  660    HA   PRO  88           HA       PRO  88  10.604  -5.527  -2.376
  661   1HB   PRO  88          2HB       PRO  88  13.241  -6.086  -1.816
  662   2HB   PRO  88          1HB       PRO  88  11.875  -6.872  -1.003
  663   1HG   PRO  88          2HG       PRO  88  13.695  -7.965  -3.099
  664   2HG   PRO  88          1HG       PRO  88  12.794  -8.821  -1.837
  665   1HD   PRO  88          2HD       PRO  88  12.062  -8.656  -4.561
  666   2HD   PRO  88          1HD       PRO  88  11.011  -9.190  -3.233
  667    H    ARG  89           H        ARG  89  10.387  -4.441  -4.655
  668    HA   ARG  89           HA       ARG  89  12.979  -3.610  -5.822
  669   1HB   ARG  89          2HB       ARG  89  10.881  -4.237  -7.194
  670   2HB   ARG  89          1HB       ARG  89  10.237  -2.676  -6.689
  671   1HG   ARG  89          2HG       ARG  89  12.677  -1.882  -7.518
  672   2HG   ARG  89          1HG       ARG  89  12.468  -3.290  -8.559
  673   1HD   ARG  89          2HD       ARG  89  11.567  -1.396  -9.742
  674   2HD   ARG  89          1HD       ARG  89  10.200  -2.366  -9.197
  675    HE   ARG  89           HE       ARG  89  10.281  -0.636  -7.176
  676   1HH1  ARG  89          1HH2      ARG  89   8.440   0.064  -9.382
  677   2HH1  ARG  89          2HH2      ARG  89   8.987   1.635  -9.862
  678   1HH2  ARG  89          2HH1      ARG  89  12.065   1.338  -8.272
  679   2HH2  ARG  89          1HH1      ARG  89  11.047   2.359  -9.232
  680    H    ASP  90           H        ASP  90  13.971  -1.911  -4.869
  681    HA   ASP  90           HA       ASP  90  12.597  -0.095  -3.075
  682   1HB   ASP  90          2HB       ASP  90  15.257  -0.835  -3.561
  683   2HB   ASP  90          1HB       ASP  90  15.180   0.871  -3.998
  684    H    ARG  91           H        ARG  91  11.757   1.910  -3.490
  685    HA   ARG  91           HA       ARG  91  11.499   2.797  -6.262
  686   1HB   ARG  91          2HB       ARG  91  10.420   3.616  -3.619
  687   2HB   ARG  91          1HB       ARG  91  10.595   4.912  -4.804
  688   1HG   ARG  91          2HG       ARG  91   8.440   4.077  -5.241
  689   2HG   ARG  91          1HG       ARG  91   9.438   3.271  -6.451
  690   1HD   ARG  91          2HD       ARG  91   9.405   1.224  -5.301
  691   2HD   ARG  91          1HD       ARG  91   8.966   1.982  -3.770
  692    HE   ARG  91           HE       ARG  91   6.693   1.969  -4.464
  693   1HH1  ARG  91          1HH2      ARG  91   7.176  -0.614  -5.764
  694   2HH1  ARG  91          2HH2      ARG  91   6.677  -0.339  -7.399
  695   1HH2  ARG  91          2HH1      ARG  91   6.780   3.121  -7.128
  696   2HH2  ARG  91          1HH1      ARG  91   6.454   1.780  -8.175
  697    H    VAL  92           H        VAL  92  13.341   3.616  -7.186
  698    HA   VAL  92           HA       VAL  92  15.166   5.300  -5.556
  699    HB   VAL  92           HB       VAL  92  15.458   4.190  -8.372
  700   1HG1  VAL  92          1HG1      VAL  92  17.705   5.245  -6.670
  701   2HG1  VAL  92          2HG1      VAL  92  16.735   6.358  -7.635
  702   3HG1  VAL  92          3HG1      VAL  92  17.629   5.058  -8.422
  703   1HG2  VAL  92          1HG2      VAL  92  15.612   2.315  -6.985
  704   2HG2  VAL  92          2HG2      VAL  92  16.294   3.236  -5.645
  705   3HG2  VAL  92          3HG2      VAL  92  17.292   2.846  -7.047
  706    H    GLY  93           H        GLY  93  15.124   5.947  -8.963
  707   1HA   GLY  93          2HA       GLY  93  14.135   8.676  -8.437
  708   2HA   GLY  93          1HA       GLY  93  14.937   8.133  -9.913
  709    H    HIS  94           HN       HIS  94  13.182   5.704 -10.088
  710    HA   HIS  94           HA       HIS  94  10.948   7.039 -11.458
  711   1HB   HIS  94          2HB       HIS  94  12.387   4.849 -12.144
  712   2HB   HIS  94          1HB       HIS  94  11.036   4.073 -11.325
  713    HD1  HIS  94           HD1      HIS  94  10.640   3.291 -13.991
  714    HD2  HIS  94           HD2      HIS  94   9.751   7.238 -12.976
  715    HE1  HIS  94           HE1      HIS  94   9.125   4.184 -15.822
  Start of MODEL   13
    1   1H    MET   1          1H        MET   1  -3.560  11.998  -3.259
    2   2H    MET   1          2H        MET   1  -3.116  11.309  -1.770
    3   3H    MET   1          3H        MET   1  -3.019  12.989  -1.996
    4    HA   MET   1           HA       MET   1  -4.954  12.369  -0.665
    5   1HB   MET   1          2HB       MET   1  -4.939  14.392  -2.129
    6   2HB   MET   1          1HB       MET   1  -5.649  13.426  -3.425
    7   1HG   MET   1          2HG       MET   1  -7.428  12.824  -1.563
    8   2HG   MET   1          1HG       MET   1  -6.873  14.338  -0.845
    9   1HE   MET   1          1HE       MET   1  -9.586  13.488  -1.671
   10   2HE   MET   1          2HE       MET   1 -10.352  14.587  -2.812
   11   3HE   MET   1          3HE       MET   1  -9.653  15.224  -1.326
   12    H    SER   2           H        SER   2  -5.411  10.170  -0.391
   13    HA   SER   2           HA       SER   2  -6.354   8.439  -2.519
   14   1HB   SER   2          2HB       SER   2  -6.389   8.242   0.503
   15   2HB   SER   2          1HB       SER   2  -7.073   6.987  -0.527
   16    HG   SER   2           HG       SER   2  -5.085   6.302  -0.610
   17    H    GLY   3           H        GLY   3  -8.270   8.870  -3.514
   18   1HA   GLY   3          2HA       GLY   3 -10.403  10.391  -2.316
   19   2HA   GLY   3          1HA       GLY   3 -10.515   9.484  -3.825
   20    H    GLY   4           H        GLY   4 -12.673   8.823  -3.133
   21   1HA   GLY   4          2HA       GLY   4 -13.104   7.281  -0.719
   22   2HA   GLY   4          1HA       GLY   4 -14.213   7.384  -2.087
   23    H    THR   5           H        THR   5 -11.436   5.647  -0.773
   24    HA   THR   5           HA       THR   5 -10.889   3.867  -2.901
   25    HB   THR   5           HB       THR   5  -9.521   3.976  -0.844
   26    HG1  THR   5           HG1      THR   5  -9.018   1.895  -0.933
   27   1HG2  THR   5          1HG2      THR   5 -11.258   2.189   0.719
   28   2HG2  THR   5          2HG2      THR   5 -11.919   3.808   0.501
   29   3HG2  THR   5          3HG2      THR   5 -10.331   3.597   1.238
   30    H    ALA   6           H        ALA   6 -13.562   3.908  -0.635
   31    HA   ALA   6           HA       ALA   6 -14.724   1.524  -2.016
   32   1HB   ALA   6          1HB       ALA   6 -15.976   1.134   0.130
   33   2HB   ALA   6          2HB       ALA   6 -15.029   2.425   0.871
   34   3HB   ALA   6          3HB       ALA   6 -14.229   0.959   0.306
   35    H    ALA   7           H        ALA   7 -15.388   3.351  -3.509
   36    HA   ALA   7           HA       ALA   7 -17.364   5.269  -2.538
   37   1HB   ALA   7          1HB       ALA   7 -16.742   4.538  -5.413
   38   2HB   ALA   7          2HB       ALA   7 -15.794   5.695  -4.479
   39   3HB   ALA   7          3HB       ALA   7 -17.491   6.023  -4.828
   40    H    THR   8           H        THR   8 -18.849   3.692  -1.593
   41    HA   THR   8           HA       THR   8 -20.649   2.180  -1.614
   42    HB   THR   8           HB       THR   8 -22.394   2.908  -3.400
   43    HG1  THR   8           HG1      THR   8 -21.720   4.304  -4.784
   44   1HG2  THR   8          1HG2      THR   8 -21.304   4.894  -1.388
   45   2HG2  THR   8          2HG2      THR   8 -22.451   3.599  -1.044
   46   3HG2  THR   8          3HG2      THR   8 -22.919   4.936  -2.095
   47    H    THR   9           H        THR   9 -18.651   0.773  -2.596
   48    HA   THR   9           HA       THR   9 -19.680  -0.513  -5.100
   49    HB   THR   9           HB       THR   9 -16.813  -0.571  -4.099
   50    HG1  THR   9           HG1      THR   9 -16.710   1.369  -4.852
   51   1HG2  THR   9          1HG2      THR   9 -16.708  -0.996  -6.766
   52   2HG2  THR   9          2HG2      THR   9 -18.293  -1.684  -6.422
   53   3HG2  THR   9          3HG2      THR   9 -16.864  -2.303  -5.594
   54    H    ALA  10           H        ALA  10 -20.941  -2.116  -4.153
   55    HA   ALA  10           HA       ALA  10 -19.479  -4.099  -2.457
   56   1HB   ALA  10          1HB       ALA  10 -22.407  -3.463  -2.088
   57   2HB   ALA  10          2HB       ALA  10 -21.155  -2.577  -1.216
   58   3HB   ALA  10          3HB       ALA  10 -21.326  -4.318  -0.988
   59    H    GLY  11           H        GLY  11 -19.847  -6.240  -3.002
   60   1HA   GLY  11          2HA       GLY  11 -21.373  -7.970  -3.937
   61   2HA   GLY  11          1HA       GLY  11 -21.873  -6.781  -5.140
   62    H    SER  12           H        SER  12 -20.069  -5.965  -6.593
   63    HA   SER  12           HA       SER  12 -18.536  -8.269  -7.595
   64   1HB   SER  12          2HB       SER  12 -19.760  -6.211  -8.872
   65   2HB   SER  12          1HB       SER  12 -18.122  -5.573  -8.779
   66    HG   SER  12           HG       SER  12 -18.429  -6.839 -10.653
   67    H    LYS  13           H        LYS  13 -16.575  -8.705  -6.714
   68    HA   LYS  13           HA       LYS  13 -14.771  -6.415  -6.063
   69   1HB   LYS  13          2HB       LYS  13 -15.116  -8.911  -4.369
   70   2HB   LYS  13          1HB       LYS  13 -14.007  -7.579  -4.045
   71   1HG   LYS  13          2HG       LYS  13 -15.975  -6.033  -3.922
   72   2HG   LYS  13          1HG       LYS  13 -17.036  -7.431  -4.093
   73   1HD   LYS  13          2HD       LYS  13 -16.787  -7.996  -1.924
   74   2HD   LYS  13          1HD       LYS  13 -15.032  -7.854  -2.020
   75   1HE   LYS  13          2HE       LYS  13 -15.277  -5.365  -1.851
   76   2HE   LYS  13          1HE       LYS  13 -17.007  -5.592  -1.597
   77   1HZ   LYS  13          1HZ       LYS  13 -15.318  -7.196   0.119
   78   2HZ   LYS  13          2HZ       LYS  13 -16.691  -6.270   0.497
   79   3HZ   LYS  13          3HZ       LYS  13 -15.171  -5.524   0.361
   80    H    VAL  14           H        VAL  14 -12.509  -6.915  -6.264
   81    HA   VAL  14           HA       VAL  14 -11.976  -9.300  -7.987
   82    HB   VAL  14           HB       VAL  14  -9.893  -7.999  -8.661
   83   1HG1  VAL  14          1HG1      VAL  14 -11.192  -6.433 -10.142
   84   2HG1  VAL  14          2HG1      VAL  14 -12.642  -6.866  -9.238
   85   3HG1  VAL  14          3HG1      VAL  14 -11.781  -8.095 -10.164
   86   1HG2  VAL  14          1HG2      VAL  14 -11.379  -5.795  -7.195
   87   2HG2  VAL  14          2HG2      VAL  14 -10.024  -5.527  -8.289
   88   3HG2  VAL  14          3HG2      VAL  14  -9.785  -6.433  -6.795
   89    H    THR  15           H        THR  15 -10.575 -10.832  -7.255
   90    HA   THR  15           HA       THR  15  -9.327 -10.399  -4.587
   91    HB   THR  15           HB       THR  15  -8.978 -12.910  -4.692
   92    HG1  THR  15           HG1      THR  15  -9.406 -13.867  -6.493
   93   1HG2  THR  15          1HG2      THR  15 -10.849 -12.740  -3.448
   94   2HG2  THR  15          2HG2      THR  15 -11.756 -13.072  -4.923
   95   3HG2  THR  15          3HG2      THR  15 -11.458 -11.407  -4.428
   96    H    PHE  16           H        PHE  16  -7.101 -10.540  -4.280
   97    HA   PHE  16           HA       PHE  16  -5.431 -10.956  -6.733
   98   1HB   PHE  16          2HB       PHE  16  -4.937  -9.001  -4.467
   99   2HB   PHE  16          1HB       PHE  16  -3.863  -9.270  -5.838
  100    HD1  PHE  16           HD1      PHE  16  -6.484  -7.265  -4.606
  101    HD2  PHE  16           HD2      PHE  16  -5.047  -9.086  -8.222
  102    HE1  PHE  16           HE1      PHE  16  -7.773  -5.626  -5.944
  103    HE2  PHE  16           HE2      PHE  16  -6.339  -7.446  -9.560
  104    HZ   PHE  16           HZ       PHE  16  -7.700  -5.718  -8.420
  105    H    LYS  17           H        LYS  17  -3.618 -12.229  -6.480
  106    HA   LYS  17           HA       LYS  17  -3.057 -13.280  -3.736
  107   1HB   LYS  17          2HB       LYS  17  -4.121 -14.773  -5.786
  108   2HB   LYS  17          1HB       LYS  17  -2.393 -15.067  -5.987
  109   1HG   LYS  17          2HG       LYS  17  -2.474 -15.391  -3.357
  110   2HG   LYS  17          1HG       LYS  17  -4.174 -15.737  -3.672
  111   1HD   LYS  17          2HD       LYS  17  -2.404 -17.085  -5.569
  112   2HD   LYS  17          1HD       LYS  17  -2.072 -17.548  -3.900
  113   1HE   LYS  17          2HE       LYS  17  -4.356 -18.218  -3.548
  114   2HE   LYS  17          1HE       LYS  17  -4.857 -17.523  -5.089
  115   1HZ   LYS  17          1HZ       LYS  17  -4.637 -19.817  -5.451
  116   2HZ   LYS  17          2HZ       LYS  17  -3.151 -19.899  -4.630
  117   3HZ   LYS  17          3HZ       LYS  17  -3.250 -19.127  -6.140
  118    H    ILE  18           H        ILE  18  -1.089 -12.502  -3.161
  119    HA   ILE  18           HA       ILE  18   0.991 -12.187  -5.286
  120    HB   ILE  18           HB       ILE  18   0.800 -10.838  -2.572
  121   1HG1  ILE  18          2HG1      ILE  18   0.644  -8.896  -4.540
  122   2HG1  ILE  18          1HG1      ILE  18  -0.310 -10.210  -5.226
  123   1HG2  ILE  18          1HG2      ILE  18   2.609  -9.394  -3.518
  124   2HG2  ILE  18          2HG2      ILE  18   2.688 -10.468  -4.914
  125   3HG2  ILE  18          3HG2      ILE  18   3.108 -11.072  -3.312
  126   1HD1  ILE  18          1HD1      ILE  18  -1.810  -8.855  -3.916
  127   2HD1  ILE  18          2HD1      ILE  18  -0.706  -8.865  -2.542
  128   3HD1  ILE  18          3HD1      ILE  18  -1.537 -10.347  -3.014
  129    H    THR  19           H        THR  19   2.549 -13.724  -5.242
  130    HA   THR  19           HA       THR  19   3.084 -15.166  -2.677
  131    HB   THR  19           HB       THR  19   3.911 -16.051  -5.454
  132    HG1  THR  19           HG1      THR  19   1.886 -16.438  -5.768
  133   1HG2  THR  19          1HG2      THR  19   3.376 -17.693  -2.970
  134   2HG2  THR  19          2HG2      THR  19   4.971 -17.046  -3.358
  135   3HG2  THR  19          3HG2      THR  19   4.198 -18.198  -4.447
  136    H    LEU  20           H        LEU  20   5.249 -15.393  -1.957
  137    HA   LEU  20           HA       LEU  20   7.030 -13.215  -2.563
  138   1HB   LEU  20          2HB       LEU  20   6.936 -14.458  -0.372
  139   2HB   LEU  20          1HB       LEU  20   7.726 -15.817  -1.171
  140    HG   LEU  20           HG       LEU  20   9.564 -14.168  -1.849
  141   1HD1  LEU  20          1HD1      LEU  20   8.231 -12.119  -1.403
  142   2HD1  LEU  20          2HD1      LEU  20   9.741 -12.130  -0.490
  143   3HD1  LEU  20          3HD1      LEU  20   8.221 -12.519   0.314
  144   1HD2  LEU  20          1HD2      LEU  20   9.431 -15.827   0.219
  145   2HD2  LEU  20          2HD2      LEU  20   9.407 -14.325   1.141
  146   3HD2  LEU  20          3HD2      LEU  20  10.764 -14.682   0.073
  147    H    THR  21           H        THR  21   8.782 -13.100  -3.921
  148    HA   THR  21           HA       THR  21   9.180 -15.374  -5.802
  149    HB   THR  21           HB       THR  21  10.458 -13.646  -7.145
  150    HG1  THR  21           HG1      THR  21  10.905 -11.868  -6.159
  151   1HG2  THR  21          1HG2      THR  21   7.843 -12.359  -6.749
  152   2HG2  THR  21          2HG2      THR  21   7.760 -14.107  -6.970
  153   3HG2  THR  21          3HG2      THR  21   8.528 -13.099  -8.196
  154    H    SER  22           H        SER  22  10.248 -16.009  -3.401
  155    HA   SER  22           HA       SER  22  13.155 -15.954  -3.947
  156   1HB   SER  22          2HB       SER  22  11.853 -14.461  -1.774
  157   2HB   SER  22          1HB       SER  22  13.132 -15.534  -1.216
  158    HG   SER  22           HG       SER  22  13.968 -13.508  -1.815
  159    H    ASP  23           H        ASP  23  10.755 -16.953  -1.470
  160    HA   ASP  23           HA       ASP  23  11.752 -19.741  -1.745
  161   1HB   ASP  23          2HB       ASP  23  11.735 -19.965   0.761
  162   2HB   ASP  23          1HB       ASP  23  12.993 -18.889   0.156
  163    HA   PRO  24           HA       PRO  24   7.463 -20.682  -1.489
  164   1HB   PRO  24          2HB       PRO  24   7.664 -23.318  -0.727
  165   2HB   PRO  24          1HB       PRO  24   7.991 -22.741  -2.370
  166   1HG   PRO  24          2HG       PRO  24   9.921 -23.594  -0.261
  167   2HG   PRO  24          1HG       PRO  24  10.094 -23.635  -2.023
  168   1HD   PRO  24          2HD       PRO  24  11.239 -21.710  -0.302
  169   2HD   PRO  24          1HD       PRO  24  11.094 -21.574  -2.068
  170    H    LYS  25           H        LYS  25   9.541 -20.933   1.290
  171    HA   LYS  25           HA       LYS  25   7.789 -21.898   3.291
  172   1HB   LYS  25          2HB       LYS  25  10.184 -20.119   3.243
  173   2HB   LYS  25          1HB       LYS  25   9.199 -20.104   4.707
  174   1HG   LYS  25          2HG       LYS  25   9.619 -22.348   5.177
  175   2HG   LYS  25          1HG       LYS  25   9.970 -22.739   3.494
  176   1HD   LYS  25          2HD       LYS  25  11.972 -21.028   3.880
  177   2HD   LYS  25          1HD       LYS  25  11.741 -21.501   5.564
  178   1HE   LYS  25          2HE       LYS  25  13.125 -23.220   5.014
  179   2HE   LYS  25          1HE       LYS  25  11.658 -23.936   4.340
  180   1HZ   LYS  25          1HZ       LYS  25  13.042 -24.042   2.544
  181   2HZ   LYS  25          2HZ       LYS  25  13.896 -22.631   2.955
  182   3HZ   LYS  25          3HZ       LYS  25  12.345 -22.521   2.269
  183    H    LEU  26           H        LEU  26   8.359 -18.490   2.320
  184    HA   LEU  26           HA       LEU  26   6.358 -17.348   4.007
  185   1HB   LEU  26          2HB       LEU  26   8.279 -16.318   2.403
  186   2HB   LEU  26          1HB       LEU  26   6.872 -16.061   1.372
  187    HG   LEU  26           HG       LEU  26   6.253 -15.332   4.107
  188   1HD1  LEU  26          1HD1      LEU  26   7.776 -13.420   4.317
  189   2HD1  LEU  26          2HD1      LEU  26   8.581 -13.874   2.815
  190   3HD1  LEU  26          3HD1      LEU  26   8.702 -14.917   4.233
  191   1HD2  LEU  26          1HD2      LEU  26   5.161 -13.628   3.034
  192   2HD2  LEU  26          2HD2      LEU  26   5.457 -14.622   1.606
  193   3HD2  LEU  26          3HD2      LEU  26   6.533 -13.276   1.983
  194    HA   PRO  27           HA       PRO  27   2.804 -18.832   1.753
  195   1HB   PRO  27          2HB       PRO  27   0.946 -17.680   3.423
  196   2HB   PRO  27          1HB       PRO  27   1.802 -19.187   3.796
  197   1HG   PRO  27          2HG       PRO  27   2.218 -16.460   4.929
  198   2HG   PRO  27          1HG       PRO  27   2.557 -18.041   5.653
  199   1HD   PRO  27          2HD       PRO  27   4.469 -16.305   4.496
  200   2HD   PRO  27          1HD       PRO  27   4.728 -18.010   4.921
  201    H    PHE  28           H        PHE  28   1.501 -17.925   0.158
  202    HA   PHE  28           HA       PHE  28   1.989 -15.223  -0.690
  203   1HB   PHE  28          2HB       PHE  28   0.165 -15.647  -2.345
  204   2HB   PHE  28          1HB       PHE  28   1.380 -16.920  -2.324
  205    HD1  PHE  28           HD1      PHE  28   0.818 -19.165  -1.726
  206    HD2  PHE  28           HD2      PHE  28  -2.033 -16.003  -1.147
  207    HE1  PHE  28           HE1      PHE  28  -0.947 -20.841  -1.255
  208    HE2  PHE  28           HE2      PHE  28  -3.795 -17.681  -0.674
  209    HZ   PHE  28           HZ       PHE  28  -3.252 -20.099  -0.727
  210    H    LYS  29           H        LYS  29   0.404 -13.476  -0.849
  211    HA   LYS  29           HA       LYS  29  -1.442 -13.449   1.499
  212   1HB   LYS  29          2HB       LYS  29   0.528 -11.669   0.822
  213   2HB   LYS  29          1HB       LYS  29  -0.890 -10.905   0.104
  214   1HG   LYS  29          2HG       LYS  29  -1.296 -11.977   2.833
  215   2HG   LYS  29          1HG       LYS  29  -0.173 -10.621   2.721
  216   1HD   LYS  29          2HD       LYS  29  -1.910  -9.371   1.405
  217   2HD   LYS  29          1HD       LYS  29  -3.035 -10.692   1.727
  218   1HE   LYS  29          2HE       LYS  29  -2.308 -10.283   4.238
  219   2HE   LYS  29          1HE       LYS  29  -1.875  -8.686   3.631
  220   1HZ   LYS  29          1HZ       LYS  29  -4.177  -8.841   4.469
  221   2HZ   LYS  29          2HZ       LYS  29  -4.528  -9.957   3.238
  222   3HZ   LYS  29          3HZ       LYS  29  -4.090  -8.363   2.844
  223    H    VAL  30           H        VAL  30  -3.601 -13.352   1.149
  224    HA   VAL  30           HA       VAL  30  -4.561 -12.957  -1.648
  225    HB   VAL  30           HB       VAL  30  -6.052 -14.059   0.759
  226   1HG1  VAL  30          1HG1      VAL  30  -7.866 -13.877  -0.560
  227   2HG1  VAL  30          2HG1      VAL  30  -7.097 -14.954  -1.727
  228   3HG1  VAL  30          3HG1      VAL  30  -6.884 -13.209  -1.863
  229   1HG2  VAL  30          1HG2      VAL  30  -4.158 -15.508   0.101
  230   2HG2  VAL  30          2HG2      VAL  30  -4.732 -15.498  -1.567
  231   3HG2  VAL  30          3HG2      VAL  30  -5.699 -16.262  -0.306
  232    H    LEU  31           H        LEU  31  -5.546 -11.052  -2.145
  233    HA   LEU  31           HA       LEU  31  -6.578  -9.375   0.112
  234   1HB   LEU  31          2HB       LEU  31  -4.802  -8.745  -2.167
  235   2HB   LEU  31          1HB       LEU  31  -6.088  -7.572  -1.883
  236    HG   LEU  31           HG       LEU  31  -4.825  -8.440   0.604
  237   1HD1  LEU  31          1HD1      LEU  31  -2.985  -8.428  -1.342
  238   2HD1  LEU  31          2HD1      LEU  31  -2.632  -7.810   0.272
  239   3HD1  LEU  31          3HD1      LEU  31  -3.040  -6.694  -1.031
  240   1HD2  LEU  31          1HD2      LEU  31  -5.217  -5.762  -0.771
  241   2HD2  LEU  31          2HD2      LEU  31  -4.674  -5.964   0.893
  242   3HD2  LEU  31          3HD2      LEU  31  -6.290  -6.488   0.425
  243    H    SER  32           H        SER  32  -8.756  -9.237   0.033
  244    HA   SER  32           HA       SER  32 -10.104  -9.419  -2.630
  245   1HB   SER  32          2HB       SER  32 -10.584 -10.840  -0.281
  246   2HB   SER  32          1HB       SER  32 -11.848  -9.613  -0.292
  247    HG   SER  32           HG       SER  32 -12.439 -11.502  -1.459
  248    H    VAL  33           H        VAL  33 -10.448  -7.371  -3.364
  249    HA   VAL  33           HA       VAL  33 -11.803  -5.446  -1.526
  250    HB   VAL  33           HB       VAL  33 -10.455  -3.608  -2.669
  251   1HG1  VAL  33          1HG1      VAL  33  -9.300  -5.652  -0.795
  252   2HG1  VAL  33          2HG1      VAL  33  -9.802  -3.994  -0.464
  253   3HG1  VAL  33          3HG1      VAL  33  -8.302  -4.304  -1.336
  254   1HG2  VAL  33          1HG2      VAL  33  -9.681  -5.036  -4.572
  255   2HG2  VAL  33          2HG2      VAL  33  -8.688  -5.953  -3.441
  256   3HG2  VAL  33          3HG2      VAL  33  -8.349  -4.247  -3.728
  257    HA   PRO  34           HA       PRO  34 -14.519  -4.837  -4.928
  258   1HB   PRO  34          2HB       PRO  34 -15.346  -2.264  -4.413
  259   2HB   PRO  34          1HB       PRO  34 -15.893  -3.675  -3.491
  260   1HG   PRO  34          2HG       PRO  34 -13.936  -1.561  -2.709
  261   2HG   PRO  34          1HG       PRO  34 -14.985  -2.555  -1.684
  262   1HD   PRO  34          2HD       PRO  34 -12.227  -2.974  -2.099
  263   2HD   PRO  34          1HD       PRO  34 -13.361  -4.151  -1.402
  264    H    GLU  35           H        GLU  35 -14.803  -3.579  -6.931
  265    HA   GLU  35           HA       GLU  35 -12.334  -2.727  -8.135
  266   1HB   GLU  35          2HB       GLU  35 -15.230  -2.646  -8.965
  267   2HB   GLU  35          1HB       GLU  35 -14.014  -1.814  -9.932
  268   1HG   GLU  35          2HG       GLU  35 -13.818  -3.849 -10.953
  269   2HG   GLU  35          1HG       GLU  35 -12.775  -4.204  -9.576
  270    H    SER  36           H        SER  36 -11.616  -1.113  -6.637
  271    HA   SER  36           HA       SER  36 -12.081   1.587  -7.390
  272   1HB   SER  36          2HB       SER  36 -13.168   2.308  -5.156
  273   2HB   SER  36          1HB       SER  36 -14.220   1.577  -6.362
  274    HG   SER  36           HG       SER  36 -14.398   0.730  -4.164
  275    H    THR  37           H        THR  37 -11.147  -0.639  -4.772
  276    HA   THR  37           HA       THR  37  -9.402   1.153  -3.369
  277    HB   THR  37           HB       THR  37  -9.318  -1.870  -3.644
  278    HG1  THR  37           HG1      THR  37 -11.149  -1.274  -2.609
  279   1HG2  THR  37          1HG2      THR  37  -7.804   0.033  -1.849
  280   2HG2  THR  37          2HG2      THR  37  -7.147  -1.212  -2.911
  281   3HG2  THR  37          3HG2      THR  37  -8.022  -1.670  -1.451
  282    HA   PRO  38           HA       PRO  38  -6.229   1.413  -6.461
  283   1HB   PRO  38          2HB       PRO  38  -4.461   2.878  -4.947
  284   2HB   PRO  38          1HB       PRO  38  -5.877   3.571  -5.757
  285   1HG   PRO  38          2HG       PRO  38  -5.475   2.972  -2.860
  286   2HG   PRO  38          1HG       PRO  38  -6.500   4.201  -3.620
  287   1HD   PRO  38          2HD       PRO  38  -7.399   1.748  -2.560
  288   2HD   PRO  38          1HD       PRO  38  -8.320   2.802  -3.653
  289    H    PHE  39           H        PHE  39  -4.079   0.597  -6.824
  290    HA   PHE  39           HA       PHE  39  -3.430  -1.810  -5.411
  291   1HB   PHE  39          2HB       PHE  39  -2.803  -0.946  -7.850
  292   2HB   PHE  39          1HB       PHE  39  -1.342  -0.409  -7.027
  293    HD1  PHE  39           HD1      PHE  39  -3.592  -3.421  -7.013
  294    HD2  PHE  39           HD2      PHE  39   0.433  -1.921  -7.022
  295    HE1  PHE  39           HE1      PHE  39  -2.725  -5.744  -7.054
  296    HE2  PHE  39           HE2      PHE  39   1.297  -4.241  -7.064
  297    HZ   PHE  39           HZ       PHE  39  -0.281  -6.153  -7.079
  298    H    THR  40           H        THR  40  -2.687   1.500  -4.721
  299    HA   THR  40           HA       THR  40  -0.188   1.213  -3.360
  300    HB   THR  40           HB       THR  40  -1.364   3.153  -1.890
  301    HG1  THR  40           HG1      THR  40  -3.222   3.666  -2.667
  302   1HG2  THR  40          1HG2      THR  40  -0.056   4.545  -3.114
  303   2HG2  THR  40          2HG2      THR  40  -0.786   4.050  -4.642
  304   3HG2  THR  40          3HG2      THR  40   0.470   3.060  -3.900
  305    H    ALA  41           H        ALA  41  -3.553   0.977  -2.187
  306    HA   ALA  41           HA       ALA  41  -2.791   0.207   0.507
  307   1HB   ALA  41          1HB       ALA  41  -4.960   1.260   0.091
  308   2HB   ALA  41          2HB       ALA  41  -5.211  -0.359   0.743
  309   3HB   ALA  41          3HB       ALA  41  -5.423  -0.061  -0.982
  310    H    VAL  42           H        VAL  42  -3.817  -1.559  -2.426
  311    HA   VAL  42           HA       VAL  42  -3.991  -4.163  -1.274
  312    HB   VAL  42           HB       VAL  42  -3.116  -3.374  -4.077
  313   1HG1  VAL  42          1HG1      VAL  42  -3.452  -5.600  -4.736
  314   2HG1  VAL  42          2HG1      VAL  42  -4.412  -5.981  -3.307
  315   3HG1  VAL  42          3HG1      VAL  42  -2.664  -5.788  -3.170
  316   1HG2  VAL  42          1HG2      VAL  42  -5.320  -2.498  -3.608
  317   2HG2  VAL  42          2HG2      VAL  42  -5.819  -4.013  -2.858
  318   3HG2  VAL  42          3HG2      VAL  42  -5.527  -3.942  -4.597
  319    H    LEU  43           H        LEU  43  -1.216  -2.551  -2.859
  320    HA   LEU  43           HA       LEU  43   0.680  -4.646  -2.395
  321   1HB   LEU  43          2HB       LEU  43   0.890  -2.620  -3.962
  322   2HB   LEU  43          1HB       LEU  43   1.356  -1.700  -2.531
  323    HG   LEU  43           HG       LEU  43   2.786  -4.252  -2.766
  324   1HD1  LEU  43          1HD1      LEU  43   2.598  -3.791  -5.160
  325   2HD1  LEU  43          2HD1      LEU  43   4.247  -3.465  -4.627
  326   3HD1  LEU  43          3HD1      LEU  43   3.129  -2.130  -4.907
  327   1HD2  LEU  43          1HD2      LEU  43   4.439  -1.902  -2.845
  328   2HD2  LEU  43          2HD2      LEU  43   4.194  -3.022  -1.506
  329   3HD2  LEU  43          3HD2      LEU  43   3.129  -1.631  -1.698
  330    H    LYS  44           H        LYS  44  -0.402  -1.925  -0.401
  331    HA   LYS  44           HA       LYS  44   1.648  -2.054   1.594
  332   1HB   LYS  44          2HB       LYS  44  -0.760  -0.598   1.169
  333   2HB   LYS  44          1HB       LYS  44  -0.875  -1.327   2.770
  334   1HG   LYS  44          2HG       LYS  44   1.775  -0.374   2.549
  335   2HG   LYS  44          1HG       LYS  44   0.744   0.907   1.912
  336   1HD   LYS  44          2HD       LYS  44  -0.365   1.208   3.924
  337   2HD   LYS  44          1HD       LYS  44  -0.078  -0.452   4.448
  338   1HE   LYS  44          2HE       LYS  44   2.458   0.317   4.404
  339   2HE   LYS  44          1HE       LYS  44   1.745   1.921   4.587
  340   1HZ   LYS  44          1HZ       LYS  44   2.187   0.970   6.735
  341   2HZ   LYS  44          2HZ       LYS  44   1.292  -0.421   6.353
  342   3HZ   LYS  44          3HZ       LYS  44   0.510   1.079   6.512
  343    H    PHE  45           H        PHE  45  -1.611  -3.552   1.499
  344    HA   PHE  45           HA       PHE  45  -1.362  -4.977   3.967
  345   1HB   PHE  45          2HB       PHE  45  -3.078  -5.301   1.517
  346   2HB   PHE  45          1HB       PHE  45  -3.116  -6.525   2.786
  347    HD1  PHE  45           HD1      PHE  45  -4.410  -3.382   1.720
  348    HD2  PHE  45           HD2      PHE  45  -3.421  -5.647   5.236
  349    HE1  PHE  45           HE1      PHE  45  -5.901  -1.934   3.072
  350    HE2  PHE  45           HE2      PHE  45  -4.913  -4.198   6.586
  351    HZ   PHE  45           HZ       PHE  45  -6.152  -2.343   5.505
  352    H    ALA  46           H        ALA  46  -0.640  -5.950   0.602
  353    HA   ALA  46           HA       ALA  46   0.123  -8.645   1.175
  354   1HB   ALA  46          1HB       ALA  46   1.113  -6.788  -1.014
  355   2HB   ALA  46          2HB       ALA  46  -0.287  -7.855  -1.117
  356   3HB   ALA  46          3HB       ALA  46   1.333  -8.538  -0.988
  357    H    ALA  47           H        ALA  47   1.997  -5.615   1.122
  358    HA   ALA  47           HA       ALA  47   4.554  -6.839   1.656
  359   1HB   ALA  47          1HB       ALA  47   3.843  -4.032   2.487
  360   2HB   ALA  47          2HB       ALA  47   4.009  -4.444   0.780
  361   3HB   ALA  47          3HB       ALA  47   5.377  -4.646   1.874
  362    H    GLU  48           H        GLU  48   1.911  -5.705   3.708
  363    HA   GLU  48           HA       GLU  48   3.273  -5.624   6.210
  364   1HB   GLU  48          2HB       GLU  48   0.519  -5.610   5.272
  365   2HB   GLU  48          1HB       GLU  48   0.680  -6.561   6.748
  366   1HG   GLU  48          2HG       GLU  48   0.547  -4.555   7.807
  367   2HG   GLU  48          1HG       GLU  48   2.235  -4.376   7.334
  368    H    GLU  49           H        GLU  49   1.414  -8.304   4.718
  369    HA   GLU  49           HA       GLU  49   2.095 -10.224   6.770
  370   1HB   GLU  49          2HB       GLU  49   0.135 -10.415   5.196
  371   2HB   GLU  49          1HB       GLU  49   1.276 -10.774   3.900
  372   1HG   GLU  49          2HG       GLU  49   1.814 -12.436   6.219
  373   2HG   GLU  49          1HG       GLU  49   0.138 -12.614   5.700
  374    H    PHE  50           H        PHE  50   3.588  -9.250   3.720
  375    HA   PHE  50           HA       PHE  50   5.486 -11.452   3.645
  376   1HB   PHE  50          2HB       PHE  50   5.056  -8.919   2.109
  377   2HB   PHE  50          1HB       PHE  50   6.618  -9.726   1.981
  378    HD1  PHE  50           HD1      PHE  50   3.170 -11.154   2.394
  379    HD2  PHE  50           HD2      PHE  50   6.648 -10.795  -0.106
  380    HE1  PHE  50           HE1      PHE  50   2.207 -12.803   0.815
  381    HE2  PHE  50           HE2      PHE  50   5.680 -12.441  -1.681
  382    HZ   PHE  50           HZ       PHE  50   3.464 -13.448  -1.222
  383    H    LYS  51           H        LYS  51   5.318  -8.708   5.623
  384    HA   LYS  51           HA       LYS  51   6.841  -7.770   7.125
  385   1HB   LYS  51          2HB       LYS  51   7.752 -10.457   6.672
  386   2HB   LYS  51          1HB       LYS  51   9.158  -9.399   6.786
  387   1HG   LYS  51          2HG       LYS  51   8.872  -9.683   9.031
  388   2HG   LYS  51          1HG       LYS  51   7.650  -8.427   8.832
  389   1HD   LYS  51          2HD       LYS  51   6.481 -10.954   8.134
  390   2HD   LYS  51          1HD       LYS  51   7.267 -11.113   9.705
  391   1HE   LYS  51          2HE       LYS  51   5.858  -9.604  10.718
  392   2HE   LYS  51          1HE       LYS  51   5.658  -8.648   9.251
  393   1HZ   LYS  51          1HZ       LYS  51   4.467 -10.844   8.464
  394   2HZ   LYS  51          2HZ       LYS  51   3.639  -9.643   9.335
  395   3HZ   LYS  51          3HZ       LYS  51   4.213 -11.031  10.131
  396    H    VAL  52           H        VAL  52   6.741  -6.804   4.419
  397    HA   VAL  52           HA       VAL  52   9.530  -5.760   4.168
  398    HB   VAL  52           HB       VAL  52   9.156  -5.710   1.666
  399   1HG1  VAL  52          1HG1      VAL  52  10.540  -7.450   2.681
  400   2HG1  VAL  52          2HG1      VAL  52   9.587  -8.145   1.370
  401   3HG1  VAL  52          3HG1      VAL  52   9.108  -8.410   3.047
  402   1HG2  VAL  52          1HG2      VAL  52   6.868  -7.588   2.333
  403   2HG2  VAL  52          2HG2      VAL  52   7.397  -7.102   0.723
  404   3HG2  VAL  52          3HG2      VAL  52   6.660  -5.921   1.805
  405    HA   PRO  53           HA       PRO  53   7.590  -1.817   4.085
  406   1HB   PRO  53          2HB       PRO  53   9.461  -0.406   2.646
  407   2HB   PRO  53          1HB       PRO  53   9.676  -0.896   4.334
  408   1HG   PRO  53          2HG       PRO  53  10.921  -2.037   1.874
  409   2HG   PRO  53          1HG       PRO  53  11.532  -2.025   3.537
  410   1HD   PRO  53          2HD       PRO  53  10.323  -4.225   2.236
  411   2HD   PRO  53          1HD       PRO  53  10.621  -4.082   3.982
  412    H    ALA  54           H        ALA  54   5.882  -1.191   2.865
  413    HA   ALA  54           HA       ALA  54   5.546  -1.998   0.105
  414   1HB   ALA  54          1HB       ALA  54   3.985  -0.312   2.038
  415   2HB   ALA  54          2HB       ALA  54   3.512  -1.803   1.224
  416   3HB   ALA  54          3HB       ALA  54   3.559  -0.284   0.327
  417    H    ALA  55           H        ALA  55   6.709   0.938   1.667
  418    HA   ALA  55           HA       ALA  55   6.440   2.750  -0.521
  419   1HB   ALA  55          1HB       ALA  55   8.572   2.672   1.636
  420   2HB   ALA  55          2HB       ALA  55   7.012   3.484   1.762
  421   3HB   ALA  55          3HB       ALA  55   8.212   4.055   0.602
  422    H    THR  56           H        THR  56   9.083   0.498   0.335
  423    HA   THR  56           HA       THR  56  10.316   1.083  -2.328
  424    HB   THR  56           HB       THR  56  12.398   0.068  -1.306
  425    HG1  THR  56           HG1      THR  56  12.029  -0.934   0.492
  426   1HG2  THR  56          1HG2      THR  56  13.067   2.126  -0.550
  427   2HG2  THR  56          2HG2      THR  56  11.642   2.333   0.468
  428   3HG2  THR  56          3HG2      THR  56  11.532   2.612  -1.269
  429    H    SER  57           H        SER  57   8.096  -0.643  -2.219
  430    HA   SER  57           HA       SER  57   9.382  -3.200  -3.031
  431   1HB   SER  57          2HB       SER  57   8.550  -3.527  -0.726
  432   2HB   SER  57          1HB       SER  57   6.944  -3.016  -1.234
  433    HG   SER  57           HG       SER  57   7.000  -5.230  -1.329
  434    H    ALA  58           H        ALA  58   8.266  -4.289  -4.679
  435    HA   ALA  58           HA       ALA  58   5.865  -2.906  -5.803
  436   1HB   ALA  58          1HB       ALA  58   6.746  -3.107  -8.031
  437   2HB   ALA  58          2HB       ALA  58   8.099  -4.090  -7.470
  438   3HB   ALA  58          3HB       ALA  58   8.016  -2.379  -7.048
  439    H    ILE  59           H        ILE  59   4.762  -4.403  -7.474
  440    HA   ILE  59           HA       ILE  59   4.996  -7.260  -6.614
  441    HB   ILE  59           HB       ILE  59   2.553  -5.511  -6.850
  442   1HG1  ILE  59          2HG1      ILE  59   3.219  -7.711  -4.879
  443   2HG1  ILE  59          1HG1      ILE  59   3.766  -6.049  -4.661
  444   1HG2  ILE  59          1HG2      ILE  59   1.102  -7.372  -7.118
  445   2HG2  ILE  59          2HG2      ILE  59   2.398  -8.530  -6.824
  446   3HG2  ILE  59          3HG2      ILE  59   2.356  -7.616  -8.331
  447   1HD1  ILE  59          1HD1      ILE  59   0.929  -7.084  -4.731
  448   2HD1  ILE  59          2HD1      ILE  59   1.300  -5.376  -4.957
  449   3HD1  ILE  59          3HD1      ILE  59   1.728  -6.177  -3.447
  450    H    ILE  60           H        ILE  60   5.493  -8.507  -8.350
  451    HA   ILE  60           HA       ILE  60   4.907  -7.451 -11.070
  452    HB   ILE  60           HB       ILE  60   6.472  -9.203 -11.863
  453   1HG1  ILE  60          2HG1      ILE  60   7.548  -9.856  -9.223
  454   2HG1  ILE  60          1HG1      ILE  60   5.889 -10.422  -9.419
  455   1HG2  ILE  60          1HG2      ILE  60   7.438  -7.060 -11.361
  456   2HG2  ILE  60          2HG2      ILE  60   8.527  -8.282 -10.708
  457   3HG2  ILE  60          3HG2      ILE  60   7.442  -7.401  -9.633
  458   1HD1  ILE  60          1HD1      ILE  60   6.718 -11.293 -11.737
  459   2HD1  ILE  60          2HD1      ILE  60   7.139 -12.207 -10.289
  460   3HD1  ILE  60          3HD1      ILE  60   8.326 -11.136 -11.033
  461    H    THR  61           H        THR  61   4.302  -9.268 -12.706
  462    HA   THR  61           HA       THR  61   2.085 -10.854 -11.494
  463    HB   THR  61           HB       THR  61   2.541 -10.186 -14.421
  464    HG1  THR  61           HG1      THR  61   2.085  -8.271 -13.564
  465   1HG2  THR  61          1HG2      THR  61   0.349 -11.498 -12.840
  466   2HG2  THR  61          2HG2      THR  61   1.058 -11.992 -14.377
  467   3HG2  THR  61          3HG2      THR  61  -0.044 -10.617 -14.316
  468    H    ASN  62           H        ASN  62   1.761 -13.068 -12.295
  469    HA   ASN  62           HA       ASN  62   4.082 -14.687 -12.210
  470   1HB   ASN  62          2HB       ASN  62   1.224 -15.108 -12.932
  471   2HB   ASN  62          1HB       ASN  62   2.367 -16.342 -13.459
  472   1HD2  ASN  62          1HD2      ASN  62   3.189 -17.779 -11.869
  473   2HD2  ASN  62          2HD2      ASN  62   2.829 -17.655 -10.215
  474    H    ASP  63           H        ASP  63   2.607 -13.051 -14.939
  475    HA   ASP  63           HA       ASP  63   3.965 -14.663 -16.965
  476   1HB   ASP  63          2HB       ASP  63   2.537 -11.989 -17.122
  477   2HB   ASP  63          1HB       ASP  63   3.172 -12.858 -18.519
  478    H    GLY  64           H        GLY  64   4.403 -11.375 -15.608
  479   1HA   GLY  64          2HA       GLY  64   6.982 -11.056 -15.175
  480   2HA   GLY  64          1HA       GLY  64   7.071 -11.236 -16.927
  481    H    VAL  65           H        VAL  65   4.888  -9.438 -14.717
  482    HA   VAL  65           HA       VAL  65   5.578  -6.949 -16.227
  483    HB   VAL  65           HB       VAL  65   2.796  -7.675 -15.250
  484   1HG1  VAL  65          1HG1      VAL  65   3.178  -5.276 -15.336
  485   2HG1  VAL  65          2HG1      VAL  65   2.176  -5.731 -16.713
  486   3HG1  VAL  65          3HG1      VAL  65   3.894  -5.409 -16.941
  487   1HG2  VAL  65          1HG2      VAL  65   4.120  -7.926 -17.955
  488   2HG2  VAL  65          2HG2      VAL  65   2.371  -7.757 -17.798
  489   3HG2  VAL  65          3HG2      VAL  65   3.193  -9.140 -17.075
  490    H    GLY  66           H        GLY  66   6.424  -5.506 -14.825
  491   1HA   GLY  66          2HA       GLY  66   6.262  -5.854 -11.954
  492   2HA   GLY  66          1HA       GLY  66   7.049  -4.517 -12.789
  493    H    VAL  67           H        VAL  67   4.017  -5.692 -11.497
  494    HA   VAL  67           HA       VAL  67   2.425  -3.388 -12.246
  495    HB   VAL  67           HB       VAL  67   1.904  -5.240  -9.903
  496   1HG1  VAL  67          1HG1      VAL  67  -0.458  -4.715 -10.466
  497   2HG1  VAL  67          2HG1      VAL  67   0.104  -3.630 -11.737
  498   3HG1  VAL  67          3HG1      VAL  67   0.459  -3.268 -10.048
  499   1HG2  VAL  67          1HG2      VAL  67   2.182  -5.956 -12.644
  500   2HG2  VAL  67          2HG2      VAL  67   0.459  -5.970 -12.278
  501   3HG2  VAL  67          3HG2      VAL  67   1.569  -6.953 -11.326
  502    H    ASN  68           H        ASN  68   2.341  -1.429 -11.270
  503    HA   ASN  68           HA       ASN  68   3.914  -1.041  -8.767
  504   1HB   ASN  68          2HB       ASN  68   2.978   0.865 -10.926
  505   2HB   ASN  68          1HB       ASN  68   3.682   1.421  -9.406
  506   1HD2  ASN  68          1HD2      ASN  68   4.422   0.102 -12.542
  507   2HD2  ASN  68          2HD2      ASN  68   6.098  -0.036 -12.316
  508    HA   PRO  69           HA       PRO  69   0.294  -0.177  -6.426
  509   1HB   PRO  69          2HB       PRO  69   1.334   1.604  -4.604
  510   2HB   PRO  69          1HB       PRO  69   1.653  -0.138  -4.565
  511   1HG   PRO  69          2HG       PRO  69   3.450   2.080  -5.420
  512   2HG   PRO  69          1HG       PRO  69   3.865   0.480  -4.784
  513   1HD   PRO  69          2HD       PRO  69   3.950   1.259  -7.506
  514   2HD   PRO  69          1HD       PRO  69   4.056  -0.403  -6.889
  515    H    ALA  70           H        ALA  70  -0.314   1.061  -8.608
  516    HA   ALA  70           HA       ALA  70  -1.082   3.829  -7.825
  517   1HB   ALA  70          1HB       ALA  70   0.948   4.049  -9.200
  518   2HB   ALA  70          2HB       ALA  70  -0.457   4.673 -10.065
  519   3HB   ALA  70          3HB       ALA  70   0.198   3.087 -10.474
  520    H    GLN  71           H        GLN  71  -1.458   1.295 -10.342
  521    HA   GLN  71           HA       GLN  71  -3.943   2.256 -11.383
  522   1HB   GLN  71          2HB       GLN  71  -2.623  -0.457 -11.361
  523   2HB   GLN  71          1HB       GLN  71  -4.204  -0.212 -12.101
  524   1HG   GLN  71          2HG       GLN  71  -3.354   1.038 -13.830
  525   2HG   GLN  71          1HG       GLN  71  -2.069   1.729 -12.837
  526   1HE2  GLN  71          1HE2      GLN  71  -0.143   0.332 -12.415
  527   2HE2  GLN  71          2HE2      GLN  71   0.226  -0.937 -13.480
  528    HA   PRO  72           HA       PRO  72  -6.862   0.982  -8.337
  529   1HB   PRO  72          2HB       PRO  72  -9.061   0.643  -9.952
  530   2HB   PRO  72          1HB       PRO  72  -8.420   2.229  -9.488
  531   1HG   PRO  72          2HG       PRO  72  -8.215   0.814 -12.102
  532   2HG   PRO  72          1HG       PRO  72  -8.176   2.551 -11.762
  533   1HD   PRO  72          2HD       PRO  72  -5.928   0.920 -12.313
  534   2HD   PRO  72          1HD       PRO  72  -5.887   2.568 -11.648
  535    H    ALA  73           H        ALA  73  -8.098  -0.883  -7.610
  536    HA   ALA  73           HA       ALA  73  -6.997  -3.422  -8.190
  537   1HB   ALA  73          1HB       ALA  73  -8.102  -3.555  -6.197
  538   2HB   ALA  73          2HB       ALA  73  -9.445  -4.090  -7.206
  539   3HB   ALA  73          3HB       ALA  73  -9.344  -2.407  -6.693
  540    H    GLY  74           H        GLY  74  -9.998  -1.930  -9.440
  541   1HA   GLY  74          2HA       GLY  74 -10.978  -4.126 -10.926
  542   2HA   GLY  74          1HA       GLY  74 -11.257  -2.439 -11.353
  543    H    ASN  75           H        ASN  75  -8.669  -1.580 -11.939
  544    HA   ASN  75           HA       ASN  75  -8.284  -2.697 -14.588
  545   1HB   ASN  75          2HB       ASN  75  -7.642  -0.306 -13.358
  546   2HB   ASN  75          1HB       ASN  75  -6.069  -1.082 -13.535
  547   1HD2  ASN  75          1HD2      ASN  75  -5.116  -0.398 -15.461
  548   2HD2  ASN  75          2HD2      ASN  75  -5.939  -0.169 -16.929
  549    H    ILE  76           H        ILE  76  -6.547  -2.997 -11.492
  550    HA   ILE  76           HA       ILE  76  -4.259  -4.401 -12.460
  551    HB   ILE  76           HB       ILE  76  -5.669  -4.540  -9.776
  552   1HG1  ILE  76          2HG1      ILE  76  -4.683  -2.331 -10.556
  553   2HG1  ILE  76          1HG1      ILE  76  -4.014  -2.951  -9.049
  554   1HG2  ILE  76          1HG2      ILE  76  -4.345  -6.321  -9.357
  555   2HG2  ILE  76          2HG2      ILE  76  -2.984  -5.204  -9.418
  556   3HG2  ILE  76          3HG2      ILE  76  -3.453  -6.103 -10.860
  557   1HD1  ILE  76          1HD1      ILE  76  -1.951  -3.016  -9.944
  558   2HD1  ILE  76          2HD1      ILE  76  -2.597  -2.257 -11.397
  559   3HD1  ILE  76          3HD1      ILE  76  -2.522  -4.014 -11.281
  560    H    PHE  77           H        PHE  77  -7.460  -5.573 -11.417
  561    HA   PHE  77           HA       PHE  77  -6.787  -8.381 -11.790
  562   1HB   PHE  77          2HB       PHE  77  -8.653  -7.372 -10.304
  563   2HB   PHE  77          1HB       PHE  77  -9.586  -7.249 -11.795
  564    HD1  PHE  77           HD1      PHE  77 -10.292  -9.256 -13.019
  565    HD2  PHE  77           HD2      PHE  77  -8.080  -9.548  -9.347
  566    HE1  PHE  77           HE1      PHE  77 -10.881 -11.659 -12.854
  567    HE2  PHE  77           HE2      PHE  77  -8.671 -11.952  -9.184
  568    HZ   PHE  77           HZ       PHE  77 -10.070 -13.006 -10.938
  569    H    LEU  78           H        LEU  78  -8.383  -5.879 -13.749
  570    HA   LEU  78           HA       LEU  78  -9.257  -7.607 -15.871
  571   1HB   LEU  78          2HB       LEU  78  -8.703  -4.645 -15.683
  572   2HB   LEU  78          1HB       LEU  78  -9.165  -5.389 -17.214
  573    HG   LEU  78           HG       LEU  78 -10.778  -5.794 -14.688
  574   1HD1  LEU  78          1HD1      LEU  78 -12.194  -3.962 -15.324
  575   2HD1  LEU  78          2HD1      LEU  78 -11.337  -3.748 -16.850
  576   3HD1  LEU  78          3HD1      LEU  78 -10.543  -3.342 -15.329
  577   1HD2  LEU  78          1HD2      LEU  78 -12.560  -6.286 -16.369
  578   2HD2  LEU  78          2HD2      LEU  78 -11.187  -7.383 -16.505
  579   3HD2  LEU  78          3HD2      LEU  78 -11.374  -6.058 -17.654
  580    H    LYS  79           H        LYS  79  -6.220  -5.832 -15.322
  581    HA   LYS  79           HA       LYS  79  -5.142  -6.679 -17.928
  582   1HB   LYS  79          2HB       LYS  79  -4.608  -4.570 -16.132
  583   2HB   LYS  79          1HB       LYS  79  -3.162  -5.581 -16.123
  584   1HG   LYS  79          2HG       LYS  79  -3.428  -5.566 -18.720
  585   2HG   LYS  79          1HG       LYS  79  -4.450  -4.156 -18.440
  586   1HD   LYS  79          2HD       LYS  79  -2.600  -2.888 -18.270
  587   2HD   LYS  79          1HD       LYS  79  -2.136  -3.808 -16.839
  588   1HE   LYS  79          2HE       LYS  79  -1.479  -5.511 -18.936
  589   2HE   LYS  79          1HE       LYS  79  -1.038  -3.918 -19.549
  590   1HZ   LYS  79          1HZ       LYS  79   0.310  -5.491 -17.663
  591   2HZ   LYS  79          2HZ       LYS  79  -0.217  -4.079 -16.880
  592   3HZ   LYS  79          3HZ       LYS  79   0.751  -3.971 -18.271
  593    H    HIS  80           H        HIS  80  -4.184  -7.173 -14.495
  594    HA   HIS  80           HA       HIS  80  -2.503  -9.465 -15.340
  595   1HB   HIS  80          2HB       HIS  80  -2.833  -8.408 -12.525
  596   2HB   HIS  80          1HB       HIS  80  -1.493  -9.348 -13.184
  597    HD1  HIS  80           HD1      HIS  80  -0.129  -8.064 -15.198
  598    HD2  HIS  80           HD2      HIS  80  -2.435  -5.673 -12.680
  599    HE1  HIS  80           HE1      HIS  80   0.672  -5.687 -15.536
  600    H    GLY  81           H        GLY  81  -4.949  -8.896 -12.761
  601   1HA   GLY  81          2HA       GLY  81  -6.914 -10.442 -12.679
  602   2HA   GLY  81          1HA       GLY  81  -5.814 -11.740 -13.141
  603    H    SER  82           H        SER  82  -5.516 -13.059 -11.412
  604    HA   SER  82           HA       SER  82  -5.268 -11.815  -8.702
  605   1HB   SER  82          2HB       SER  82  -7.085 -13.621  -9.308
  606   2HB   SER  82          1HB       SER  82  -5.745 -14.750  -9.131
  607    HG   SER  82           HG       SER  82  -7.070 -14.167  -7.191
  608    H    GLU  83           H        GLU  83  -3.820 -14.243 -10.882
  609    HA   GLU  83           HA       GLU  83  -1.745 -15.111  -9.127
  610   1HB   GLU  83          2HB       GLU  83  -2.434 -15.424 -11.926
  611   2HB   GLU  83          1HB       GLU  83  -0.695 -15.201 -11.739
  612   1HG   GLU  83          2HG       GLU  83  -0.788 -17.471 -11.377
  613   2HG   GLU  83          1HG       GLU  83  -1.090 -16.928  -9.725
  614    H    LEU  84           H        LEU  84  -0.508 -13.590  -8.113
  615    HA   LEU  84           HA       LEU  84   1.137 -11.789  -9.827
  616   1HB   LEU  84          2HB       LEU  84  -0.570 -10.995  -7.464
  617   2HB   LEU  84          1HB       LEU  84   0.832 -10.040  -7.947
  618    HG   LEU  84           HG       LEU  84  -1.004 -10.791 -10.147
  619   1HD1  LEU  84          1HD1      LEU  84  -1.803  -8.717  -8.083
  620   2HD1  LEU  84          2HD1      LEU  84  -2.588 -10.284  -8.293
  621   3HD1  LEU  84          3HD1      LEU  84  -2.657  -9.082  -9.582
  622   1HD2  LEU  84          1HD2      LEU  84   0.592  -8.393  -9.257
  623   2HD2  LEU  84          2HD2      LEU  84  -0.620  -8.242 -10.528
  624   3HD2  LEU  84          3HD2      LEU  84   0.748  -9.333 -10.740
  625    H    ARG  85           H        ARG  85   2.970 -10.814  -8.411
  626    HA   ARG  85           HA       ARG  85   3.811 -12.675  -6.239
  627   1HB   ARG  85          2HB       ARG  85   5.187 -12.158  -8.844
  628   2HB   ARG  85          1HB       ARG  85   6.181 -12.380  -7.406
  629   1HG   ARG  85          2HG       ARG  85   5.851 -14.605  -7.471
  630   2HG   ARG  85          1HG       ARG  85   4.103 -14.375  -7.439
  631   1HD   ARG  85          2HD       ARG  85   4.152 -15.259  -9.530
  632   2HD   ARG  85          1HD       ARG  85   4.713 -13.663 -10.023
  633    HE   ARG  85           HE       ARG  85   7.066 -14.604  -9.724
  634   1HH1  ARG  85          2HH1      ARG  85   6.263 -17.252  -8.586
  635   2HH1  ARG  85          1HH1      ARG  85   6.310 -18.283  -9.977
  636   1HH2  ARG  85          1HH2      ARG  85   6.290 -15.651 -12.255
  637   2HH2  ARG  85          2HH2      ARG  85   6.325 -17.373 -12.064
  638    H    LEU  86           H        LEU  86   5.439 -11.742  -4.811
  639    HA   LEU  86           HA       LEU  86   5.423  -8.755  -4.881
  640   1HB   LEU  86          2HB       LEU  86   4.524 -10.200  -2.866
  641   2HB   LEU  86          1HB       LEU  86   6.233 -10.338  -2.462
  642    HG   LEU  86           HG       LEU  86   5.424  -7.602  -3.163
  643   1HD1  LEU  86          1HD1      LEU  86   3.560  -7.460  -1.908
  644   2HD1  LEU  86          2HD1      LEU  86   4.540  -7.842  -0.493
  645   3HD1  LEU  86          3HD1      LEU  86   3.733  -9.134  -1.381
  646   1HD2  LEU  86          1HD2      LEU  86   7.471  -8.861  -1.801
  647   2HD2  LEU  86          2HD2      LEU  86   6.496  -8.201  -0.488
  648   3HD2  LEU  86          3HD2      LEU  86   7.130  -7.133  -1.738
  649    H    ILE  87           H        ILE  87   7.314  -7.692  -5.172
  650    HA   ILE  87           HA       ILE  87   9.873  -9.156  -4.707
  651    HB   ILE  87           HB       ILE  87   9.511  -9.192  -7.111
  652   1HG1  ILE  87          2HG1      ILE  87  11.413  -6.891  -6.628
  653   2HG1  ILE  87          1HG1      ILE  87  11.798  -8.532  -6.111
  654   1HG2  ILE  87          1HG2      ILE  87   9.580  -6.504  -7.915
  655   2HG2  ILE  87          2HG2      ILE  87   8.404  -6.551  -6.603
  656   3HG2  ILE  87          3HG2      ILE  87   8.199  -7.595  -8.007
  657   1HD1  ILE  87          1HD1      ILE  87  12.756  -8.247  -8.298
  658   2HD1  ILE  87          2HD1      ILE  87  11.253  -7.576  -8.931
  659   3HD1  ILE  87          3HD1      ILE  87  11.341  -9.281  -8.490
  660    HA   PRO  88           HA       PRO  88  10.621  -5.438  -2.400
  661   1HB   PRO  88          2HB       PRO  88  13.197  -6.074  -1.660
  662   2HB   PRO  88          1HB       PRO  88  11.755  -6.749  -0.882
  663   1HG   PRO  88          2HG       PRO  88  13.629  -8.044  -2.811
  664   2HG   PRO  88          1HG       PRO  88  12.632  -8.783  -1.546
  665   1HD   PRO  88          2HD       PRO  88  12.036  -8.771  -4.302
  666   2HD   PRO  88          1HD       PRO  88  10.893  -9.153  -2.996
  667    H    ARG  89           H        ARG  89  10.612  -4.030  -4.282
  668    HA   ARG  89           HA       ARG  89  13.007  -3.769  -5.934
  669   1HB   ARG  89          2HB       ARG  89  10.297  -2.547  -5.845
  670   2HB   ARG  89          1HB       ARG  89  11.578  -1.555  -6.543
  671   1HG   ARG  89          2HG       ARG  89  11.582  -4.371  -7.436
  672   2HG   ARG  89          1HG       ARG  89  10.168  -3.444  -7.936
  673   1HD   ARG  89          2HD       ARG  89  11.662  -2.987  -9.670
  674   2HD   ARG  89          1HD       ARG  89  11.941  -1.619  -8.592
  675    HE   ARG  89           HE       ARG  89  13.858  -3.179  -7.668
  676   1HH1  ARG  89          2HH1      ARG  89  14.691  -1.409  -9.888
  677   2HH1  ARG  89          1HH1      ARG  89  15.333  -2.522 -11.050
  678   1HH2  ARG  89          1HH2      ARG  89  13.831  -5.309  -9.604
  679   2HH2  ARG  89          2HH2      ARG  89  14.844  -4.739 -10.889
  680    H    ASP  90           H        ASP  90  14.665  -3.227  -4.449
  681    HA   ASP  90           HA       ASP  90  14.400  -0.550  -3.131
  682   1HB   ASP  90          2HB       ASP  90  16.190  -2.896  -2.413
  683   2HB   ASP  90          1HB       ASP  90  16.191  -1.337  -1.591
  684    H    ARG  91           H        ARG  91  16.840  -2.706  -4.634
  685    HA   ARG  91           HA       ARG  91  18.393  -0.292  -5.441
  686   1HB   ARG  91          2HB       ARG  91  19.072  -3.204  -5.082
  687   2HB   ARG  91          1HB       ARG  91  20.099  -2.171  -6.074
  688   1HG   ARG  91          2HG       ARG  91  20.948  -1.088  -4.269
  689   2HG   ARG  91          1HG       ARG  91  19.365  -0.952  -3.502
  690   1HD   ARG  91          2HD       ARG  91  20.829  -3.589  -3.614
  691   2HD   ARG  91          1HD       ARG  91  21.125  -2.427  -2.322
  692    HE   ARG  91           HE       ARG  91  18.293  -3.048  -2.726
  693   1HH1  ARG  91          1HH2      ARG  91  19.402  -2.258  -0.084
  694   2HH1  ARG  91          2HH2      ARG  91  19.463  -3.765   0.768
  695   1HH2  ARG  91          2HH1      ARG  91  19.170  -5.704  -2.103
  696   2HH2  ARG  91          1HH1      ARG  91  19.330  -5.719  -0.379
  697    H    VAL  92           H        VAL  92  19.696  -1.062  -7.669
  698    HA   VAL  92           HA       VAL  92  17.671  -0.926  -9.730
  699    HB   VAL  92           HB       VAL  92  20.648  -1.484  -9.968
  700   1HG1  VAL  92          1HG1      VAL  92  19.772  -2.084 -12.053
  701   2HG1  VAL  92          2HG1      VAL  92  20.115  -0.370 -12.285
  702   3HG1  VAL  92          3HG1      VAL  92  18.465  -0.902 -11.956
  703   1HG2  VAL  92          1HG2      VAL  92  20.992   0.824 -10.091
  704   2HG2  VAL  92          2HG2      VAL  92  19.718   0.730  -8.876
  705   3HG2  VAL  92          3HG2      VAL  92  19.320   1.152 -10.541
  706    H    GLY  93           H        GLY  93  19.923  -3.505  -8.685
  707   1HA   GLY  93          2HA       GLY  93  18.415  -5.431 -10.397
  708   2HA   GLY  93          1HA       GLY  93  20.038  -5.700  -9.762
  709    H    HIS  94           HN       HIS  94  17.290  -4.454  -7.892
  710    HA   HIS  94           HA       HIS  94  17.056  -7.061  -6.480
  711   1HB   HIS  94          2HB       HIS  94  18.716  -5.542  -5.280
  712   2HB   HIS  94          1HB       HIS  94  17.368  -4.448  -4.978
  713    HD1  HIS  94           HD1      HIS  94  16.127  -4.884  -2.860
  714    HD2  HIS  94           HD2      HIS  94  18.043  -8.318  -4.250
  715    HE1  HIS  94           HE1      HIS  94  15.713  -6.689  -1.131
  Start of MODEL   14
    1   1H    MET   1          1H        MET   1  -5.133 -18.654   3.475
    2   2H    MET   1          2H        MET   1  -6.751 -18.654   3.992
    3   3H    MET   1          3H        MET   1  -6.382 -18.850   2.347
    4    HA   MET   1           HA       MET   1  -5.413 -20.974   2.718
    5   1HB   MET   1          2HB       MET   1  -5.069 -19.946   5.341
    6   2HB   MET   1          1HB       MET   1  -6.092 -21.372   5.490
    7   1HG   MET   1          2HG       MET   1  -4.234 -22.285   3.720
    8   2HG   MET   1          1HG       MET   1  -3.252 -21.171   4.673
    9   1HE   MET   1          1HE       MET   1  -2.798 -24.847   5.220
   10   2HE   MET   1          2HE       MET   1  -3.800 -24.159   3.944
   11   3HE   MET   1          3HE       MET   1  -4.535 -25.181   5.174
   12    H    SER   2           H        SER   2  -7.816 -20.702   5.349
   13    HA   SER   2           HA       SER   2  -9.626 -22.406   3.723
   14   1HB   SER   2          2HB       SER   2  -9.016 -22.193   6.538
   15   2HB   SER   2          1HB       SER   2 -10.746 -21.982   6.283
   16    HG   SER   2           HG       SER   2  -9.144 -24.089   5.241
   17    H    GLY   3           H        GLY   3 -10.763 -21.049   2.356
   18   1HA   GLY   3          2HA       GLY   3 -13.060 -19.896   2.594
   19   2HA   GLY   3          1HA       GLY   3 -12.197 -18.731   3.598
   20    H    GLY   4           H        GLY   4 -13.384 -19.162   0.577
   21   1HA   GLY   4          2HA       GLY   4 -11.414 -17.251  -0.615
   22   2HA   GLY   4          1HA       GLY   4 -12.044 -18.605  -1.555
   23    H    THR   5           H        THR   5 -13.233 -15.857   0.406
   24    HA   THR   5           HA       THR   5 -15.855 -15.821  -0.777
   25    HB   THR   5           HB       THR   5 -15.915 -13.447   0.159
   26    HG1  THR   5           HG1      THR   5 -14.142 -12.629   0.939
   27   1HG2  THR   5          1HG2      THR   5 -14.985 -15.577   2.101
   28   2HG2  THR   5          2HG2      THR   5 -16.610 -15.509   1.419
   29   3HG2  THR   5          3HG2      THR   5 -16.032 -14.202   2.450
   30    H    ALA   6           H        ALA   6 -16.176 -15.445  -2.926
   31    HA   ALA   6           HA       ALA   6 -14.293 -13.712  -4.409
   32   1HB   ALA   6          1HB       ALA   6 -14.973 -14.815  -6.275
   33   2HB   ALA   6          2HB       ALA   6 -16.677 -14.698  -5.838
   34   3HB   ALA   6          3HB       ALA   6 -15.676 -15.974  -5.147
   35    H    ALA   7           H        ALA   7 -17.702 -13.788  -3.422
   36    HA   ALA   7           HA       ALA   7 -17.867 -10.885  -4.115
   37   1HB   ALA   7          1HB       ALA   7 -19.250 -12.179  -5.673
   38   2HB   ALA   7          2HB       ALA   7 -20.285 -11.258  -4.582
   39   3HB   ALA   7          3HB       ALA   7 -20.049 -12.987  -4.323
   40    H    THR   8           H        THR   8 -17.506 -10.084  -2.040
   41    HA   THR   8           HA       THR   8 -19.109 -11.181   0.213
   42    HB   THR   8           HB       THR   8 -16.942  -9.049   0.243
   43    HG1  THR   8           HG1      THR   8 -15.671 -10.692   0.073
   44   1HG2  THR   8          1HG2      THR   8 -16.953  -9.321   2.630
   45   2HG2  THR   8          2HG2      THR   8 -18.055 -10.695   2.527
   46   3HG2  THR   8          3HG2      THR   8 -18.628  -9.074   2.139
   47    H    THR   9           H        THR   9 -18.410  -8.034  -1.357
   48    HA   THR   9           HA       THR   9 -20.755  -6.822  -0.031
   49    HB   THR   9           HB       THR   9 -18.596  -5.553  -0.346
   50    HG1  THR   9           HG1      THR   9 -20.109  -4.114  -0.093
   51   1HG2  THR   9          1HG2      THR   9 -17.607  -5.637  -2.361
   52   2HG2  THR   9          2HG2      THR   9 -18.917  -4.642  -2.993
   53   3HG2  THR   9          3HG2      THR   9 -19.026  -6.399  -3.078
   54    H    ALA  10           H        ALA  10 -22.082  -5.345  -1.744
   55    HA   ALA  10           HA       ALA  10 -23.402  -7.239  -3.517
   56   1HB   ALA  10          1HB       ALA  10 -23.731  -4.243  -3.168
   57   2HB   ALA  10          2HB       ALA  10 -24.707  -5.501  -2.408
   58   3HB   ALA  10          3HB       ALA  10 -24.788  -5.254  -4.153
   59    H    GLY  11           H        GLY  11 -23.184  -7.423  -5.743
   60   1HA   GLY  11          2HA       GLY  11 -22.576  -6.531  -7.939
   61   2HA   GLY  11          1HA       GLY  11 -21.406  -5.477  -7.144
   62    H    SER  12           H        SER  12 -19.310  -6.182  -7.017
   63    HA   SER  12           HA       SER  12 -18.626  -9.017  -6.919
   64   1HB   SER  12          2HB       SER  12 -17.319  -9.010  -9.046
   65   2HB   SER  12          1HB       SER  12 -19.050  -8.849  -9.316
   66    HG   SER  12           HG       SER  12 -18.637  -7.018 -10.241
   67    H    LYS  13           H        LYS  13 -16.370  -9.353  -6.490
   68    HA   LYS  13           HA       LYS  13 -14.819  -6.864  -5.874
   69   1HB   LYS  13          2HB       LYS  13 -15.064  -9.411  -4.246
   70   2HB   LYS  13          1HB       LYS  13 -13.847  -8.173  -3.941
   71   1HG   LYS  13          2HG       LYS  13 -15.732  -6.502  -3.728
   72   2HG   LYS  13          1HG       LYS  13 -16.853  -7.862  -3.790
   73   1HD   LYS  13          2HD       LYS  13 -16.568  -8.091  -1.565
   74   2HD   LYS  13          1HD       LYS  13 -14.916  -8.610  -1.898
   75   1HE   LYS  13          2HE       LYS  13 -14.354  -6.089  -2.000
   76   2HE   LYS  13          1HE       LYS  13 -15.909  -5.845  -1.207
   77   1HZ   LYS  13          1HZ       LYS  13 -14.697  -6.126   0.645
   78   2HZ   LYS  13          2HZ       LYS  13 -13.445  -6.951  -0.154
   79   3HZ   LYS  13          3HZ       LYS  13 -14.856  -7.779   0.301
   80    H    VAL  14           H        VAL  14 -12.547  -7.012  -6.198
   81    HA   VAL  14           HA       VAL  14 -11.714  -9.248  -7.981
   82    HB   VAL  14           HB       VAL  14  -9.687  -7.720  -8.384
   83   1HG1  VAL  14          1HG1      VAL  14 -10.847  -6.481 -10.063
   84   2HG1  VAL  14          2HG1      VAL  14 -12.351  -6.508  -9.145
   85   3HG1  VAL  14          3HG1      VAL  14 -11.737  -7.991  -9.875
   86   1HG2  VAL  14          1HG2      VAL  14  -9.850  -5.417  -7.755
   87   2HG2  VAL  14          2HG2      VAL  14 -10.194  -6.337  -6.292
   88   3HG2  VAL  14          3HG2      VAL  14 -11.515  -5.611  -7.206
   89    H    THR  15           H        THR  15 -10.427 -10.819  -7.181
   90    HA   THR  15           HA       THR  15  -9.153 -10.408  -4.520
   91    HB   THR  15           HB       THR  15  -8.746 -12.994  -4.864
   92    HG1  THR  15           HG1      THR  15  -9.796 -13.864  -6.464
   93   1HG2  THR  15          1HG2      THR  15 -11.304 -11.563  -4.196
   94   2HG2  THR  15          2HG2      THR  15 -10.172 -12.380  -3.117
   95   3HG2  THR  15          3HG2      THR  15 -11.240 -13.325  -4.154
   96    H    PHE  16           H        PHE  16  -6.920 -10.538  -4.254
   97    HA   PHE  16           HA       PHE  16  -5.315 -10.946  -6.748
   98   1HB   PHE  16          2HB       PHE  16  -4.738  -9.012  -4.490
   99   2HB   PHE  16          1HB       PHE  16  -3.742  -9.247  -5.923
  100    HD1  PHE  16           HD1      PHE  16  -4.985  -8.996  -8.232
  101    HD2  PHE  16           HD2      PHE  16  -6.407  -7.358  -4.524
  102    HE1  PHE  16           HE1      PHE  16  -6.388  -7.381  -9.483
  103    HE2  PHE  16           HE2      PHE  16  -7.809  -5.743  -5.778
  104    HZ   PHE  16           HZ       PHE  16  -7.800  -5.756  -8.255
  105    H    LYS  17           H        LYS  17  -3.669 -12.350  -6.604
  106    HA   LYS  17           HA       LYS  17  -3.000 -13.495  -3.920
  107   1HB   LYS  17          2HB       LYS  17  -4.004 -14.833  -6.098
  108   2HB   LYS  17          1HB       LYS  17  -2.268 -15.043  -6.333
  109   1HG   LYS  17          2HG       LYS  17  -2.158 -15.758  -3.886
  110   2HG   LYS  17          1HG       LYS  17  -3.920 -15.839  -3.927
  111   1HD   LYS  17          2HD       LYS  17  -3.906 -17.546  -5.590
  112   2HD   LYS  17          1HD       LYS  17  -2.199 -17.283  -5.950
  113   1HE   LYS  17          2HE       LYS  17  -1.864 -17.892  -3.413
  114   2HE   LYS  17          1HE       LYS  17  -3.443 -18.658  -3.587
  115   1HZ   LYS  17          1HZ       LYS  17  -2.353 -19.668  -5.700
  116   2HZ   LYS  17          2HZ       LYS  17  -2.043 -20.349  -4.177
  117   3HZ   LYS  17          3HZ       LYS  17  -0.900 -19.320  -4.899
  118    H    ILE  18           H        ILE  18  -1.085 -12.573  -3.284
  119    HA   ILE  18           HA       ILE  18   1.045 -12.246  -5.363
  120    HB   ILE  18           HB       ILE  18   0.746 -10.705  -2.766
  121   1HG1  ILE  18          2HG1      ILE  18   0.467  -8.984  -4.973
  122   2HG1  ILE  18          1HG1      ILE  18  -0.545 -10.377  -5.354
  123   1HG2  ILE  18          1HG2      ILE  18   2.626 -10.538  -5.125
  124   2HG2  ILE  18          2HG2      ILE  18   3.030 -10.730  -3.420
  125   3HG2  ILE  18          3HG2      ILE  18   2.398  -9.193  -4.008
  126   1HD1  ILE  18          1HD1      ILE  18  -1.029  -9.874  -2.641
  127   2HD1  ILE  18          2HD1      ILE  18  -2.105  -9.496  -3.985
  128   3HD1  ILE  18          3HD1      ILE  18  -0.977  -8.279  -3.389
  129    H    THR  19           H        THR  19   2.839 -13.464  -5.091
  130    HA   THR  19           HA       THR  19   3.301 -14.748  -2.423
  131    HB   THR  19           HB       THR  19   4.614 -16.462  -3.780
  132    HG1  THR  19           HG1      THR  19   4.830 -16.069  -5.812
  133   1HG2  THR  19          1HG2      THR  19   2.732 -17.770  -4.037
  134   2HG2  THR  19          2HG2      THR  19   1.801 -16.472  -4.785
  135   3HG2  THR  19          3HG2      THR  19   2.055 -16.482  -3.040
  136    H    LEU  20           H        LEU  20   5.163 -14.162  -1.393
  137    HA   LEU  20           HA       LEU  20   6.909 -12.156  -2.496
  138   1HB   LEU  20          2HB       LEU  20   6.422 -12.641  -0.018
  139   2HB   LEU  20          1HB       LEU  20   7.597 -13.946  -0.160
  140    HG   LEU  20           HG       LEU  20   9.188 -12.155  -1.135
  141   1HD1  LEU  20          1HD1      LEU  20   8.648  -9.925  -0.965
  142   2HD1  LEU  20          2HD1      LEU  20   7.631 -10.171   0.455
  143   3HD1  LEU  20          3HD1      LEU  20   7.017 -10.565  -1.149
  144   1HD2  LEU  20          1HD2      LEU  20   8.275 -12.352   1.729
  145   2HD2  LEU  20          2HD2      LEU  20   9.572 -11.242   1.286
  146   3HD2  LEU  20          3HD2      LEU  20   9.753 -12.971   0.994
  147    H    THR  21           H        THR  21   8.722 -12.378  -3.702
  148    HA   THR  21           HA       THR  21   9.518 -14.999  -4.689
  149    HB   THR  21           HB       THR  21  11.333 -13.665  -5.856
  150    HG1  THR  21           HG1      THR  21  11.692 -11.746  -5.133
  151   1HG2  THR  21          1HG2      THR  21   8.714 -12.285  -6.320
  152   2HG2  THR  21          2HG2      THR  21   8.821 -14.024  -6.593
  153   3HG2  THR  21          3HG2      THR  21   9.865 -12.925  -7.493
  154    H    SER  22           H        SER  22  10.890 -12.634  -2.404
  155    HA   SER  22           HA       SER  22  13.207 -14.404  -1.882
  156   1HB   SER  22          2HB       SER  22  13.844 -12.522  -0.281
  157   2HB   SER  22          1HB       SER  22  13.771 -12.075  -1.982
  158    HG   SER  22           HG       SER  22  12.489 -10.961  -0.002
  159    H    ASP  23           H        ASP  23  11.151 -15.881  -1.172
  160    HA   ASP  23           HA       ASP  23  11.249 -15.895   1.784
  161   1HB   ASP  23          2HB       ASP  23   9.079 -14.736   0.567
  162   2HB   ASP  23          1HB       ASP  23   8.538 -16.405   0.730
  163    HA   PRO  24           HA       PRO  24  11.599 -20.192   0.844
  164   1HB   PRO  24          2HB       PRO  24  11.467 -21.104   3.436
  165   2HB   PRO  24          1HB       PRO  24  12.909 -20.362   2.724
  166   1HG   PRO  24          2HG       PRO  24  10.972 -19.203   4.673
  167   2HG   PRO  24          1HG       PRO  24  12.682 -18.814   4.423
  168   1HD   PRO  24          2HD       PRO  24  10.490 -17.293   3.495
  169   2HD   PRO  24          1HD       PRO  24  12.177 -17.116   2.970
  170    H    LYS  25           H        LYS  25  10.354 -22.209   1.077
  171    HA   LYS  25           HA       LYS  25   8.390 -23.466   1.074
  172   1HB   LYS  25          2HB       LYS  25   8.300 -21.944   3.454
  173   2HB   LYS  25          1HB       LYS  25   6.692 -21.825   2.740
  174   1HG   LYS  25          2HG       LYS  25   6.532 -24.247   2.572
  175   2HG   LYS  25          1HG       LYS  25   8.190 -24.429   3.146
  176   1HD   LYS  25          2HD       LYS  25   7.335 -24.563   5.230
  177   2HD   LYS  25          1HD       LYS  25   6.969 -22.844   5.093
  178   1HE   LYS  25          2HE       LYS  25   4.949 -24.327   3.691
  179   2HE   LYS  25          1HE       LYS  25   5.126 -24.999   5.313
  180   1HZ   LYS  25          1HZ       LYS  25   4.908 -22.764   6.216
  181   2HZ   LYS  25          2HZ       LYS  25   3.543 -23.184   5.300
  182   3HZ   LYS  25          3HZ       LYS  25   4.713 -22.133   4.654
  183    H    LEU  26           H        LEU  26   5.641 -22.385   1.273
  184    HA   LEU  26           HA       LEU  26   5.602 -20.756  -1.239
  185   1HB   LEU  26          2HB       LEU  26   4.778 -23.344  -1.044
  186   2HB   LEU  26          1HB       LEU  26   3.274 -22.500  -0.678
  187    HG   LEU  26           HG       LEU  26   4.357 -21.085  -2.838
  188   1HD1  LEU  26          1HD1      LEU  26   4.408 -24.018  -3.547
  189   2HD1  LEU  26          2HD1      LEU  26   5.867 -23.191  -3.003
  190   3HD1  LEU  26          3HD1      LEU  26   5.042 -22.654  -4.466
  191   1HD2  LEU  26          1HD2      LEU  26   2.272 -23.295  -2.811
  192   2HD2  LEU  26          2HD2      LEU  26   2.437 -22.058  -4.057
  193   3HD2  LEU  26          3HD2      LEU  26   1.975 -21.602  -2.418
  194    HA   PRO  27           HA       PRO  27   3.202 -18.490   2.004
  195   1HB   PRO  27          2HB       PRO  27   4.672 -16.175   1.838
  196   2HB   PRO  27          1HB       PRO  27   5.082 -17.512   2.924
  197   1HG   PRO  27          2HG       PRO  27   6.422 -16.670   0.407
  198   2HG   PRO  27          1HG       PRO  27   7.074 -17.590   1.772
  199   1HD   PRO  27          2HD       PRO  27   6.208 -18.646  -0.733
  200   2HD   PRO  27          1HD       PRO  27   6.677 -19.568   0.710
  201    H    PHE  28           H        PHE  28   1.370 -17.406   1.282
  202    HA   PHE  28           HA       PHE  28   1.589 -15.686  -1.143
  203   1HB   PHE  28          2HB       PHE  28  -0.532 -16.639  -2.026
  204   2HB   PHE  28          1HB       PHE  28   0.758 -17.835  -1.956
  205    HD1  PHE  28           HD1      PHE  28  -2.462 -16.766  -0.542
  206    HD2  PHE  28           HD2      PHE  28   0.733 -19.625  -0.259
  207    HE1  PHE  28           HE1      PHE  28  -3.887 -18.219   0.874
  208    HE2  PHE  28           HE2      PHE  28  -0.693 -21.076   1.160
  209    HZ   PHE  28           HZ       PHE  28  -3.002 -20.373   1.725
  210    H    LYS  29           H        LYS  29  -0.088 -14.061  -1.304
  211    HA   LYS  29           HA       LYS  29  -1.559 -13.576   1.262
  212   1HB   LYS  29          2HB       LYS  29   0.507 -12.036   0.338
  213   2HB   LYS  29          1HB       LYS  29  -0.873 -11.220  -0.395
  214   1HG   LYS  29          2HG       LYS  29  -1.097 -11.997   2.483
  215   2HG   LYS  29          1HG       LYS  29  -0.059 -10.628   2.082
  216   1HD   LYS  29          2HD       LYS  29  -1.949  -9.602   0.825
  217   2HD   LYS  29          1HD       LYS  29  -2.980 -10.941   1.332
  218   1HE   LYS  29          2HE       LYS  29  -1.823 -10.062   3.709
  219   2HE   LYS  29          1HE       LYS  29  -2.157  -8.571   2.829
  220   1HZ   LYS  29          1HZ       LYS  29  -4.146  -8.946   3.868
  221   2HZ   LYS  29          2HZ       LYS  29  -4.022 -10.637   3.766
  222   3HZ   LYS  29          3HZ       LYS  29  -4.427  -9.728   2.390
  223    H    VAL  30           H        VAL  30  -3.725 -13.605   0.942
  224    HA   VAL  30           HA       VAL  30  -4.792 -13.137  -1.802
  225    HB   VAL  30           HB       VAL  30  -6.205 -14.248   0.649
  226   1HG1  VAL  30          1HG1      VAL  30  -7.113 -14.806  -2.130
  227   2HG1  VAL  30          2HG1      VAL  30  -7.374 -13.166  -1.537
  228   3HG1  VAL  30          3HG1      VAL  30  -8.061 -14.538  -0.667
  229   1HG2  VAL  30          1HG2      VAL  30  -4.208 -15.465  -0.906
  230   2HG2  VAL  30          2HG2      VAL  30  -5.722 -16.108  -1.540
  231   3HG2  VAL  30          3HG2      VAL  30  -5.339 -16.281   0.172
  232    H    LEU  31           H        LEU  31  -5.578 -11.122  -2.210
  233    HA   LEU  31           HA       LEU  31  -6.611  -9.517   0.101
  234   1HB   LEU  31          2HB       LEU  31  -4.857  -8.828  -2.200
  235   2HB   LEU  31          1HB       LEU  31  -6.061  -7.621  -1.750
  236    HG   LEU  31           HG       LEU  31  -4.635  -8.816   0.539
  237   1HD1  LEU  31          1HD1      LEU  31  -2.877  -8.644  -1.312
  238   2HD1  LEU  31          2HD1      LEU  31  -2.527  -7.758   0.172
  239   3HD1  LEU  31          3HD1      LEU  31  -3.124  -6.900  -1.248
  240   1HD2  LEU  31          1HD2      LEU  31  -4.390  -5.989   0.389
  241   2HD2  LEU  31          2HD2      LEU  31  -5.506  -6.918   1.390
  242   3HD2  LEU  31          3HD2      LEU  31  -5.997  -6.388  -0.218
  243    H    SER  32           H        SER  32  -8.803  -9.583   0.011
  244    HA   SER  32           HA       SER  32 -10.155  -9.532  -2.645
  245   1HB   SER  32          2HB       SER  32 -10.670 -11.143  -0.543
  246   2HB   SER  32          1HB       SER  32 -11.722  -9.795  -0.122
  247    HG   SER  32           HG       SER  32 -12.777 -11.314  -1.463
  248    H    VAL  33           H        VAL  33 -10.567  -7.488  -3.335
  249    HA   VAL  33           HA       VAL  33 -11.793  -5.569  -1.410
  250    HB   VAL  33           HB       VAL  33 -10.439  -3.733  -2.543
  251   1HG1  VAL  33          1HG1      VAL  33  -8.366  -4.265  -1.210
  252   2HG1  VAL  33          2HG1      VAL  33  -9.053  -5.857  -0.891
  253   3HG1  VAL  33          3HG1      VAL  33  -9.870  -4.410  -0.302
  254   1HG2  VAL  33          1HG2      VAL  33  -8.176  -4.715  -3.416
  255   2HG2  VAL  33          2HG2      VAL  33  -9.565  -4.692  -4.501
  256   3HG2  VAL  33          3HG2      VAL  33  -9.109  -6.186  -3.684
  257    HA   PRO  34           HA       PRO  34 -14.587  -4.765  -4.704
  258   1HB   PRO  34          2HB       PRO  34 -15.289  -2.171  -4.109
  259   2HB   PRO  34          1HB       PRO  34 -15.858  -3.578  -3.193
  260   1HG   PRO  34          2HG       PRO  34 -13.793  -1.558  -2.444
  261   2HG   PRO  34          1HG       PRO  34 -14.836  -2.536  -1.401
  262   1HD   PRO  34          2HD       PRO  34 -12.113  -3.043  -1.942
  263   2HD   PRO  34          1HD       PRO  34 -13.257  -4.188  -1.210
  264    H    GLU  35           H        GLU  35 -14.798  -3.628  -6.727
  265    HA   GLU  35           HA       GLU  35 -12.345  -2.714  -7.914
  266   1HB   GLU  35          2HB       GLU  35 -15.224  -2.779  -8.799
  267   2HB   GLU  35          1HB       GLU  35 -14.022  -1.927  -9.770
  268   1HG   GLU  35          2HG       GLU  35 -13.706  -3.983 -10.715
  269   2HG   GLU  35          1HG       GLU  35 -12.697  -4.256  -9.294
  270    H    SER  36           H        SER  36 -11.715  -1.038  -6.460
  271    HA   SER  36           HA       SER  36 -12.286   1.622  -7.297
  272   1HB   SER  36          2HB       SER  36 -13.400   2.395  -5.129
  273   2HB   SER  36          1HB       SER  36 -14.429   1.486  -6.229
  274    HG   SER  36           HG       SER  36 -14.230   0.919  -3.817
  275    H    THR  37           H        THR  37 -11.294  -0.480  -4.602
  276    HA   THR  37           HA       THR  37  -9.594   1.375  -3.254
  277    HB   THR  37           HB       THR  37  -8.398  -0.729  -2.448
  278    HG1  THR  37           HG1      THR  37  -8.715  -2.121  -4.105
  279   1HG2  THR  37          1HG2      THR  37  -9.968  -0.446  -0.860
  280   2HG2  THR  37          2HG2      THR  37 -10.964  -1.603  -1.742
  281   3HG2  THR  37          3HG2      THR  37 -11.147   0.125  -2.040
  282    HA   PRO  38           HA       PRO  38  -6.307   1.719  -6.186
  283   1HB   PRO  38          2HB       PRO  38  -4.510   2.963  -4.522
  284   2HB   PRO  38          1HB       PRO  38  -5.894   3.784  -5.261
  285   1HG   PRO  38          2HG       PRO  38  -5.526   2.897  -2.438
  286   2HG   PRO  38          1HG       PRO  38  -6.525   4.210  -3.080
  287   1HD   PRO  38          2HD       PRO  38  -7.456   1.662  -2.268
  288   2HD   PRO  38          1HD       PRO  38  -8.372   2.860  -3.208
  289    H    PHE  39           H        PHE  39  -4.231   0.802  -6.638
  290    HA   PHE  39           HA       PHE  39  -3.645  -1.704  -5.354
  291   1HB   PHE  39          2HB       PHE  39  -3.066  -0.798  -7.780
  292   2HB   PHE  39          1HB       PHE  39  -1.573  -0.289  -6.994
  293    HD1  PHE  39           HD1      PHE  39  -3.806  -3.305  -6.684
  294    HD2  PHE  39           HD2      PHE  39   0.156  -1.798  -7.386
  295    HE1  PHE  39           HE1      PHE  39  -2.945  -5.626  -6.817
  296    HE2  PHE  39           HE2      PHE  39   1.015  -4.120  -7.519
  297    HZ   PHE  39           HZ       PHE  39  -0.536  -6.034  -7.235
  298    H    THR  40           H        THR  40  -2.753   1.551  -4.593
  299    HA   THR  40           HA       THR  40  -0.230   1.116  -3.309
  300    HB   THR  40           HB       THR  40  -1.135   3.120  -1.824
  301    HG1  THR  40           HG1      THR  40  -2.888   4.094  -2.612
  302   1HG2  THR  40          1HG2      THR  40   0.569   3.219  -3.660
  303   2HG2  THR  40          2HG2      THR  40  -0.428   4.669  -3.537
  304   3HG2  THR  40          3HG2      THR  40  -0.750   3.482  -4.801
  305    H    ALA  41           H        ALA  41  -3.579   1.013  -2.082
  306    HA   ALA  41           HA       ALA  41  -2.813   0.214   0.600
  307   1HB   ALA  41          1HB       ALA  41  -4.928   1.122   0.666
  308   2HB   ALA  41          2HB       ALA  41  -5.382  -0.571   0.471
  309   3HB   ALA  41          3HB       ALA  41  -5.358   0.503  -0.927
  310    H    VAL  42           H        VAL  42  -3.894  -1.523  -2.329
  311    HA   VAL  42           HA       VAL  42  -4.108  -4.127  -1.155
  312    HB   VAL  42           HB       VAL  42  -3.332  -3.353  -3.991
  313   1HG1  VAL  42          1HG1      VAL  42  -2.746  -5.619  -3.825
  314   2HG1  VAL  42          2HG1      VAL  42  -4.418  -5.704  -4.375
  315   3HG1  VAL  42          3HG1      VAL  42  -4.035  -5.969  -2.675
  316   1HG2  VAL  42          1HG2      VAL  42  -5.961  -3.814  -2.577
  317   2HG2  VAL  42          2HG2      VAL  42  -5.818  -4.038  -4.320
  318   3HG2  VAL  42          3HG2      VAL  42  -5.489  -2.461  -3.603
  319    H    LEU  43           H        LEU  43  -1.364  -2.579  -2.855
  320    HA   LEU  43           HA       LEU  43   0.509  -4.708  -2.468
  321   1HB   LEU  43          2HB       LEU  43   0.710  -2.666  -4.018
  322   2HB   LEU  43          1HB       LEU  43   1.233  -1.771  -2.591
  323    HG   LEU  43           HG       LEU  43   2.610  -4.351  -2.935
  324   1HD1  LEU  43          1HD1      LEU  43   2.166  -3.038  -5.302
  325   2HD1  LEU  43          2HD1      LEU  43   3.564  -4.061  -4.980
  326   3HD1  LEU  43          3HD1      LEU  43   3.687  -2.314  -4.781
  327   1HD2  LEU  43          1HD2      LEU  43   3.648  -3.018  -1.361
  328   2HD2  LEU  43          2HD2      LEU  43   3.202  -1.521  -2.180
  329   3HD2  LEU  43          3HD2      LEU  43   4.542  -2.492  -2.786
  330    H    LYS  44           H        LYS  44  -0.428  -1.955  -0.440
  331    HA   LYS  44           HA       LYS  44   1.669  -2.160   1.496
  332   1HB   LYS  44          2HB       LYS  44  -0.695  -0.614   1.135
  333   2HB   LYS  44          1HB       LYS  44  -0.780  -1.322   2.747
  334   1HG   LYS  44          2HG       LYS  44   1.487  -0.467   3.235
  335   2HG   LYS  44          1HG       LYS  44   1.556   0.248   1.623
  336   1HD   LYS  44          2HD       LYS  44  -0.592   1.496   2.248
  337   2HD   LYS  44          1HD       LYS  44  -0.274   1.002   3.909
  338   1HE   LYS  44          2HE       LYS  44   0.876   3.003   3.919
  339   2HE   LYS  44          1HE       LYS  44   2.160   1.951   3.311
  340   1HZ   LYS  44          1HZ       LYS  44   0.994   2.540   1.028
  341   2HZ   LYS  44          2HZ       LYS  44   2.193   3.539   1.707
  342   3HZ   LYS  44          3HZ       LYS  44   0.552   3.935   1.884
  343    H    PHE  45           H        PHE  45  -1.647  -3.532   1.502
  344    HA   PHE  45           HA       PHE  45  -1.413  -4.924   3.983
  345   1HB   PHE  45          2HB       PHE  45  -3.218  -4.991   1.640
  346   2HB   PHE  45          1HB       PHE  45  -3.143  -6.490   2.567
  347    HD1  PHE  45           HD1      PHE  45  -4.133  -2.957   2.600
  348    HD2  PHE  45           HD2      PHE  45  -3.765  -6.533   4.956
  349    HE1  PHE  45           HE1      PHE  45  -5.577  -1.956   4.350
  350    HE2  PHE  45           HE2      PHE  45  -5.209  -5.529   6.703
  351    HZ   PHE  45           HZ       PHE  45  -6.114  -3.242   6.400
  352    H    ALA  46           H        ALA  46  -0.701  -5.980   0.641
  353    HA   ALA  46           HA       ALA  46  -0.011  -8.683   1.304
  354   1HB   ALA  46          1HB       ALA  46   1.374  -8.470  -0.890
  355   2HB   ALA  46          2HB       ALA  46   0.660  -6.863  -1.005
  356   3HB   ALA  46          3HB       ALA  46  -0.377  -8.288  -0.993
  357    H    ALA  47           H        ALA  47   1.985  -5.737   0.970
  358    HA   ALA  47           HA       ALA  47   4.495  -7.007   1.562
  359   1HB   ALA  47          1HB       ALA  47   3.666  -4.118   1.982
  360   2HB   ALA  47          2HB       ALA  47   4.324  -4.783   0.487
  361   3HB   ALA  47          3HB       ALA  47   5.323  -4.721   1.939
  362    H    GLU  48           H        GLU  48   2.004  -5.512   3.612
  363    HA   GLU  48           HA       GLU  48   3.478  -5.478   6.061
  364   1HB   GLU  48          2HB       GLU  48   0.678  -5.192   5.236
  365   2HB   GLU  48          1HB       GLU  48   0.846  -5.971   6.810
  366   1HG   GLU  48          2HG       GLU  48   1.333  -3.993   7.765
  367   2HG   GLU  48          1HG       GLU  48   2.702  -3.784   6.674
  368    H    GLU  49           H        GLU  49   1.387  -7.988   4.610
  369    HA   GLU  49           HA       GLU  49   1.635  -9.879   6.767
  370   1HB   GLU  49          2HB       GLU  49  -0.109  -9.996   4.977
  371   2HB   GLU  49          1HB       GLU  49   1.147 -10.432   3.820
  372   1HG   GLU  49          2HG       GLU  49   1.208 -12.093   6.239
  373   2HG   GLU  49          1HG       GLU  49  -0.314 -12.221   5.359
  374    H    PHE  50           H        PHE  50   3.487  -9.365   3.769
  375    HA   PHE  50           HA       PHE  50   5.259 -11.628   4.219
  376   1HB   PHE  50          2HB       PHE  50   5.252  -9.298   2.305
  377   2HB   PHE  50          1HB       PHE  50   6.603 -10.427   2.375
  378    HD1  PHE  50           HD1      PHE  50   3.785  -9.766   0.557
  379    HD2  PHE  50           HD2      PHE  50   5.588 -13.028   2.693
  380    HE1  PHE  50           HE1      PHE  50   2.502 -11.379  -0.821
  381    HE2  PHE  50           HE2      PHE  50   4.304 -14.635   1.313
  382    HZ   PHE  50           HZ       PHE  50   2.762 -13.815  -0.442
  383    H    LYS  51           H        LYS  51   5.102  -8.578   5.672
  384    HA   LYS  51           HA       LYS  51   6.527  -7.518   7.190
  385   1HB   LYS  51          2HB       LYS  51   7.306 -10.207   7.281
  386   2HB   LYS  51          1HB       LYS  51   8.812  -9.319   7.045
  387   1HG   LYS  51          2HG       LYS  51   8.537  -8.076   9.020
  388   2HG   LYS  51          1HG       LYS  51   6.804  -8.396   9.091
  389   1HD   LYS  51          2HD       LYS  51   7.980 -10.935   9.157
  390   2HD   LYS  51          1HD       LYS  51   9.007  -9.948  10.199
  391   1HE   LYS  51          2HE       LYS  51   6.901  -9.131  11.344
  392   2HE   LYS  51          1HE       LYS  51   6.010 -10.344  10.425
  393   1HZ   LYS  51          1HZ       LYS  51   6.542 -11.320  12.488
  394   2HZ   LYS  51          2HZ       LYS  51   8.157 -10.793  12.420
  395   3HZ   LYS  51          3HZ       LYS  51   7.612 -12.010  11.366
  396    H    VAL  52           H        VAL  52   6.637  -7.010   4.303
  397    HA   VAL  52           HA       VAL  52   9.454  -6.015   4.103
  398    HB   VAL  52           HB       VAL  52   9.153  -6.085   1.617
  399   1HG1  VAL  52          1HG1      VAL  52  10.318  -7.920   2.699
  400   2HG1  VAL  52          2HG1      VAL  52   9.292  -8.572   1.422
  401   3HG1  VAL  52          3HG1      VAL  52   8.789  -8.697   3.108
  402   1HG2  VAL  52          1HG2      VAL  52   7.188  -7.854   1.075
  403   2HG2  VAL  52          2HG2      VAL  52   6.929  -6.111   1.040
  404   3HG2  VAL  52          3HG2      VAL  52   6.462  -7.043   2.459
  405    HA   PRO  53           HA       PRO  53   7.729  -1.985   3.817
  406   1HB   PRO  53          2HB       PRO  53   9.622  -0.750   2.251
  407   2HB   PRO  53          1HB       PRO  53   9.855  -1.149   3.960
  408   1HG   PRO  53          2HG       PRO  53  10.986  -2.492   1.546
  409   2HG   PRO  53          1HG       PRO  53  11.640  -2.409   3.190
  410   1HD   PRO  53          2HD       PRO  53  10.304  -4.627   2.058
  411   2HD   PRO  53          1HD       PRO  53  10.643  -4.387   3.786
  412    H    ALA  54           H        ALA  54   5.987  -1.436   2.628
  413    HA   ALA  54           HA       ALA  54   5.541  -2.327  -0.086
  414   1HB   ALA  54          1HB       ALA  54   3.492  -2.000   0.864
  415   2HB   ALA  54          2HB       ALA  54   3.690  -0.358   0.253
  416   3HB   ALA  54          3HB       ALA  54   4.080  -0.726   1.933
  417    H    ALA  55           H        ALA  55   6.637   0.729   1.341
  418    HA   ALA  55           HA       ALA  55   6.479   2.303  -1.062
  419   1HB   ALA  55          1HB       ALA  55   6.704   3.225   1.267
  420   2HB   ALA  55          2HB       ALA  55   7.854   3.910   0.120
  421   3HB   ALA  55          3HB       ALA  55   8.381   2.680   1.267
  422    H    THR  56           H        THR  56   8.858   0.005   0.132
  423    HA   THR  56           HA       THR  56  10.674   0.745  -2.127
  424    HB   THR  56           HB       THR  56  11.458  -1.020   0.195
  425    HG1  THR  56           HG1      THR  56  11.332   0.647   1.438
  426   1HG2  THR  56          1HG2      THR  56  13.693  -0.257  -0.367
  427   2HG2  THR  56          2HG2      THR  56  13.046   0.895  -1.534
  428   3HG2  THR  56          3HG2      THR  56  12.912  -0.836  -1.837
  429    H    SER  57           H        SER  57   8.185  -1.139  -2.015
  430    HA   SER  57           HA       SER  57   9.547  -3.390  -3.409
  431   1HB   SER  57          2HB       SER  57   8.184  -5.046  -2.307
  432   2HB   SER  57          1HB       SER  57   8.946  -4.069  -1.059
  433    HG   SER  57           HG       SER  57   6.627  -4.463  -0.819
  434    H    ALA  58           H        ALA  58   8.291  -4.382  -5.034
  435    HA   ALA  58           HA       ALA  58   5.745  -2.982  -5.753
  436   1HB   ALA  58          1HB       ALA  58   6.547  -2.413  -7.792
  437   2HB   ALA  58          2HB       ALA  58   7.247  -4.012  -8.041
  438   3HB   ALA  58          3HB       ALA  58   8.146  -2.785  -7.152
  439    H    ILE  59           H        ILE  59   4.505  -4.367  -7.431
  440    HA   ILE  59           HA       ILE  59   4.789  -7.256  -6.702
  441    HB   ILE  59           HB       ILE  59   2.373  -5.492  -7.027
  442   1HG1  ILE  59          2HG1      ILE  59   2.879  -7.774  -5.109
  443   2HG1  ILE  59          1HG1      ILE  59   3.492  -6.148  -4.804
  444   1HG2  ILE  59          1HG2      ILE  59   1.249  -7.964  -6.877
  445   2HG2  ILE  59          2HG2      ILE  59   2.644  -8.318  -7.894
  446   3HG2  ILE  59          3HG2      ILE  59   1.478  -7.094  -8.393
  447   1HD1  ILE  59          1HD1      ILE  59   1.269  -5.226  -4.793
  448   2HD1  ILE  59          2HD1      ILE  59   1.246  -6.644  -3.745
  449   3HD1  ILE  59          3HD1      ILE  59   0.578  -6.740  -5.374
  450    H    ILE  60           H        ILE  60   5.391  -8.485  -8.416
  451    HA   ILE  60           HA       ILE  60   4.973  -7.401 -11.153
  452    HB   ILE  60           HB       ILE  60   6.611  -9.084 -11.877
  453   1HG1  ILE  60          2HG1      ILE  60   7.491  -9.943  -9.243
  454   2HG1  ILE  60          1HG1      ILE  60   5.818 -10.418  -9.529
  455   1HG2  ILE  60          1HG2      ILE  60   7.514  -7.596  -9.393
  456   2HG2  ILE  60          2HG2      ILE  60   7.427  -6.914 -11.016
  457   3HG2  ILE  60          3HG2      ILE  60   8.567  -8.212 -10.665
  458   1HD1  ILE  60          1HD1      ILE  60   7.493 -10.850 -11.881
  459   2HD1  ILE  60          2HD1      ILE  60   6.423 -11.976 -11.047
  460   3HD1  ILE  60          3HD1      ILE  60   8.074 -11.745 -10.478
  461    H    THR  61           H        THR  61   4.466  -9.171 -12.851
  462    HA   THR  61           HA       THR  61   2.161 -10.768 -11.834
  463    HB   THR  61           HB       THR  61   2.796 -10.285 -14.747
  464    HG1  THR  61           HG1      THR  61   1.108  -8.600 -13.250
  465   1HG2  THR  61          1HG2      THR  61   0.095 -10.433 -13.424
  466   2HG2  THR  61          2HG2      THR  61   0.979 -11.902 -13.827
  467   3HG2  THR  61          3HG2      THR  61   0.522 -10.773 -15.100
  468    H    ASN  62           H        ASN  62   1.907 -12.980 -12.606
  469    HA   ASN  62           HA       ASN  62   4.222 -14.602 -12.425
  470   1HB   ASN  62          2HB       ASN  62   2.792 -16.440 -13.207
  471   2HB   ASN  62          1HB       ASN  62   1.916 -15.434 -12.054
  472   1HD2  ASN  62          1HD2      ASN  62   1.949 -16.586 -15.349
  473   2HD2  ASN  62          2HD2      ASN  62   0.564 -15.751 -15.867
  474    H    ASP  63           H        ASP  63   2.861 -12.946 -15.195
  475    HA   ASP  63           HA       ASP  63   4.299 -14.536 -17.183
  476   1HB   ASP  63          2HB       ASP  63   2.953 -11.824 -17.426
  477   2HB   ASP  63          1HB       ASP  63   3.516 -12.814 -18.773
  478    H    GLY  64           H        GLY  64   4.664 -11.241 -15.810
  479   1HA   GLY  64          2HA       GLY  64   7.239 -10.945 -15.266
  480   2HA   GLY  64          1HA       GLY  64   7.377 -11.075 -17.019
  481    H    VAL  65           H        VAL  65   5.134  -9.339 -14.816
  482    HA   VAL  65           HA       VAL  65   5.853  -6.811 -16.243
  483    HB   VAL  65           HB       VAL  65   3.057  -7.629 -15.378
  484   1HG1  VAL  65          1HG1      VAL  65   3.852  -5.126 -15.419
  485   2HG1  VAL  65          2HG1      VAL  65   2.321  -5.556 -16.179
  486   3HG1  VAL  65          3HG1      VAL  65   3.760  -5.316 -17.170
  487   1HG2  VAL  65          1HG2      VAL  65   2.780  -7.410 -17.991
  488   2HG2  VAL  65          2HG2      VAL  65   3.416  -8.905 -17.305
  489   3HG2  VAL  65          3HG2      VAL  65   4.517  -7.718 -18.007
  490    H    GLY  66           H        GLY  66   6.725  -5.456 -14.766
  491   1HA   GLY  66          2HA       GLY  66   6.399  -5.848 -11.908
  492   2HA   GLY  66          1HA       GLY  66   7.303  -4.544 -12.676
  493    H    VAL  67           H        VAL  67   4.130  -5.579 -11.602
  494    HA   VAL  67           HA       VAL  67   2.733  -3.160 -12.392
  495    HB   VAL  67           HB       VAL  67   1.929  -5.078 -10.186
  496   1HG1  VAL  67          1HG1      VAL  67   0.189  -3.513 -12.100
  497   2HG1  VAL  67          2HG1      VAL  67   0.719  -2.847 -10.557
  498   3HG1  VAL  67          3HG1      VAL  67  -0.283  -4.296 -10.592
  499   1HG2  VAL  67          1HG2      VAL  67   2.453  -5.797 -12.821
  500   2HG2  VAL  67          2HG2      VAL  67   0.720  -5.485 -12.820
  501   3HG2  VAL  67          3HG2      VAL  67   1.399  -6.670 -11.709
  502    H    ASN  68           H        ASN  68   2.715  -1.231 -11.362
  503    HA   ASN  68           HA       ASN  68   4.085  -1.022  -8.725
  504   1HB   ASN  68          2HB       ASN  68   3.524   0.893 -10.974
  505   2HB   ASN  68          1HB       ASN  68   3.784   1.528  -9.350
  506   1HD2  ASN  68          1HD2      ASN  68   5.473   1.109 -12.091
  507   2HD2  ASN  68          2HD2      ASN  68   7.000   0.709 -11.469
  508    HA   PRO  69           HA       PRO  69   0.317  -0.085  -6.650
  509   1HB   PRO  69          2HB       PRO  69   1.281   1.567  -4.667
  510   2HB   PRO  69          1HB       PRO  69   1.519  -0.188  -4.680
  511   1HG   PRO  69          2HG       PRO  69   3.480   1.973  -5.277
  512   2HG   PRO  69          1HG       PRO  69   3.768   0.327  -4.690
  513   1HD   PRO  69          2HD       PRO  69   4.108   1.233  -7.358
  514   2HD   PRO  69          1HD       PRO  69   4.105  -0.459  -6.816
  515    H    ALA  70           H        ALA  70  -0.027   1.269  -8.823
  516    HA   ALA  70           HA       ALA  70  -0.811   4.007  -7.989
  517   1HB   ALA  70          1HB       ALA  70   1.330   3.346  -9.901
  518   2HB   ALA  70          2HB       ALA  70   1.022   4.850  -9.034
  519   3HB   ALA  70          3HB       ALA  70   0.144   4.494 -10.520
  520    H    GLN  71           H        GLN  71  -2.052   1.291  -8.961
  521    HA   GLN  71           HA       GLN  71  -3.879   2.550 -10.970
  522   1HB   GLN  71          2HB       GLN  71  -2.590  -0.175 -10.978
  523   2HB   GLN  71          1HB       GLN  71  -4.126   0.089 -11.805
  524   1HG   GLN  71          2HG       GLN  71  -3.179   1.720 -13.262
  525   2HG   GLN  71          1HG       GLN  71  -1.722   1.860 -12.277
  526   1HE2  GLN  71          1HE2      GLN  71  -0.158   0.054 -12.361
  527   2HE2  GLN  71          2HE2      GLN  71  -0.188  -1.054 -13.647
  528    HA   PRO  72           HA       PRO  72  -7.142   1.194  -8.347
  529   1HB   PRO  72          2HB       PRO  72  -9.120   0.715 -10.198
  530   2HB   PRO  72          1HB       PRO  72  -8.599   2.338  -9.714
  531   1HG   PRO  72          2HG       PRO  72  -8.024   0.857 -12.238
  532   2HG   PRO  72          1HG       PRO  72  -8.099   2.603 -11.955
  533   1HD   PRO  72          2HD       PRO  72  -5.736   1.067 -12.182
  534   2HD   PRO  72          1HD       PRO  72  -5.843   2.728 -11.560
  535    H    ALA  73           H        ALA  73  -8.039  -0.717  -7.502
  536    HA   ALA  73           HA       ALA  73  -6.883  -3.218  -8.097
  537   1HB   ALA  73          1HB       ALA  73  -9.065  -2.230  -6.423
  538   2HB   ALA  73          2HB       ALA  73  -7.914  -3.528  -6.110
  539   3HB   ALA  73          3HB       ALA  73  -9.379  -3.852  -7.034
  540    H    GLY  74           H        GLY  74  -9.939  -1.824  -9.305
  541   1HA   GLY  74          2HA       GLY  74 -10.933  -4.095 -10.679
  542   2HA   GLY  74          1HA       GLY  74 -11.260  -2.426 -11.148
  543    H    ASN  75           H        ASN  75  -8.722  -1.528 -11.849
  544    HA   ASN  75           HA       ASN  75  -8.391  -2.685 -14.478
  545   1HB   ASN  75          2HB       ASN  75  -7.915  -0.270 -13.789
  546   2HB   ASN  75          1HB       ASN  75  -6.416  -0.870 -13.076
  547   1HD2  ASN  75          1HD2      ASN  75  -4.702  -1.514 -14.519
  548   2HD2  ASN  75          2HD2      ASN  75  -4.791  -1.287 -16.199
  549    H    ILE  76           H        ILE  76  -6.614  -3.005 -11.414
  550    HA   ILE  76           HA       ILE  76  -4.331  -4.397 -12.407
  551    HB   ILE  76           HB       ILE  76  -5.734  -4.601  -9.723
  552   1HG1  ILE  76          2HG1      ILE  76  -4.846  -2.346 -10.403
  553   2HG1  ILE  76          1HG1      ILE  76  -4.069  -3.006  -8.967
  554   1HG2  ILE  76          1HG2      ILE  76  -2.865  -5.195  -9.807
  555   2HG2  ILE  76          2HG2      ILE  76  -3.826  -6.353 -10.724
  556   3HG2  ILE  76          3HG2      ILE  76  -4.171  -6.076  -9.018
  557   1HD1  ILE  76          1HD1      ILE  76  -2.930  -3.309 -11.758
  558   2HD1  ILE  76          2HD1      ILE  76  -2.132  -3.679 -10.231
  559   3HD1  ILE  76          3HD1      ILE  76  -2.476  -2.005 -10.662
  560    H    PHE  77           H        PHE  77  -7.499  -5.613 -11.299
  561    HA   PHE  77           HA       PHE  77  -6.835  -8.405 -11.736
  562   1HB   PHE  77          2HB       PHE  77  -8.682  -7.400 -10.222
  563   2HB   PHE  77          1HB       PHE  77  -9.635  -7.275 -11.699
  564    HD1  PHE  77           HD1      PHE  77  -8.192  -9.544  -9.213
  565    HD2  PHE  77           HD2      PHE  77 -10.263  -9.311 -12.971
  566    HE1  PHE  77           HE1      PHE  77  -8.783 -11.946  -9.039
  567    HE2  PHE  77           HE2      PHE  77 -10.852 -11.712 -12.794
  568    HZ   PHE  77           HZ       PHE  77 -10.112 -13.029 -10.828
  569    H    LEU  78           H        LEU  78  -8.463  -5.888 -13.652
  570    HA   LEU  78           HA       LEU  78  -9.329  -7.623 -15.784
  571   1HB   LEU  78          2HB       LEU  78  -8.859  -4.643 -15.595
  572   2HB   LEU  78          1HB       LEU  78  -9.395  -5.409 -17.090
  573    HG   LEU  78           HG       LEU  78 -10.832  -5.822 -14.460
  574   1HD1  LEU  78          1HD1      LEU  78 -11.289  -3.584 -14.643
  575   2HD1  LEU  78          2HD1      LEU  78 -12.464  -4.153 -15.828
  576   3HD1  LEU  78          3HD1      LEU  78 -10.901  -3.538 -16.362
  577   1HD2  LEU  78          1HD2      LEU  78 -11.629  -7.451 -15.901
  578   2HD2  LEU  78          2HD2      LEU  78 -11.280  -6.496 -17.342
  579   3HD2  LEU  78          3HD2      LEU  78 -12.693  -6.120 -16.356
  580    H    LYS  79           H        LYS  79  -6.375  -5.694 -15.284
  581    HA   LYS  79           HA       LYS  79  -5.299  -6.389 -17.913
  582   1HB   LYS  79          2HB       LYS  79  -4.836  -4.273 -16.410
  583   2HB   LYS  79          1HB       LYS  79  -3.605  -5.308 -15.685
  584   1HG   LYS  79          2HG       LYS  79  -2.456  -5.573 -17.740
  585   2HG   LYS  79          1HG       LYS  79  -3.826  -4.978 -18.678
  586   1HD   LYS  79          2HD       LYS  79  -2.656  -3.018 -18.663
  587   2HD   LYS  79          1HD       LYS  79  -3.378  -2.836 -17.065
  588   1HE   LYS  79          2HE       LYS  79  -1.082  -4.478 -16.748
  589   2HE   LYS  79          1HE       LYS  79  -0.597  -3.114 -17.752
  590   1HZ   LYS  79          1HZ       LYS  79  -2.147  -1.994 -15.806
  591   2HZ   LYS  79          2HZ       LYS  79  -0.450  -1.984 -15.862
  592   3HZ   LYS  79          3HZ       LYS  79  -1.266  -3.179 -14.973
  593    H    HIS  80           H        HIS  80  -4.500  -7.288 -14.531
  594    HA   HIS  80           HA       HIS  80  -2.825  -9.506 -15.625
  595   1HB   HIS  80          2HB       HIS  80  -2.878  -8.451 -12.782
  596   2HB   HIS  80          1HB       HIS  80  -1.683  -9.533 -13.499
  597    HD1  HIS  80           HD1      HIS  80  -0.465  -8.403 -15.749
  598    HD2  HIS  80           HD2      HIS  80  -2.103  -5.805 -12.930
  599    HE1  HIS  80           HE1      HIS  80   0.565  -6.134 -16.184
  600    H    GLY  81           H        GLY  81  -4.864  -9.040 -12.694
  601   1HA   GLY  81          2HA       GLY  81  -6.953 -10.533 -12.674
  602   2HA   GLY  81          1HA       GLY  81  -5.849 -11.835 -13.112
  603    H    SER  82           H        SER  82  -5.290 -13.079 -11.409
  604    HA   SER  82           HA       SER  82  -5.130 -11.795  -8.708
  605   1HB   SER  82          2HB       SER  82  -6.956 -13.604  -9.259
  606   2HB   SER  82          1HB       SER  82  -5.618 -14.737  -9.087
  607    HG   SER  82           HG       SER  82  -6.615 -14.428  -7.092
  608    H    GLU  83           H        GLU  83  -3.767 -14.425 -10.733
  609    HA   GLU  83           HA       GLU  83  -1.645 -15.148  -8.989
  610   1HB   GLU  83          2HB       GLU  83  -2.471 -15.835 -11.604
  611   2HB   GLU  83          1HB       GLU  83  -0.789 -15.324 -11.742
  612   1HG   GLU  83          2HG       GLU  83  -1.656 -17.209  -9.553
  613   2HG   GLU  83          1HG       GLU  83  -1.261 -17.812 -11.162
  614    H    LEU  84           H        LEU  84  -0.308 -13.653  -8.131
  615    HA   LEU  84           HA       LEU  84   1.283 -11.946  -9.980
  616   1HB   LEU  84          2HB       LEU  84  -0.321 -11.012  -7.592
  617   2HB   LEU  84          1HB       LEU  84   1.046 -10.088  -8.213
  618    HG   LEU  84           HG       LEU  84  -0.902 -10.979 -10.257
  619   1HD1  LEU  84          1HD1      LEU  84  -1.797  -8.542  -8.865
  620   2HD1  LEU  84          2HD1      LEU  84  -2.021 -10.026  -7.937
  621   3HD1  LEU  84          3HD1      LEU  84  -2.745  -9.868  -9.538
  622   1HD2  LEU  84          1HD2      LEU  84  -0.526  -8.270 -10.496
  623   2HD2  LEU  84          2HD2      LEU  84   0.510  -9.487 -11.240
  624   3HD2  LEU  84          3HD2      LEU  84   0.966  -8.762  -9.698
  625    H    ARG  85           H        ARG  85   3.177 -10.944  -8.704
  626    HA   ARG  85           HA       ARG  85   4.100 -12.768  -6.518
  627   1HB   ARG  85          2HB       ARG  85   5.353 -12.146  -9.131
  628   2HB   ARG  85          1HB       ARG  85   6.435 -12.060  -7.742
  629   1HG   ARG  85          2HG       ARG  85   6.628 -14.301  -7.961
  630   2HG   ARG  85          1HG       ARG  85   5.013 -14.381  -7.255
  631   1HD   ARG  85          2HD       ARG  85   3.978 -14.467  -9.416
  632   2HD   ARG  85          1HD       ARG  85   5.487 -14.049 -10.227
  633    HE   ARG  85           HE       ARG  85   6.331 -16.313  -9.328
  634   1HH1  ARG  85          1HH2      ARG  85   3.678 -16.880  -7.932
  635   2HH1  ARG  85          2HH2      ARG  85   2.929 -17.959  -9.063
  636   1HH2  ARG  85          2HH1      ARG  85   5.095 -17.157 -11.663
  637   2HH2  ARG  85          1HH1      ARG  85   3.735 -18.117 -11.185
  638    H    LEU  86           H        LEU  86   5.735 -11.753  -5.097
  639    HA   LEU  86           HA       LEU  86   5.511  -8.767  -5.100
  640   1HB   LEU  86          2HB       LEU  86   4.599 -10.389  -3.132
  641   2HB   LEU  86          1HB       LEU  86   6.256 -10.155  -2.586
  642    HG   LEU  86           HG       LEU  86   4.792  -7.731  -3.512
  643   1HD1  LEU  86          1HD1      LEU  86   4.336  -8.232  -0.677
  644   2HD1  LEU  86          2HD1      LEU  86   3.541  -9.437  -1.687
  645   3HD1  LEU  86          3HD1      LEU  86   3.194  -7.725  -1.920
  646   1HD2  LEU  86          1HD2      LEU  86   7.175  -7.780  -2.679
  647   2HD2  LEU  86          2HD2      LEU  86   6.553  -8.251  -1.098
  648   3HD2  LEU  86          3HD2      LEU  86   6.125  -6.683  -1.784
  649    H    ILE  87           H        ILE  87   7.379  -7.753  -5.504
  650    HA   ILE  87           HA       ILE  87   9.946  -9.150  -4.853
  651    HB   ILE  87           HB       ILE  87   9.580  -8.946  -7.296
  652   1HG1  ILE  87          2HG1      ILE  87  11.676  -6.966  -6.349
  653   2HG1  ILE  87          1HG1      ILE  87  11.883  -8.716  -6.296
  654   1HG2  ILE  87          1HG2      ILE  87   8.139  -6.853  -7.060
  655   2HG2  ILE  87          2HG2      ILE  87   9.309  -6.826  -8.377
  656   3HG2  ILE  87          3HG2      ILE  87   9.641  -5.946  -6.886
  657   1HD1  ILE  87          1HD1      ILE  87  12.501  -8.726  -8.458
  658   2HD1  ILE  87          2HD1      ILE  87  12.341  -6.970  -8.500
  659   3HD1  ILE  87          3HD1      ILE  87  10.965  -7.991  -8.914
  660    HA   PRO  88           HA       PRO  88  10.621  -5.581  -2.302
  661   1HB   PRO  88          2HB       PRO  88  13.245  -6.145  -1.672
  662   2HB   PRO  88          1HB       PRO  88  11.862  -6.956  -0.920
  663   1HG   PRO  88          2HG       PRO  88  13.749  -7.992  -2.985
  664   2HG   PRO  88          1HG       PRO  88  12.814  -8.881  -1.771
  665   1HD   PRO  88          2HD       PRO  88  12.163  -8.657  -4.510
  666   2HD   PRO  88          1HD       PRO  88  11.075  -9.224  -3.227
  667    H    ARG  89           H        ARG  89  10.529  -4.701  -4.802
  668    HA   ARG  89           HA       ARG  89  12.675  -2.769  -5.031
  669   1HB   ARG  89          2HB       ARG  89  13.730  -4.860  -5.983
  670   2HB   ARG  89          1HB       ARG  89  12.482  -4.857  -7.228
  671   1HG   ARG  89          2HG       ARG  89  13.822  -3.493  -8.425
  672   2HG   ARG  89          1HG       ARG  89  13.483  -2.241  -7.230
  673   1HD   ARG  89          2HD       ARG  89  15.396  -3.651  -5.913
  674   2HD   ARG  89          1HD       ARG  89  15.908  -3.910  -7.582
  675    HE   ARG  89           HE       ARG  89  15.688  -1.296  -7.719
  676   1HH1  ARG  89          2HH1      ARG  89  18.332  -2.309  -6.763
  677   2HH1  ARG  89          1HH1      ARG  89  18.551  -1.440  -5.281
  678   1HH2  ARG  89          1HH2      ARG  89  15.203  -0.527  -5.027
  679   2HH2  ARG  89          2HH2      ARG  89  16.769  -0.427  -4.290
  680    H    ASP  90           H        ASP  90  11.426  -1.028  -5.529
  681    HA   ASP  90           HA       ASP  90   8.925  -1.273  -7.010
  682   1HB   ASP  90          2HB       ASP  90  10.320   0.794  -5.474
  683   2HB   ASP  90          1HB       ASP  90   9.580   1.438  -6.939
  684    H    ARG  91           H        ARG  91   8.971  -1.579  -9.191
  685    HA   ARG  91           HA       ARG  91  10.691   0.183 -10.830
  686   1HB   ARG  91          2HB       ARG  91  11.334  -2.560 -10.296
  687   2HB   ARG  91          1HB       ARG  91  10.916  -2.394 -12.003
  688   1HG   ARG  91          2HG       ARG  91  12.528  -0.613 -12.291
  689   2HG   ARG  91          1HG       ARG  91  12.851  -0.563 -10.558
  690   1HD   ARG  91          2HD       ARG  91  14.546  -1.993 -10.994
  691   2HD   ARG  91          1HD       ARG  91  13.295  -3.219 -11.190
  692    HE   ARG  91           HE       ARG  91  13.306  -2.411 -13.675
  693   1HH1  ARG  91          2HH1      ARG  91  15.794  -0.723 -12.594
  694   2HH1  ARG  91          1HH1      ARG  91  17.064  -1.602 -13.378
  695   1HH2  ARG  91          1HH2      ARG  91  15.031  -4.311 -14.199
  696   2HH2  ARG  91          2HH2      ARG  91  16.629  -3.647 -14.296
  697    H    VAL  92           H        VAL  92  10.141  -0.004 -13.177
  698    HA   VAL  92           HA       VAL  92   7.215  -0.230 -13.480
  699    HB   VAL  92           HB       VAL  92   9.338   0.712 -15.434
  700   1HG1  VAL  92          1HG1      VAL  92   7.318   1.816 -16.507
  701   2HG1  VAL  92          2HG1      VAL  92   6.312   0.813 -15.462
  702   3HG1  VAL  92          3HG1      VAL  92   7.375   0.059 -16.651
  703   1HG2  VAL  92          1HG2      VAL  92   8.077   2.957 -14.768
  704   2HG2  VAL  92          2HG2      VAL  92   9.416   2.350 -13.794
  705   3HG2  VAL  92          3HG2      VAL  92   7.752   2.067 -13.281
  706    H    GLY  93           H        GLY  93  10.092  -1.447 -15.260
  707   1HA   GLY  93          2HA       GLY  93   8.432  -3.386 -16.712
  708   2HA   GLY  93          1HA       GLY  93  10.168  -3.157 -16.902
  709    H    HIS  94           HN       HIS  94  11.456  -3.829 -14.828
  710    HA   HIS  94           HA       HIS  94  10.220  -6.215 -13.536
  711   1HB   HIS  94          2HB       HIS  94  12.022  -6.416 -15.656
  712   2HB   HIS  94          1HB       HIS  94  13.033  -6.648 -14.232
  713    HD1  HIS  94           HD1      HIS  94  10.322  -8.244 -16.219
  714    HD2  HIS  94           HD2      HIS  94  12.286  -8.921 -12.612
  715    HE1  HIS  94           HE1      HIS  94   9.736 -10.604 -15.517
  Start of MODEL   15
    1   1H    MET   1          1H        MET   1 -19.513 -13.175  -5.882
    2   2H    MET   1          2H        MET   1 -20.827 -14.006  -6.568
    3   3H    MET   1          3H        MET   1 -20.443 -12.437  -7.094
    4    HA   MET   1           HA       MET   1 -19.724 -14.132  -8.688
    5   1HB   MET   1          2HB       MET   1 -18.446 -11.895  -8.041
    6   2HB   MET   1          1HB       MET   1 -17.214 -13.019  -7.475
    7   1HG   MET   1          2HG       MET   1 -16.843 -13.899  -9.624
    8   2HG   MET   1          1HG       MET   1 -18.411 -13.340 -10.226
    9   1HE   MET   1          1HE       MET   1 -16.517 -11.637 -12.556
   10   2HE   MET   1          2HE       MET   1 -16.382 -13.242 -11.840
   11   3HE   MET   1          3HE       MET   1 -15.038 -12.108 -11.709
   12    H    SER   2           H        SER   2 -18.788 -16.103  -9.034
   13    HA   SER   2           HA       SER   2 -17.082 -17.354  -6.967
   14   1HB   SER   2          2HB       SER   2 -19.898 -18.155  -7.542
   15   2HB   SER   2          1HB       SER   2 -18.725 -19.457  -7.358
   16    HG   SER   2           HG       SER   2 -18.924 -19.112  -5.301
   17    H    GLY   3           H        GLY   3 -18.931 -18.105  -9.960
   18   1HA   GLY   3          2HA       GLY   3 -16.380 -19.125 -11.156
   19   2HA   GLY   3          1HA       GLY   3 -17.875 -20.044 -11.323
   20    H    GLY   4           H        GLY   4 -19.502 -19.288 -12.734
   21   1HA   GLY   4          2HA       GLY   4 -18.613 -17.206 -14.671
   22   2HA   GLY   4          1HA       GLY   4 -19.856 -18.423 -14.971
   23    H    THR   5           H        THR   5 -19.193 -15.358 -13.334
   24    HA   THR   5           HA       THR   5 -22.149 -14.945 -13.120
   25    HB   THR   5           HB       THR   5 -20.083 -14.784 -11.015
   26    HG1  THR   5           HG1      THR   5 -21.662 -15.987 -10.371
   27   1HG2  THR   5          1HG2      THR   5 -20.784 -12.814  -9.927
   28   2HG2  THR   5          2HG2      THR   5 -22.222 -12.659 -10.942
   29   3HG2  THR   5          3HG2      THR   5 -20.625 -12.327 -11.617
   30    H    ALA   6           H        ALA   6 -22.753 -12.600 -13.065
   31    HA   ALA   6           HA       ALA   6 -21.530 -11.129 -15.223
   32   1HB   ALA   6          1HB       ALA   6 -23.921 -10.937 -14.701
   33   2HB   ALA   6          2HB       ALA   6 -23.156  -9.352 -14.571
   34   3HB   ALA   6          3HB       ALA   6 -23.542 -10.271 -13.115
   35    H    ALA   7           H        ALA   7 -19.765  -9.859 -15.123
   36    HA   ALA   7           HA       ALA   7 -18.503  -9.156 -12.585
   37   1HB   ALA   7          1HB       ALA   7 -17.460  -7.599 -14.757
   38   2HB   ALA   7          2HB       ALA   7 -17.730  -9.241 -15.337
   39   3HB   ALA   7          3HB       ALA   7 -16.697  -8.961 -13.934
   40    H    THR   8           H        THR   8 -19.590  -7.642 -11.377
   41    HA   THR   8           HA       THR   8 -20.938  -5.373 -12.742
   42    HB   THR   8           HB       THR   8 -21.341  -5.051 -10.011
   43    HG1  THR   8           HG1      THR   8 -22.027  -7.237  -9.457
   44   1HG2  THR   8          1HG2      THR   8 -23.068  -4.801 -11.668
   45   2HG2  THR   8          2HG2      THR   8 -23.592  -6.040 -10.531
   46   3HG2  THR   8          3HG2      THR   8 -22.962  -6.503 -12.112
   47    H    THR   9           H        THR   9 -20.671  -3.167 -11.911
   48    HA   THR   9           HA       THR   9 -17.858  -2.618 -11.060
   49    HB   THR   9           HB       THR   9 -19.854  -0.674 -12.252
   50    HG1  THR   9           HG1      THR   9 -17.934  -2.360 -13.477
   51   1HG2  THR   9          1HG2      THR   9 -16.856  -0.652 -11.848
   52   2HG2  THR   9          2HG2      THR   9 -18.041   0.456 -11.158
   53   3HG2  THR   9          3HG2      THR   9 -17.698   0.497 -12.887
   54    H    ALA  10           H        ALA  10 -20.914  -2.858  -9.724
   55    HA   ALA  10           HA       ALA  10 -20.394  -0.700  -7.722
   56   1HB   ALA  10          1HB       ALA  10 -22.993  -2.119  -8.389
   57   2HB   ALA  10          2HB       ALA  10 -22.550  -0.499  -8.922
   58   3HB   ALA  10          3HB       ALA  10 -22.801  -0.825  -7.207
   59    H    GLY  11           H        GLY  11 -21.867  -3.987  -7.875
   60   1HA   GLY  11          2HA       GLY  11 -20.827  -4.445  -5.107
   61   2HA   GLY  11          1HA       GLY  11 -22.226  -5.268  -5.793
   62    H    SER  12           H        SER  12 -18.754  -4.809  -6.603
   63    HA   SER  12           HA       SER  12 -18.429  -7.740  -6.809
   64   1HB   SER  12          2HB       SER  12 -18.754  -6.041  -9.130
   65   2HB   SER  12          1HB       SER  12 -17.146  -6.758  -9.125
   66    HG   SER  12           HG       SER  12 -18.128  -8.486  -9.795
   67    H    LYS  13           H        LYS  13 -16.427  -8.305  -6.066
   68    HA   LYS  13           HA       LYS  13 -14.395  -6.121  -5.787
   69   1HB   LYS  13          2HB       LYS  13 -15.026  -8.484  -4.001
   70   2HB   LYS  13          1HB       LYS  13 -13.548  -7.539  -3.840
   71   1HG   LYS  13          2HG       LYS  13 -14.631  -5.829  -2.824
   72   2HG   LYS  13          1HG       LYS  13 -15.947  -5.857  -3.998
   73   1HD   LYS  13          2HD       LYS  13 -16.483  -8.152  -2.661
   74   2HD   LYS  13          1HD       LYS  13 -15.725  -7.223  -1.367
   75   1HE   LYS  13          2HE       LYS  13 -17.455  -5.745  -1.240
   76   2HE   LYS  13          1HE       LYS  13 -17.683  -5.713  -2.990
   77   1HZ   LYS  13          1HZ       LYS  13 -18.575  -8.080  -2.657
   78   2HZ   LYS  13          2HZ       LYS  13 -19.569  -6.775  -2.217
   79   3HZ   LYS  13          3HZ       LYS  13 -18.732  -7.646  -1.024
   80    H    VAL  14           H        VAL  14 -12.170  -6.725  -6.060
   81    HA   VAL  14           HA       VAL  14 -11.789  -9.171  -7.739
   82    HB   VAL  14           HB       VAL  14  -9.750  -7.951  -8.614
   83   1HG1  VAL  14          1HG1      VAL  14 -11.531  -6.015  -9.547
   84   2HG1  VAL  14          2HG1      VAL  14 -12.567  -7.374  -9.109
   85   3HG1  VAL  14          3HG1      VAL  14 -11.253  -7.603 -10.261
   86   1HG2  VAL  14          1HG2      VAL  14 -11.020  -5.569  -7.223
   87   2HG2  VAL  14          2HG2      VAL  14  -9.568  -5.553  -8.221
   88   3HG2  VAL  14          3HG2      VAL  14  -9.557  -6.380  -6.666
   89    H    THR  15           H        THR  15 -10.448 -10.730  -6.952
   90    HA   THR  15           HA       THR  15  -8.986 -10.152  -4.424
   91    HB   THR  15           HB       THR  15 -10.571 -12.090  -4.489
   92    HG1  THR  15           HG1      THR  15  -9.185 -12.602  -3.005
   93   1HG2  THR  15          1HG2      THR  15 -10.368 -12.889  -6.728
   94   2HG2  THR  15          2HG2      THR  15  -9.676 -14.150  -5.709
   95   3HG2  THR  15          3HG2      THR  15  -8.619 -13.049  -6.590
   96    H    PHE  16           H        PHE  16  -6.752 -10.750  -4.197
   97    HA   PHE  16           HA       PHE  16  -5.311 -11.275  -6.764
   98   1HB   PHE  16          2HB       PHE  16  -4.427  -9.305  -4.639
   99   2HB   PHE  16          1HB       PHE  16  -3.600  -9.646  -6.155
  100    HD1  PHE  16           HD1      PHE  16  -5.986  -7.548  -4.551
  101    HD2  PHE  16           HD2      PHE  16  -5.023  -9.324  -8.341
  102    HE1  PHE  16           HE1      PHE  16  -7.374  -5.847  -5.702
  103    HE2  PHE  16           HE2      PHE  16  -6.411  -7.623  -9.492
  104    HZ   PHE  16           HZ       PHE  16  -7.586  -5.885  -8.172
  105    H    LYS  17           H        LYS  17  -3.743 -12.797  -6.605
  106    HA   LYS  17           HA       LYS  17  -3.071 -13.846  -3.886
  107   1HB   LYS  17          2HB       LYS  17  -4.224 -15.398  -5.549
  108   2HB   LYS  17          1HB       LYS  17  -2.762 -15.300  -6.529
  109   1HG   LYS  17          2HG       LYS  17  -1.872 -15.834  -3.910
  110   2HG   LYS  17          1HG       LYS  17  -3.260 -16.892  -4.160
  111   1HD   LYS  17          2HD       LYS  17  -1.971 -18.255  -5.398
  112   2HD   LYS  17          1HD       LYS  17  -1.741 -16.949  -6.562
  113   1HE   LYS  17          2HE       LYS  17  -0.077 -16.398  -4.309
  114   2HE   LYS  17          1HE       LYS  17   0.183 -18.080  -4.767
  115   1HZ   LYS  17          1HZ       LYS  17   0.772 -17.467  -6.934
  116   2HZ   LYS  17          2HZ       LYS  17   1.581 -16.354  -5.937
  117   3HZ   LYS  17          3HZ       LYS  17   0.170 -15.891  -6.759
  118    H    ILE  18           H        ILE  18  -1.184 -12.837  -3.308
  119    HA   ILE  18           HA       ILE  18   0.984 -12.652  -5.364
  120    HB   ILE  18           HB       ILE  18   0.698 -11.024  -2.822
  121   1HG1  ILE  18          2HG1      ILE  18   0.314  -9.391  -5.088
  122   2HG1  ILE  18          1HG1      ILE  18  -0.691 -10.813  -5.364
  123   1HG2  ILE  18          1HG2      ILE  18   2.859 -10.600  -3.343
  124   2HG2  ILE  18          2HG2      ILE  18   2.196  -9.599  -4.632
  125   3HG2  ILE  18          3HG2      ILE  18   2.697 -11.257  -4.969
  126   1HD1  ILE  18          1HD1      ILE  18  -1.602 -10.521  -3.028
  127   2HD1  ILE  18          2HD1      ILE  18  -2.016  -9.211  -4.132
  128   3HD1  ILE  18          3HD1      ILE  18  -0.731  -8.990  -2.945
  129    H    THR  19           H        THR  19   2.808 -13.824  -5.008
  130    HA   THR  19           HA       THR  19   3.248 -14.961  -2.272
  131    HB   THR  19           HB       THR  19   2.613 -16.645  -4.031
  132    HG1  THR  19           HG1      THR  19   3.772 -17.822  -2.766
  133   1HG2  THR  19          1HG2      THR  19   3.721 -15.499  -5.938
  134   2HG2  THR  19          2HG2      THR  19   4.236 -17.178  -5.784
  135   3HG2  THR  19          3HG2      THR  19   5.292 -15.879  -5.232
  136    H    LEU  20           H        LEU  20   5.501 -15.157  -1.602
  137    HA   LEU  20           HA       LEU  20   7.134 -12.909  -2.317
  138   1HB   LEU  20          2HB       LEU  20   7.137 -14.428  -0.161
  139   2HB   LEU  20          1HB       LEU  20   8.320 -15.372  -1.067
  140    HG   LEU  20           HG       LEU  20   9.701 -13.349  -1.381
  141   1HD1  LEU  20          1HD1      LEU  20   8.937 -11.408   0.264
  142   2HD1  LEU  20          2HD1      LEU  20   7.339 -12.086  -0.042
  143   3HD1  LEU  20          3HD1      LEU  20   8.314 -11.489  -1.383
  144   1HD2  LEU  20          1HD2      LEU  20   9.767 -14.865   0.734
  145   2HD2  LEU  20          2HD2      LEU  20   9.014 -13.497   1.553
  146   3HD2  LEU  20          3HD2      LEU  20  10.597 -13.312   0.800
  147    H    THR  21           H        THR  21   8.745 -12.691  -3.823
  148    HA   THR  21           HA       THR  21   9.236 -15.014  -5.633
  149    HB   THR  21           HB       THR  21  10.032 -12.169  -6.234
  150    HG1  THR  21           HG1      THR  21   8.035 -11.655  -6.654
  151   1HG2  THR  21          1HG2      THR  21  10.387 -12.957  -8.331
  152   2HG2  THR  21          2HG2      THR  21   8.920 -13.935  -8.309
  153   3HG2  THR  21          3HG2      THR  21  10.397 -14.545  -7.567
  154    H    SER  22           H        SER  22  11.009 -12.312  -4.073
  155    HA   SER  22           HA       SER  22  13.629 -13.126  -4.751
  156   1HB   SER  22          2HB       SER  22  12.425 -11.234  -2.956
  157   2HB   SER  22          1HB       SER  22  13.714 -12.079  -2.106
  158    HG   SER  22           HG       SER  22  14.047 -10.120  -3.704
  159    H    ASP  23           H        ASP  23  11.812 -13.900  -1.752
  160    HA   ASP  23           HA       ASP  23  13.742 -16.132  -1.267
  161   1HB   ASP  23          2HB       ASP  23  12.278 -14.257   0.482
  162   2HB   ASP  23          1HB       ASP  23  12.245 -15.933   1.025
  163    HA   PRO  24           HA       PRO  24  10.450 -18.996  -2.030
  164   1HB   PRO  24          2HB       PRO  24  11.608 -21.181  -0.817
  165   2HB   PRO  24          1HB       PRO  24  12.096 -20.576  -2.410
  166   1HG   PRO  24          2HG       PRO  24  13.506 -20.325   0.206
  167   2HG   PRO  24          1HG       PRO  24  14.175 -20.321  -1.435
  168   1HD   PRO  24          2HD       PRO  24  13.748 -18.040   0.187
  169   2HD   PRO  24          1HD       PRO  24  14.100 -18.034  -1.554
  170    H    LYS  25           H        LYS  25  11.581 -18.096   1.126
  171    HA   LYS  25           HA       LYS  25   9.767 -19.667   2.745
  172   1HB   LYS  25          2HB       LYS  25  11.815 -17.633   3.147
  173   2HB   LYS  25          1HB       LYS  25  10.413 -17.339   4.172
  174   1HG   LYS  25          2HG       LYS  25  10.574 -19.877   4.735
  175   2HG   LYS  25          1HG       LYS  25  12.213 -19.756   4.093
  176   1HD   LYS  25          2HD       LYS  25  12.917 -18.315   5.779
  177   2HD   LYS  25          1HD       LYS  25  11.287 -17.720   6.095
  178   1HE   LYS  25          2HE       LYS  25  10.681 -19.911   7.069
  179   2HE   LYS  25          1HE       LYS  25  12.321 -20.488   6.773
  180   1HZ   LYS  25          1HZ       LYS  25  12.811 -18.229   8.105
  181   2HZ   LYS  25          2HZ       LYS  25  12.650 -19.747   8.850
  182   3HZ   LYS  25          3HZ       LYS  25  11.332 -18.679   8.810
  183    H    LEU  26           H        LEU  26   8.166 -18.478   4.223
  184    HA   LEU  26           HA       LEU  26   6.198 -17.277   4.516
  185   1HB   LEU  26          2HB       LEU  26   7.910 -15.462   2.948
  186   2HB   LEU  26          1HB       LEU  26   6.183 -15.143   2.794
  187    HG   LEU  26           HG       LEU  26   6.480 -15.621   5.506
  188   1HD1  LEU  26          1HD1      LEU  26   8.569 -15.123   6.178
  189   2HD1  LEU  26          2HD1      LEU  26   8.505 -13.582   5.324
  190   3HD1  LEU  26          3HD1      LEU  26   9.062 -15.032   4.488
  191   1HD2  LEU  26          1HD2      LEU  26   5.671 -13.472   5.698
  192   2HD2  LEU  26          2HD2      LEU  26   5.387 -13.712   3.974
  193   3HD2  LEU  26          3HD2      LEU  26   6.811 -12.824   4.518
  194    HA   PRO  27           HA       PRO  27   3.800 -19.106   1.242
  195   1HB   PRO  27          2HB       PRO  27   1.392 -18.849   2.550
  196   2HB   PRO  27          1HB       PRO  27   2.563 -20.134   2.890
  197   1HG   PRO  27          2HG       PRO  27   1.945 -17.683   4.481
  198   2HG   PRO  27          1HG       PRO  27   2.541 -19.259   5.032
  199   1HD   PRO  27          2HD       PRO  27   4.114 -16.945   4.707
  200   2HD   PRO  27          1HD       PRO  27   4.733 -18.604   4.852
  201    H    PHE  28           H        PHE  28   1.912 -18.404  -0.115
  202    HA   PHE  28           HA       PHE  28   2.103 -15.621  -0.853
  203   1HB   PHE  28          2HB       PHE  28   0.377 -16.138  -2.510
  204   2HB   PHE  28          1HB       PHE  28   1.584 -17.420  -2.484
  205    HD1  PHE  28           HD1      PHE  28  -1.865 -16.491  -1.518
  206    HD2  PHE  28           HD2      PHE  28   1.046 -19.648  -1.673
  207    HE1  PHE  28           HE1      PHE  28  -3.639 -18.153  -1.033
  208    HE2  PHE  28           HE2      PHE  28  -0.730 -21.308  -1.187
  209    HZ   PHE  28           HZ       PHE  28  -3.072 -20.561  -0.868
  210    H    LYS  29           H        LYS  29   0.299 -14.077  -0.886
  211    HA   LYS  29           HA       LYS  29  -1.600 -14.471   1.397
  212   1HB   LYS  29          2HB       LYS  29   0.195 -12.212   0.678
  213   2HB   LYS  29          1HB       LYS  29  -1.424 -11.772   1.224
  214   1HG   LYS  29          2HG       LYS  29  -0.448 -11.931   3.290
  215   2HG   LYS  29          1HG       LYS  29  -0.820 -13.642   3.083
  216   1HD   LYS  29          2HD       LYS  29   1.475 -13.877   1.992
  217   2HD   LYS  29          1HD       LYS  29   1.817 -12.247   2.574
  218   1HE   LYS  29          2HE       LYS  29   1.652 -12.894   4.842
  219   2HE   LYS  29          1HE       LYS  29   0.810 -14.391   4.443
  220   1HZ   LYS  29          1HZ       LYS  29   2.732 -15.440   4.236
  221   2HZ   LYS  29          2HZ       LYS  29   3.520 -14.053   4.814
  222   3HZ   LYS  29          3HZ       LYS  29   3.330 -14.289   3.144
  223    H    VAL  30           H        VAL  30  -3.742 -14.086   0.956
  224    HA   VAL  30           HA       VAL  30  -4.426 -13.270  -1.831
  225    HB   VAL  30           HB       VAL  30  -6.161 -14.597   0.283
  226   1HG1  VAL  30          1HG1      VAL  30  -7.627 -13.503  -1.211
  227   2HG1  VAL  30          2HG1      VAL  30  -7.503 -15.130  -1.879
  228   3HG1  VAL  30          3HG1      VAL  30  -6.584 -13.809  -2.599
  229   1HG2  VAL  30          1HG2      VAL  30  -5.886 -16.605  -1.225
  230   2HG2  VAL  30          2HG2      VAL  30  -4.405 -16.122  -0.402
  231   3HG2  VAL  30          3HG2      VAL  30  -4.644 -15.709  -2.099
  232    H    LEU  31           H        LEU  31  -5.208 -11.238  -2.142
  233    HA   LEU  31           HA       LEU  31  -6.292  -9.770   0.232
  234   1HB   LEU  31          2HB       LEU  31  -4.345  -9.053  -1.802
  235   2HB   LEU  31          1HB       LEU  31  -5.680  -7.901  -1.775
  236    HG   LEU  31           HG       LEU  31  -4.872  -8.617   0.923
  237   1HD1  LEU  31          1HD1      LEU  31  -2.688  -7.181   0.616
  238   2HD1  LEU  31          2HD1      LEU  31  -2.767  -7.768  -1.044
  239   3HD1  LEU  31          3HD1      LEU  31  -2.646  -8.913   0.292
  240   1HD2  LEU  31          1HD2      LEU  31  -4.483  -5.903  -0.274
  241   2HD2  LEU  31          2HD2      LEU  31  -5.199  -6.353   1.273
  242   3HD2  LEU  31          3HD2      LEU  31  -6.123  -6.548  -0.217
  243    H    SER  32           H        SER  32  -8.482  -9.723   0.132
  244    HA   SER  32           HA       SER  32  -9.808  -9.574  -2.536
  245   1HB   SER  32          2HB       SER  32 -11.895 -10.110  -1.182
  246   2HB   SER  32          1HB       SER  32 -10.677 -11.381  -1.214
  247    HG   SER  32           HG       SER  32 -11.539 -10.873   0.904
  248    H    VAL  33           H        VAL  33 -10.176  -7.511  -3.164
  249    HA   VAL  33           HA       VAL  33 -11.432  -5.628  -1.231
  250    HB   VAL  33           HB       VAL  33  -9.952  -3.786  -2.147
  251   1HG1  VAL  33          1HG1      VAL  33  -8.146  -4.245  -0.632
  252   2HG1  VAL  33          2HG1      VAL  33  -8.407  -5.985  -0.754
  253   3HG1  VAL  33          3HG1      VAL  33  -9.596  -4.970   0.063
  254   1HG2  VAL  33          1HG2      VAL  33  -9.110  -4.769  -4.165
  255   2HG2  VAL  33          2HG2      VAL  33  -8.520  -6.192  -3.306
  256   3HG2  VAL  33          3HG2      VAL  33  -7.731  -4.632  -3.075
  257    HA   PRO  34           HA       PRO  34 -13.971  -4.638  -4.676
  258   1HB   PRO  34          2HB       PRO  34 -14.607  -2.024  -4.092
  259   2HB   PRO  34          1HB       PRO  34 -15.300  -3.420  -3.248
  260   1HG   PRO  34          2HG       PRO  34 -13.201  -1.510  -2.315
  261   2HG   PRO  34          1HG       PRO  34 -14.375  -2.439  -1.367
  262   1HD   PRO  34          2HD       PRO  34 -11.655  -3.092  -1.677
  263   2HD   PRO  34          1HD       PRO  34 -12.921  -4.196  -1.098
  264    H    GLU  35           H        GLU  35 -14.079  -3.316  -6.647
  265    HA   GLU  35           HA       GLU  35 -11.558  -2.716  -7.808
  266   1HB   GLU  35          2HB       GLU  35 -12.783  -1.824  -9.688
  267   2HB   GLU  35          1HB       GLU  35 -13.675  -3.213  -9.074
  268   1HG   GLU  35          2HG       GLU  35 -14.384  -0.546  -7.937
  269   2HG   GLU  35          1HG       GLU  35 -14.868  -0.860  -9.600
  270    H    SER  36           H        SER  36 -13.682  -0.713  -5.867
  271    HA   SER  36           HA       SER  36 -12.675   1.861  -6.626
  272   1HB   SER  36          2HB       SER  36 -14.134   0.748  -4.266
  273   2HB   SER  36          1HB       SER  36 -13.370   2.324  -4.090
  274    HG   SER  36           HG       SER  36 -15.598   2.274  -4.925
  275    H    THR  37           H        THR  37 -11.567  -0.532  -4.226
  276    HA   THR  37           HA       THR  37  -9.556   1.114  -3.008
  277    HB   THR  37           HB       THR  37  -9.658  -1.906  -3.319
  278    HG1  THR  37           HG1      THR  37 -10.234  -1.354  -0.922
  279   1HG2  THR  37          1HG2      THR  37  -7.404  -1.273  -2.767
  280   2HG2  THR  37          2HG2      THR  37  -8.161  -1.816  -1.270
  281   3HG2  THR  37          3HG2      THR  37  -7.962  -0.092  -1.582
  282    HA   PRO  38           HA       PRO  38  -6.774   1.178  -6.481
  283   1HB   PRO  38          2HB       PRO  38  -4.872   2.731  -5.248
  284   2HB   PRO  38          1HB       PRO  38  -6.368   3.378  -5.945
  285   1HG   PRO  38          2HG       PRO  38  -5.655   2.971  -3.079
  286   2HG   PRO  38          1HG       PRO  38  -6.784   4.129  -3.800
  287   1HD   PRO  38          2HD       PRO  38  -7.488   1.716  -2.499
  288   2HD   PRO  38          1HD       PRO  38  -8.561   2.716  -3.501
  289    H    PHE  39           H        PHE  39  -4.525   0.486  -6.929
  290    HA   PHE  39           HA       PHE  39  -3.766  -1.897  -5.514
  291   1HB   PHE  39          2HB       PHE  39  -3.239  -1.127  -7.977
  292   2HB   PHE  39          1HB       PHE  39  -1.819  -0.390  -7.237
  293    HD1  PHE  39           HD1      PHE  39  -3.718  -3.622  -6.899
  294    HD2  PHE  39           HD2      PHE  39   0.103  -1.700  -7.296
  295    HE1  PHE  39           HE1      PHE  39  -2.600  -5.834  -6.841
  296    HE2  PHE  39           HE2      PHE  39   1.220  -3.913  -7.240
  297    HZ   PHE  39           HZ       PHE  39  -0.131  -5.979  -7.011
  298    H    THR  40           H        THR  40  -3.074   1.456  -4.945
  299    HA   THR  40           HA       THR  40  -0.545   1.252  -3.631
  300    HB   THR  40           HB       THR  40  -1.348   3.322  -2.368
  301    HG1  THR  40           HG1      THR  40  -3.347   3.988  -2.650
  302   1HG2  THR  40          1HG2      THR  40  -1.606   4.668  -4.550
  303   2HG2  THR  40          2HG2      THR  40  -1.430   3.119  -5.375
  304   3HG2  THR  40          3HG2      THR  40  -0.128   3.725  -4.353
  305    H    ALA  41           H        ALA  41  -3.883   0.920  -2.416
  306    HA   ALA  41           HA       ALA  41  -3.036   0.311   0.307
  307   1HB   ALA  41          1HB       ALA  41  -5.728  -0.487  -0.739
  308   2HB   ALA  41          2HB       ALA  41  -5.347   1.232  -0.629
  309   3HB   ALA  41          3HB       ALA  41  -5.297   0.222   0.816
  310    H    VAL  42           H        VAL  42  -3.997  -1.571  -2.561
  311    HA   VAL  42           HA       VAL  42  -4.133  -4.140  -1.299
  312    HB   VAL  42           HB       VAL  42  -3.328  -3.439  -4.146
  313   1HG1  VAL  42          1HG1      VAL  42  -3.245  -5.919  -2.782
  314   2HG1  VAL  42          2HG1      VAL  42  -3.095  -5.648  -4.518
  315   3HG1  VAL  42          3HG1      VAL  42  -4.677  -5.970  -3.809
  316   1HG2  VAL  42          1HG2      VAL  42  -5.493  -2.689  -4.132
  317   2HG2  VAL  42          2HG2      VAL  42  -5.912  -3.617  -2.693
  318   3HG2  VAL  42          3HG2      VAL  42  -5.869  -4.407  -4.269
  319    H    LEU  43           H        LEU  43  -1.432  -2.571  -3.056
  320    HA   LEU  43           HA       LEU  43   0.531  -4.578  -2.490
  321   1HB   LEU  43          2HB       LEU  43   0.662  -2.634  -4.181
  322   2HB   LEU  43          1HB       LEU  43   1.132  -1.627  -2.811
  323    HG   LEU  43           HG       LEU  43   2.635  -4.130  -2.885
  324   1HD1  LEU  43          1HD1      LEU  43   2.259  -3.818  -5.337
  325   2HD1  LEU  43          2HD1      LEU  43   3.954  -3.643  -4.882
  326   3HD1  LEU  43          3HD1      LEU  43   2.976  -2.213  -5.213
  327   1HD2  LEU  43          1HD2      LEU  43   3.036  -1.848  -1.672
  328   2HD2  LEU  43          2HD2      LEU  43   3.727  -1.339  -3.213
  329   3HD2  LEU  43          3HD2      LEU  43   4.425  -2.702  -2.341
  330    H    LYS  44           H        LYS  44  -0.573  -1.722  -0.697
  331    HA   LYS  44           HA       LYS  44   1.454  -1.645   1.307
  332   1HB   LYS  44          2HB       LYS  44  -0.364   0.088   0.866
  333   2HB   LYS  44          1HB       LYS  44  -1.469  -0.970   1.742
  334   1HG   LYS  44          2HG       LYS  44  -0.770   0.149   3.585
  335   2HG   LYS  44          1HG       LYS  44   0.686  -0.840   3.456
  336   1HD   LYS  44          2HD       LYS  44   1.281   1.118   1.671
  337   2HD   LYS  44          1HD       LYS  44   0.282   2.025   2.804
  338   1HE   LYS  44          2HE       LYS  44   1.955   0.485   4.439
  339   2HE   LYS  44          1HE       LYS  44   2.999   1.035   3.129
  340   1HZ   LYS  44          1HZ       LYS  44   1.199   2.843   4.642
  341   2HZ   LYS  44          2HZ       LYS  44   2.438   3.279   3.562
  342   3HZ   LYS  44          3HZ       LYS  44   2.821   2.579   5.061
  343    H    PHE  45           H        PHE  45  -1.763  -3.238   1.393
  344    HA   PHE  45           HA       PHE  45  -1.379  -4.513   3.933
  345   1HB   PHE  45          2HB       PHE  45  -3.539  -4.183   2.429
  346   2HB   PHE  45          1HB       PHE  45  -3.091  -5.774   1.820
  347    HD1  PHE  45           HD1      PHE  45  -3.262  -4.022   5.148
  348    HD2  PHE  45           HD2      PHE  45  -4.070  -7.584   2.891
  349    HE1  PHE  45           HE1      PHE  45  -4.258  -5.073   7.162
  350    HE2  PHE  45           HE2      PHE  45  -5.063  -8.635   4.905
  351    HZ   PHE  45           HZ       PHE  45  -5.159  -7.380   7.041
  352    H    ALA  46           H        ALA  46  -0.827  -5.664   0.595
  353    HA   ALA  46           HA       ALA  46  -0.081  -8.339   1.242
  354   1HB   ALA  46          1HB       ALA  46  -0.504  -7.821  -1.055
  355   2HB   ALA  46          2HB       ALA  46   1.214  -8.205  -0.957
  356   3HB   ALA  46          3HB       ALA  46   0.691  -6.524  -1.056
  357    H    ALA  47           H        ALA  47   1.942  -5.403   0.884
  358    HA   ALA  47           HA       ALA  47   4.443  -6.694   1.427
  359   1HB   ALA  47          1HB       ALA  47   5.196  -4.638   0.917
  360   2HB   ALA  47          2HB       ALA  47   4.480  -3.990   2.392
  361   3HB   ALA  47          3HB       ALA  47   3.537  -4.047   0.904
  362    H    GLU  48           H        GLU  48   2.083  -5.086   3.572
  363    HA   GLU  48           HA       GLU  48   3.602  -5.254   5.981
  364   1HB   GLU  48          2HB       GLU  48   0.824  -4.707   5.235
  365   2HB   GLU  48          1HB       GLU  48   0.951  -5.562   6.771
  366   1HG   GLU  48          2HG       GLU  48   1.179  -3.369   7.496
  367   2HG   GLU  48          1HG       GLU  48   2.870  -3.796   7.233
  368    H    GLU  49           H        GLU  49   1.368  -7.573   4.452
  369    HA   GLU  49           HA       GLU  49   1.500  -9.520   6.586
  370   1HB   GLU  49          2HB       GLU  49   0.763  -9.781   3.655
  371   2HB   GLU  49          1HB       GLU  49   0.607 -11.091   4.826
  372   1HG   GLU  49          2HG       GLU  49  -1.013  -9.892   6.105
  373   2HG   GLU  49          1HG       GLU  49  -0.672  -8.384   5.258
  374    H    PHE  50           H        PHE  50   3.415  -8.924   3.665
  375    HA   PHE  50           HA       PHE  50   4.991 -11.379   3.982
  376   1HB   PHE  50          2HB       PHE  50   4.923  -9.084   2.072
  377   2HB   PHE  50          1HB       PHE  50   6.433  -9.981   2.213
  378    HD1  PHE  50           HD1      PHE  50   6.208 -12.609   2.166
  379    HD2  PHE  50           HD2      PHE  50   3.248  -9.893   0.651
  380    HE1  PHE  50           HE1      PHE  50   5.263 -14.421   0.763
  381    HE2  PHE  50           HE2      PHE  50   2.302 -11.705  -0.752
  382    HZ   PHE  50           HZ       PHE  50   3.310 -13.969  -0.695
  383    H    LYS  51           H        LYS  51   4.965  -8.498   5.661
  384    HA   LYS  51           HA       LYS  51   6.440  -7.573   7.206
  385   1HB   LYS  51          2HB       LYS  51   7.171 -10.287   7.037
  386   2HB   LYS  51          1HB       LYS  51   8.686  -9.395   6.908
  387   1HG   LYS  51          2HG       LYS  51   8.645  -9.003   9.126
  388   2HG   LYS  51          1HG       LYS  51   7.115  -8.144   8.943
  389   1HD   LYS  51          2HD       LYS  51   6.381  -9.813  10.339
  390   2HD   LYS  51          1HD       LYS  51   6.191 -10.674   8.813
  391   1HE   LYS  51          2HE       LYS  51   8.826 -11.168   9.377
  392   2HE   LYS  51          1HE       LYS  51   8.132 -11.112  10.997
  393   1HZ   LYS  51          1HZ       LYS  51   7.588 -13.225  10.574
  394   2HZ   LYS  51          2HZ       LYS  51   7.753 -13.052   8.893
  395   3HZ   LYS  51          3HZ       LYS  51   6.314 -12.576   9.663
  396    H    VAL  52           H        VAL  52   6.488  -6.736   4.438
  397    HA   VAL  52           HA       VAL  52   9.296  -5.714   4.278
  398    HB   VAL  52           HB       VAL  52   8.991  -5.693   1.756
  399   1HG1  VAL  52          1HG1      VAL  52  10.318  -7.420   2.986
  400   2HG1  VAL  52          2HG1      VAL  52   9.609  -8.024   1.488
  401   3HG1  VAL  52          3HG1      VAL  52   8.877  -8.435   3.039
  402   1HG2  VAL  52          1HG2      VAL  52   6.384  -6.167   2.222
  403   2HG2  VAL  52          2HG2      VAL  52   6.932  -7.832   2.042
  404   3HG2  VAL  52          3HG2      VAL  52   7.178  -6.677   0.734
  405    HA   PRO  53           HA       PRO  53   7.338  -1.776   4.139
  406   1HB   PRO  53          2HB       PRO  53   9.263  -0.335   2.804
  407   2HB   PRO  53          1HB       PRO  53   9.373  -0.815   4.504
  408   1HG   PRO  53          2HG       PRO  53  10.784  -1.956   2.133
  409   2HG   PRO  53          1HG       PRO  53  11.302  -1.905   3.826
  410   1HD   PRO  53          2HD       PRO  53  10.236  -4.162   2.517
  411   2HD   PRO  53          1HD       PRO  53  10.377  -3.960   4.277
  412    H    ALA  54           H        ALA  54   5.630  -1.389   2.875
  413    HA   ALA  54           HA       ALA  54   5.388  -2.072   0.103
  414   1HB   ALA  54          1HB       ALA  54   3.790  -0.389   2.013
  415   2HB   ALA  54          2HB       ALA  54   3.335  -1.888   1.203
  416   3HB   ALA  54          3HB       ALA  54   3.389  -0.377   0.296
  417    H    ALA  55           H        ALA  55   6.461   0.871   1.727
  418    HA   ALA  55           HA       ALA  55   6.255   2.707  -0.434
  419   1HB   ALA  55          1HB       ALA  55   8.361   2.582   1.749
  420   2HB   ALA  55          2HB       ALA  55   6.802   3.397   1.872
  421   3HB   ALA  55          3HB       ALA  55   8.017   3.985   0.737
  422    H    THR  56           H        THR  56   8.816   0.359   0.379
  423    HA   THR  56           HA       THR  56  10.093   0.994  -2.254
  424    HB   THR  56           HB       THR  56  11.525  -0.418  -0.005
  425    HG1  THR  56           HG1      THR  56  11.374   1.361   1.083
  426   1HG2  THR  56          1HG2      THR  56  12.699  -0.491  -2.066
  427   2HG2  THR  56          2HG2      THR  56  13.450   0.821  -1.163
  428   3HG2  THR  56          3HG2      THR  56  12.297   1.183  -2.446
  429    H    SER  57           H        SER  57   7.899  -0.722  -2.242
  430    HA   SER  57           HA       SER  57   9.207  -3.322  -2.898
  431   1HB   SER  57          2HB       SER  57   7.875  -3.271  -0.653
  432   2HB   SER  57          1HB       SER  57   6.452  -3.268  -1.688
  433    HG   SER  57           HG       SER  57   7.419  -5.376  -0.987
  434    H    ALA  58           H        ALA  58   7.980  -4.594  -4.465
  435    HA   ALA  58           HA       ALA  58   5.900  -3.105  -5.987
  436   1HB   ALA  58          1HB       ALA  58   7.808  -2.500  -7.249
  437   2HB   ALA  58          2HB       ALA  58   7.157  -3.893  -8.111
  438   3HB   ALA  58          3HB       ALA  58   8.550  -4.087  -7.048
  439    H    ILE  59           H        ILE  59   4.785  -4.566  -7.576
  440    HA   ILE  59           HA       ILE  59   4.970  -7.443  -6.775
  441    HB   ILE  59           HB       ILE  59   2.546  -5.660  -6.995
  442   1HG1  ILE  59          2HG1      ILE  59   3.224  -7.856  -5.020
  443   2HG1  ILE  59          1HG1      ILE  59   3.753  -6.188  -4.808
  444   1HG2  ILE  59          1HG2      ILE  59   1.105  -7.390  -7.495
  445   2HG2  ILE  59          2HG2      ILE  59   2.163  -8.615  -6.799
  446   3HG2  ILE  59          3HG2      ILE  59   2.509  -7.954  -8.395
  447   1HD1  ILE  59          1HD1      ILE  59   1.733  -6.276  -3.596
  448   2HD1  ILE  59          2HD1      ILE  59   0.944  -7.282  -4.810
  449   3HD1  ILE  59          3HD1      ILE  59   1.249  -5.577  -5.141
  450    H    ILE  60           H        ILE  60   5.477  -8.649  -8.536
  451    HA   ILE  60           HA       ILE  60   4.894  -7.541 -11.235
  452    HB   ILE  60           HB       ILE  60   6.464  -9.268 -12.064
  453   1HG1  ILE  60          2HG1      ILE  60   7.582 -10.012  -9.488
  454   2HG1  ILE  60          1HG1      ILE  60   5.891 -10.501  -9.595
  455   1HG2  ILE  60          1HG2      ILE  60   8.071  -8.158  -9.865
  456   2HG2  ILE  60          2HG2      ILE  60   7.077  -6.960 -10.691
  457   3HG2  ILE  60          3HG2      ILE  60   8.233  -7.929 -11.605
  458   1HD1  ILE  60          1HD1      ILE  60   8.224 -11.373 -11.254
  459   2HD1  ILE  60          2HD1      ILE  60   6.634 -11.316 -12.013
  460   3HD1  ILE  60          3HD1      ILE  60   6.898 -12.331 -10.596
  461    H    THR  61           H        THR  61   4.261  -9.301 -12.910
  462    HA   THR  61           HA       THR  61   2.065 -10.930 -11.711
  463    HB   THR  61           HB       THR  61   2.440 -10.155 -14.621
  464    HG1  THR  61           HG1      THR  61   2.048  -8.258 -13.712
  465   1HG2  THR  61          1HG2      THR  61   0.868 -11.826 -14.717
  466   2HG2  THR  61          2HG2      THR  61  -0.206 -10.498 -14.281
  467   3HG2  THR  61          3HG2      THR  61   0.375 -11.605 -13.039
  468    H    ASN  62           H        ASN  62   1.676 -13.091 -12.677
  469    HA   ASN  62           HA       ASN  62   3.949 -14.773 -12.663
  470   1HB   ASN  62          2HB       ASN  62   1.361 -15.295 -12.502
  471   2HB   ASN  62          1HB       ASN  62   1.522 -15.564 -14.237
  472   1HD2  ASN  62          1HD2      ASN  62   2.557 -17.498 -14.929
  473   2HD2  ASN  62          2HD2      ASN  62   3.200 -18.647 -13.859
  474    H    ASP  63           H        ASP  63   2.539 -12.964 -15.330
  475    HA   ASP  63           HA       ASP  63   3.934 -14.477 -17.406
  476   1HB   ASP  63          2HB       ASP  63   2.533 -11.786 -17.472
  477   2HB   ASP  63          1HB       ASP  63   3.172 -12.613 -18.891
  478    H    GLY  64           H        GLY  64   4.399 -11.317 -15.798
  479   1HA   GLY  64          2HA       GLY  64   6.951 -10.999 -15.336
  480   2HA   GLY  64          1HA       GLY  64   7.083 -11.114 -17.091
  481    H    VAL  65           H        VAL  65   4.754  -9.420 -14.959
  482    HA   VAL  65           HA       VAL  65   5.490  -6.875 -16.354
  483    HB   VAL  65           HB       VAL  65   2.723  -7.662 -15.383
  484   1HG1  VAL  65          1HG1      VAL  65   2.836  -5.311 -15.338
  485   2HG1  VAL  65          2HG1      VAL  65   2.183  -5.649 -16.941
  486   3HG1  VAL  65          3HG1      VAL  65   3.889  -5.243 -16.751
  487   1HG2  VAL  65          1HG2      VAL  65   2.478  -8.765 -17.334
  488   2HG2  VAL  65          2HG2      VAL  65   4.133  -8.364 -17.794
  489   3HG2  VAL  65          3HG2      VAL  65   2.815  -7.265 -18.199
  490    H    GLY  66           H        GLY  66   6.404  -5.518 -14.904
  491   1HA   GLY  66          2HA       GLY  66   6.237  -5.928 -12.047
  492   2HA   GLY  66          1HA       GLY  66   7.027  -4.570 -12.849
  493    H    VAL  67           H        VAL  67   3.963  -5.780 -11.629
  494    HA   VAL  67           HA       VAL  67   2.392  -3.447 -12.295
  495    HB   VAL  67           HB       VAL  67   1.877  -5.364 -10.004
  496   1HG1  VAL  67          1HG1      VAL  67  -0.528  -4.768 -11.072
  497   2HG1  VAL  67          2HG1      VAL  67   0.340  -3.287 -11.474
  498   3HG1  VAL  67          3HG1      VAL  67   0.211  -3.805  -9.794
  499   1HG2  VAL  67          1HG2      VAL  67   2.143  -6.835 -11.825
  500   2HG2  VAL  67          2HG2      VAL  67   1.486  -5.673 -12.978
  501   3HG2  VAL  67          3HG2      VAL  67   0.413  -6.493 -11.842
  502    H    ASN  68           H        ASN  68   2.278  -1.515 -11.257
  503    HA   ASN  68           HA       ASN  68   3.717  -1.240  -8.646
  504   1HB   ASN  68          2HB       ASN  68   3.509   0.521 -11.063
  505   2HB   ASN  68          1HB       ASN  68   3.691   1.282  -9.484
  506   1HD2  ASN  68          1HD2      ASN  68   5.811   1.432  -8.699
  507   2HD2  ASN  68          2HD2      ASN  68   7.126   0.544  -9.301
  508    HA   PRO  69           HA       PRO  69  -0.018   0.250  -6.850
  509   1HB   PRO  69          2HB       PRO  69   0.998   2.025  -5.008
  510   2HB   PRO  69          1HB       PRO  69   1.099   0.266  -4.831
  511   1HG   PRO  69          2HG       PRO  69   3.243   2.202  -5.559
  512   2HG   PRO  69          1HG       PRO  69   3.380   0.613  -4.790
  513   1HD   PRO  69          2HD       PRO  69   3.892   1.199  -7.517
  514   2HD   PRO  69          1HD       PRO  69   3.736  -0.420  -6.802
  515    H    ALA  70           H        ALA  70  -0.095   1.417  -9.202
  516    HA   ALA  70           HA       ALA  70  -0.603   4.306  -8.656
  517   1HB   ALA  70          1HB       ALA  70   0.631   3.319 -11.234
  518   2HB   ALA  70          2HB       ALA  70   1.600   3.899  -9.880
  519   3HB   ALA  70          3HB       ALA  70   0.464   4.985 -10.681
  520    H    GLN  71           H        GLN  71  -2.142   1.575  -9.286
  521    HA   GLN  71           HA       GLN  71  -4.154   2.907 -11.026
  522   1HB   GLN  71          2HB       GLN  71  -4.462   0.742 -12.277
  523   2HB   GLN  71          1HB       GLN  71  -2.911   1.520 -12.579
  524   1HG   GLN  71          2HG       GLN  71  -2.600  -0.174 -10.300
  525   2HG   GLN  71          1HG       GLN  71  -3.406  -1.105 -11.561
  526   1HE2  GLN  71          1HE2      GLN  71  -2.200  -1.623 -13.479
  527   2HE2  GLN  71          2HE2      GLN  71  -0.556  -1.242 -13.657
  528    HA   PRO  72           HA       PRO  72  -7.052   1.164  -8.225
  529   1HB   PRO  72          2HB       PRO  72  -9.180   0.626  -9.883
  530   2HB   PRO  72          1HB       PRO  72  -8.721   2.256  -9.363
  531   1HG   PRO  72          2HG       PRO  72  -8.311   0.943 -12.012
  532   2HG   PRO  72          1HG       PRO  72  -8.492   2.662 -11.628
  533   1HD   PRO  72          2HD       PRO  72  -6.057   1.357 -12.186
  534   2HD   PRO  72          1HD       PRO  72  -6.225   2.957 -11.434
  535    H    ALA  73           H        ALA  73  -7.990  -0.821  -7.475
  536    HA   ALA  73           HA       ALA  73  -6.667  -3.230  -8.188
  537   1HB   ALA  73          1HB       ALA  73  -8.419  -4.356  -6.822
  538   2HB   ALA  73          2HB       ALA  73  -9.326  -2.844  -6.780
  539   3HB   ALA  73          3HB       ALA  73  -7.741  -2.946  -6.011
  540    H    GLY  74           H        GLY  74  -9.789  -1.912  -9.276
  541   1HA   GLY  74          2HA       GLY  74 -10.785  -4.183 -10.648
  542   2HA   GLY  74          1HA       GLY  74 -11.138  -2.513 -11.100
  543    H    ASN  75           H        ASN  75  -8.578  -1.611 -11.789
  544    HA   ASN  75           HA       ASN  75  -8.274  -2.695 -14.453
  545   1HB   ASN  75          2HB       ASN  75  -7.636  -0.316 -13.361
  546   2HB   ASN  75          1HB       ASN  75  -6.062  -1.102 -13.240
  547   1HD2  ASN  75          1HD2      ASN  75  -4.854  -1.382 -15.176
  548   2HD2  ASN  75          2HD2      ASN  75  -5.415  -0.907 -16.705
  549    H    ILE  76           H        ILE  76  -6.561  -3.164 -11.385
  550    HA   ILE  76           HA       ILE  76  -4.285  -4.573 -12.384
  551    HB   ILE  76           HB       ILE  76  -5.737  -4.811  -9.729
  552   1HG1  ILE  76          2HG1      ILE  76  -4.760  -2.566 -10.382
  553   2HG1  ILE  76          1HG1      ILE  76  -4.090  -3.256  -8.907
  554   1HG2  ILE  76          1HG2      ILE  76  -2.898  -5.472  -9.726
  555   2HG2  ILE  76          2HG2      ILE  76  -3.813  -6.557 -10.768
  556   3HG2  ILE  76          3HG2      ILE  76  -4.257  -6.381  -9.072
  557   1HD1  ILE  76          1HD1      ILE  76  -2.311  -4.289 -10.573
  558   2HD1  ILE  76          2HD1      ILE  76  -2.145  -2.626 -10.016
  559   3HD1  ILE  76          3HD1      ILE  76  -2.823  -2.958 -11.609
  560    H    PHE  77           H        PHE  77  -7.494  -5.749 -11.324
  561    HA   PHE  77           HA       PHE  77  -6.875  -8.536 -11.866
  562   1HB   PHE  77          2HB       PHE  77  -8.721  -7.504 -10.320
  563   2HB   PHE  77          1HB       PHE  77  -9.676  -7.432 -11.799
  564    HD1  PHE  77           HD1      PHE  77  -8.121  -9.632  -9.303
  565    HD2  PHE  77           HD2      PHE  77 -10.307  -9.492 -12.997
  566    HE1  PHE  77           HE1      PHE  77  -8.653 -12.044  -9.080
  567    HE2  PHE  77           HE2      PHE  77 -10.838 -11.904 -12.774
  568    HZ   PHE  77           HZ       PHE  77 -10.011 -13.180 -10.815
  569    H    LEU  78           H        LEU  78  -8.583  -5.955 -13.656
  570    HA   LEU  78           HA       LEU  78  -9.460  -7.557 -15.857
  571   1HB   LEU  78          2HB       LEU  78  -8.818  -4.614 -15.593
  572   2HB   LEU  78          1HB       LEU  78  -9.352  -5.308 -17.121
  573    HG   LEU  78           HG       LEU  78 -10.906  -5.720 -14.562
  574   1HD1  LEU  78          1HD1      LEU  78 -11.195  -3.494 -16.604
  575   2HD1  LEU  78          2HD1      LEU  78 -10.725  -3.302 -14.916
  576   3HD1  LEU  78          3HD1      LEU  78 -12.354  -3.843 -15.321
  577   1HD2  LEU  78          1HD2      LEU  78 -12.200  -5.541 -17.224
  578   2HD2  LEU  78          2HD2      LEU  78 -12.489  -6.679 -15.909
  579   3HD2  LEU  78          3HD2      LEU  78 -11.129  -6.924 -17.003
  580    H    LYS  79           H        LYS  79  -6.378  -5.871 -15.259
  581    HA   LYS  79           HA       LYS  79  -5.341  -6.678 -17.907
  582   1HB   LYS  79          2HB       LYS  79  -4.894  -4.458 -16.404
  583   2HB   LYS  79          1HB       LYS  79  -3.510  -5.441 -15.927
  584   1HG   LYS  79          2HG       LYS  79  -3.716  -5.738 -18.725
  585   2HG   LYS  79          1HG       LYS  79  -3.968  -4.023 -18.412
  586   1HD   LYS  79          2HD       LYS  79  -1.855  -4.631 -16.733
  587   2HD   LYS  79          1HD       LYS  79  -1.523  -5.625 -18.152
  588   1HE   LYS  79          2HE       LYS  79  -1.444  -3.763 -19.596
  589   2HE   LYS  79          1HE       LYS  79  -2.304  -2.730 -18.455
  590   1HZ   LYS  79          1HZ       LYS  79   0.298  -2.620 -18.751
  591   2HZ   LYS  79          2HZ       LYS  79   0.251  -3.856 -17.587
  592   3HZ   LYS  79          3HZ       LYS  79  -0.441  -2.341 -17.252
  593    H    HIS  80           H        HIS  80  -4.199  -7.071 -14.516
  594    HA   HIS  80           HA       HIS  80  -2.468  -9.300 -15.376
  595   1HB   HIS  80          2HB       HIS  80  -2.881  -8.311 -12.546
  596   2HB   HIS  80          1HB       HIS  80  -1.495  -9.185 -13.198
  597    HD1  HIS  80           HD1      HIS  80  -0.292  -7.786 -15.317
  598    HD2  HIS  80           HD2      HIS  80  -2.454  -5.585 -12.512
  599    HE1  HIS  80           HE1      HIS  80   0.455  -5.378 -15.565
  600    H    GLY  81           H        GLY  81  -5.021  -8.913 -12.867
  601   1HA   GLY  81          2HA       GLY  81  -6.873 -10.591 -12.840
  602   2HA   GLY  81          1HA       GLY  81  -5.673 -11.809 -13.274
  603    H    SER  82           H        SER  82  -5.344 -13.115 -11.542
  604    HA   SER  82           HA       SER  82  -5.167 -11.850  -8.833
  605   1HB   SER  82          2HB       SER  82  -6.964 -13.714  -9.499
  606   2HB   SER  82          1HB       SER  82  -5.617 -14.789  -9.133
  607    HG   SER  82           HG       SER  82  -6.497 -14.483  -7.191
  608    H    GLU  83           H        GLU  83  -3.741 -14.338 -10.967
  609    HA   GLU  83           HA       GLU  83  -1.667 -15.204  -9.221
  610   1HB   GLU  83          2HB       GLU  83  -2.165 -15.276 -12.151
  611   2HB   GLU  83          1HB       GLU  83  -0.488 -15.473 -11.645
  612   1HG   GLU  83          2HG       GLU  83  -2.613 -17.036 -10.219
  613   2HG   GLU  83          1HG       GLU  83  -2.087 -17.575 -11.814
  614    H    LEU  84           H        LEU  84  -0.408 -13.709  -8.194
  615    HA   LEU  84           HA       LEU  84   1.192 -11.862  -9.900
  616   1HB   LEU  84          2HB       LEU  84  -0.433 -11.134  -7.457
  617   2HB   LEU  84          1HB       LEU  84   0.921 -10.146  -8.004
  618    HG   LEU  84           HG       LEU  84  -1.081 -10.941 -10.064
  619   1HD1  LEU  84          1HD1      LEU  84  -2.240  -8.662  -9.221
  620   2HD1  LEU  84          2HD1      LEU  84  -1.693  -9.288  -7.666
  621   3HD1  LEU  84          3HD1      LEU  84  -2.771 -10.253  -8.675
  622   1HD2  LEU  84          1HD2      LEU  84   0.354  -8.342  -9.426
  623   2HD2  LEU  84          2HD2      LEU  84  -0.570  -8.684 -10.888
  624   3HD2  LEU  84          3HD2      LEU  84   0.927  -9.559 -10.566
  625    H    ARG  85           H        ARG  85   3.068 -10.932  -8.565
  626    HA   ARG  85           HA       ARG  85   4.018 -12.865  -6.491
  627   1HB   ARG  85          2HB       ARG  85   5.284 -12.091  -9.087
  628   2HB   ARG  85          1HB       ARG  85   6.343 -12.325  -7.700
  629   1HG   ARG  85          2HG       ARG  85   6.266 -14.531  -8.180
  630   2HG   ARG  85          1HG       ARG  85   4.609 -14.500  -7.574
  631   1HD   ARG  85          2HD       ARG  85   3.831 -13.883  -9.872
  632   2HD   ARG  85          1HD       ARG  85   5.487 -14.077 -10.445
  633    HE   ARG  85           HE       ARG  85   5.091 -16.392 -10.475
  634   1HH1  ARG  85          2HH1      ARG  85   2.107 -15.399  -9.906
  635   2HH1  ARG  85          1HH1      ARG  85   1.661 -16.577  -8.719
  636   1HH2  ARG  85          1HH2      ARG  85   4.916 -17.683  -8.204
  637   2HH2  ARG  85          2HH2      ARG  85   3.254 -17.873  -7.752
  638    H    LEU  86           H        LEU  86   5.441 -11.932  -4.920
  639    HA   LEU  86           HA       LEU  86   5.404  -8.945  -4.880
  640   1HB   LEU  86          2HB       LEU  86   4.409 -10.405  -2.955
  641   2HB   LEU  86          1HB       LEU  86   6.092 -10.660  -2.502
  642    HG   LEU  86           HG       LEU  86   5.746  -7.877  -3.057
  643   1HD1  LEU  86          1HD1      LEU  86   3.709  -9.045  -1.136
  644   2HD1  LEU  86          2HD1      LEU  86   3.358  -8.189  -2.636
  645   3HD1  LEU  86          3HD1      LEU  86   4.087  -7.329  -1.281
  646   1HD2  LEU  86          1HD2      LEU  86   6.171  -7.876  -0.459
  647   2HD2  LEU  86          2HD2      LEU  86   7.429  -8.464  -1.546
  648   3HD2  LEU  86          3HD2      LEU  86   6.400  -9.610  -0.689
  649    H    ILE  87           H        ILE  87   7.282  -7.980  -5.385
  650    HA   ILE  87           HA       ILE  87   9.835  -9.404  -4.749
  651    HB   ILE  87           HB       ILE  87   9.537  -9.378  -7.162
  652   1HG1  ILE  87          2HG1      ILE  87  11.427  -7.088  -6.629
  653   2HG1  ILE  87          1HG1      ILE  87  11.789  -8.707  -6.033
  654   1HG2  ILE  87          1HG2      ILE  87   8.345  -6.814  -6.633
  655   2HG2  ILE  87          2HG2      ILE  87   8.333  -7.745  -8.128
  656   3HG2  ILE  87          3HG2      ILE  87   9.646  -6.614  -7.805
  657   1HD1  ILE  87          1HD1      ILE  87  11.425  -9.549  -8.398
  658   2HD1  ILE  87          2HD1      ILE  87  12.836  -8.512  -8.187
  659   3HD1  ILE  87          3HD1      ILE  87  11.363  -7.862  -8.908
  660    HA   PRO  88           HA       PRO  88  10.485  -5.753  -2.310
  661   1HB   PRO  88          2HB       PRO  88  13.006  -6.448  -1.453
  662   2HB   PRO  88          1HB       PRO  88  11.514  -7.114  -0.764
  663   1HG   PRO  88          2HG       PRO  88  13.467  -8.399  -2.619
  664   2HG   PRO  88          1HG       PRO  88  12.390  -9.149  -1.428
  665   1HD   PRO  88          2HD       PRO  88  11.947  -9.064  -4.212
  666   2HD   PRO  88          1HD       PRO  88  10.730  -9.458  -2.981
  667    H    ARG  89           H        ARG  89  11.078  -3.808  -3.158
  668    HA   ARG  89           HA       ARG  89  13.088  -3.684  -5.317
  669   1HB   ARG  89          2HB       ARG  89  10.733  -2.294  -4.804
  670   2HB   ARG  89          1HB       ARG  89  11.992  -1.130  -4.389
  671   1HG   ARG  89          2HG       ARG  89  12.782  -1.002  -6.546
  672   2HG   ARG  89          1HG       ARG  89  12.361  -2.676  -6.913
  673   1HD   ARG  89          2HD       ARG  89  10.757  -1.544  -8.159
  674   2HD   ARG  89          1HD       ARG  89   9.886  -1.790  -6.646
  675    HE   ARG  89           HE       ARG  89  11.181   0.784  -7.446
  676   1HH1  ARG  89          2HH1      ARG  89   8.193   0.513  -7.469
  677   2HH1  ARG  89          1HH1      ARG  89   7.752   1.166  -5.926
  678   1HH2  ARG  89          1HH2      ARG  89  10.963   0.940  -4.615
  679   2HH2  ARG  89          2HH2      ARG  89   9.323   1.408  -4.308
  680    H    ASP  90           H        ASP  90  15.016  -2.464  -5.169
  681    HA   ASP  90           HA       ASP  90  15.735  -1.476  -2.441
  682   1HB   ASP  90          2HB       ASP  90  17.058  -3.533  -4.103
  683   2HB   ASP  90          1HB       ASP  90  18.148  -2.307  -3.454
  684    H    ARG  91           H        ARG  91  14.760   0.347  -4.045
  685    HA   ARG  91           HA       ARG  91  17.010   1.611  -5.544
  686   1HB   ARG  91          2HB       ARG  91  14.094   1.525  -5.874
  687   2HB   ARG  91          1HB       ARG  91  14.742   3.163  -5.971
  688   1HG   ARG  91          2HG       ARG  91  15.518   2.757  -8.041
  689   2HG   ARG  91          1HG       ARG  91  16.477   1.404  -7.435
  690   1HD   ARG  91          2HD       ARG  91  13.899   0.383  -7.443
  691   2HD   ARG  91          1HD       ARG  91  13.938   1.377  -8.901
  692    HE   ARG  91           HE       ARG  91  15.843   0.021  -9.683
  693   1HH1  ARG  91          1HH2      ARG  91  16.942  -1.090  -7.195
  694   2HH1  ARG  91          2HH2      ARG  91  16.299  -2.698  -7.155
  695   1HH2  ARG  91          2HH1      ARG  91  13.818  -2.056  -9.496
  696   2HH2  ARG  91          1HH1      ARG  91  14.531  -3.244  -8.458
  697    H    VAL  92           H        VAL  92  14.307   2.620  -3.405
  698    HA   VAL  92           HA       VAL  92  15.725   5.058  -2.625
  699    HB   VAL  92           HB       VAL  92  13.201   3.828  -1.460
  700   1HG1  VAL  92          1HG1      VAL  92  12.829   6.338  -0.926
  701   2HG1  VAL  92          2HG1      VAL  92  14.564   6.506  -1.191
  702   3HG1  VAL  92          3HG1      VAL  92  13.965   5.444   0.083
  703   1HG2  VAL  92          1HG2      VAL  92  12.820   4.246  -3.803
  704   2HG2  VAL  92          2HG2      VAL  92  13.653   5.796  -3.721
  705   3HG2  VAL  92          3HG2      VAL  92  12.094   5.591  -2.924
  706    H    GLY  93           H        GLY  93  14.573   2.193  -0.784
  707   1HA   GLY  93          2HA       GLY  93  17.040   2.305   0.857
  708   2HA   GLY  93          1HA       GLY  93  15.501   2.448   1.704
  709    H    HIS  94           HN       HIS  94  14.683   0.565   2.446
  710    HA   HIS  94           HA       HIS  94  14.081  -1.697   2.558
  711   1HB   HIS  94          2HB       HIS  94  13.921  -1.345  -0.046
  712   2HB   HIS  94          1HB       HIS  94  15.417  -2.278  -0.071
  713    HD1  HIS  94           HD1      HIS  94  15.302  -4.743   0.867
  714    HD2  HIS  94           HD2      HIS  94  11.606  -2.835   0.570
  715    HE1  HIS  94           HE1      HIS  94  13.541  -6.549   1.101
  Start of MODEL   16
    1   1H    MET   1          1H        MET   1   0.918 -24.805 -10.495
    2   2H    MET   1          2H        MET   1   2.194 -23.799 -10.994
    3   3H    MET   1          3H        MET   1   0.631 -23.570 -11.621
    4    HA   MET   1           HA       MET   1   1.196 -21.901  -9.937
    5   1HB   MET   1          2HB       MET   1  -1.155 -23.472 -10.139
    6   2HB   MET   1          1HB       MET   1  -0.847 -23.265  -8.414
    7   1HG   MET   1          2HG       MET   1  -0.653 -20.820  -8.742
    8   2HG   MET   1          1HG       MET   1  -0.952 -21.034 -10.468
    9   1HE   MET   1          1HE       MET   1  -2.654 -21.554 -11.549
   10   2HE   MET   1          2HE       MET   1  -4.337 -21.278 -11.115
   11   3HE   MET   1          3HE       MET   1  -3.638 -22.879 -10.914
   12    H    SER   2           H        SER   2   1.663 -21.441  -7.752
   13    HA   SER   2           HA       SER   2   2.545 -23.728  -6.051
   14   1HB   SER   2          2HB       SER   2   4.180 -21.630  -7.271
   15   2HB   SER   2          1HB       SER   2   4.364 -21.695  -5.521
   16    HG   SER   2           HG       SER   2   5.769 -23.177  -6.270
   17    H    GLY   3           H        GLY   3   3.076 -22.772  -3.754
   18   1HA   GLY   3          2HA       GLY   3   2.483 -21.426  -1.905
   19   2HA   GLY   3          1HA       GLY   3   1.613 -20.350  -2.999
   20    H    GLY   4           H        GLY   4  -0.593 -20.678  -3.321
   21   1HA   GLY   4          2HA       GLY   4  -1.851 -23.087  -2.105
   22   2HA   GLY   4          1HA       GLY   4  -2.400 -21.496  -1.578
   23    H    THR   5           H        THR   5  -4.307 -21.042  -2.543
   24    HA   THR   5           HA       THR   5  -4.639 -21.773  -5.427
   25    HB   THR   5           HB       THR   5  -7.116 -21.647  -4.939
   26    HG1  THR   5           HG1      THR   5  -7.319 -20.567  -3.097
   27   1HG2  THR   5          1HG2      THR   5  -6.983 -23.803  -3.406
   28   2HG2  THR   5          2HG2      THR   5  -5.257 -23.662  -3.740
   29   3HG2  THR   5          3HG2      THR   5  -6.400 -23.844  -5.069
   30    H    ALA   6           H        ALA   6  -5.266 -20.163  -6.840
   31    HA   ALA   6           HA       ALA   6  -5.079 -17.390  -5.832
   32   1HB   ALA   6          1HB       ALA   6  -3.873 -18.192  -7.918
   33   2HB   ALA   6          2HB       ALA   6  -4.867 -16.751  -8.142
   34   3HB   ALA   6          3HB       ALA   6  -5.454 -18.321  -8.691
   35    H    ALA   7           H        ALA   7  -6.883 -16.207  -5.413
   36    HA   ALA   7           HA       ALA   7  -9.523 -17.338  -6.076
   37   1HB   ALA   7          1HB       ALA   7  -8.813 -16.203  -3.838
   38   2HB   ALA   7          2HB       ALA   7 -10.407 -15.841  -4.499
   39   3HB   ALA   7          3HB       ALA   7  -9.086 -14.693  -4.706
   40    H    THR   8           H        THR   8 -10.278 -16.930  -8.090
   41    HA   THR   8           HA       THR   8  -9.657 -14.318  -9.379
   42    HB   THR   8           HB       THR   8 -10.914 -16.814 -10.573
   43    HG1  THR   8           HG1      THR   8  -8.955 -17.485 -10.846
   44   1HG2  THR   8          1HG2      THR   8 -11.482 -14.761 -11.788
   45   2HG2  THR   8          2HG2      THR   8 -10.336 -15.721 -12.723
   46   3HG2  THR   8          3HG2      THR   8  -9.780 -14.302 -11.837
   47    H    THR   9           H        THR   9 -11.158 -12.922  -8.405
   48    HA   THR   9           HA       THR   9 -14.040 -13.593  -8.875
   49    HB   THR   9           HB       THR   9 -14.512 -12.123  -6.867
   50    HG1  THR   9           HG1      THR   9 -12.886 -11.132  -6.025
   51   1HG2  THR   9          1HG2      THR   9 -13.950 -13.866  -5.237
   52   2HG2  THR   9          2HG2      THR   9 -12.793 -14.569  -6.366
   53   3HG2  THR   9          3HG2      THR   9 -14.516 -14.595  -6.740
   54    H    ALA  10           H        ALA  10 -15.177 -12.104 -10.039
   55    HA   ALA  10           HA       ALA  10 -14.111  -9.337 -10.298
   56   1HB   ALA  10          1HB       ALA  10 -14.547  -9.464 -12.784
   57   2HB   ALA  10          2HB       ALA  10 -14.744 -11.206 -12.598
   58   3HB   ALA  10          3HB       ALA  10 -13.193 -10.451 -12.234
   59    H    GLY  11           H        GLY  11 -15.729  -7.787 -10.595
   60   1HA   GLY  11          2HA       GLY  11 -18.089  -7.395 -11.489
   61   2HA   GLY  11          1HA       GLY  11 -18.542  -8.813 -10.542
   62    H    SER  12           H        SER  12 -18.172  -8.666  -8.160
   63    HA   SER  12           HA       SER  12 -18.964  -5.992  -7.188
   64   1HB   SER  12          2HB       SER  12 -19.235  -7.213  -4.990
   65   2HB   SER  12          1HB       SER  12 -20.237  -7.838  -6.296
   66    HG   SER  12           HG       SER  12 -19.083  -9.461  -5.074
   67    H    LYS  13           H        LYS  13 -16.434  -8.414  -6.391
   68    HA   LYS  13           HA       LYS  13 -14.630  -6.150  -5.672
   69   1HB   LYS  13          2HB       LYS  13 -14.954  -8.674  -4.019
   70   2HB   LYS  13          1HB       LYS  13 -13.850  -7.342  -3.683
   71   1HG   LYS  13          2HG       LYS  13 -15.761  -5.810  -3.416
   72   2HG   LYS  13          1HG       LYS  13 -16.875  -7.133  -3.764
   73   1HD   LYS  13          2HD       LYS  13 -16.868  -7.617  -1.562
   74   2HD   LYS  13          1HD       LYS  13 -15.186  -8.115  -1.743
   75   1HE   LYS  13          2HE       LYS  13 -14.929  -5.388  -1.621
   76   2HE   LYS  13          1HE       LYS  13 -16.301  -5.657  -0.547
   77   1HZ   LYS  13          1HZ       LYS  13 -13.547  -6.236  -0.128
   78   2HZ   LYS  13          2HZ       LYS  13 -14.493  -7.631   0.082
   79   3HZ   LYS  13          3HZ       LYS  13 -14.825  -6.233   0.987
   80    H    VAL  14           H        VAL  14 -12.371  -6.668  -5.886
   81    HA   VAL  14           HA       VAL  14 -11.858  -9.056  -7.615
   82    HB   VAL  14           HB       VAL  14  -9.792  -7.684  -8.330
   83   1HG1  VAL  14          1HG1      VAL  14 -11.419  -7.901  -9.985
   84   2HG1  VAL  14          2HG1      VAL  14 -11.374  -6.151  -9.773
   85   3HG1  VAL  14          3HG1      VAL  14 -12.655  -7.099  -9.018
   86   1HG2  VAL  14          1HG2      VAL  14 -10.079  -6.028  -6.419
   87   2HG2  VAL  14          2HG2      VAL  14 -11.479  -5.393  -7.282
   88   3HG2  VAL  14          3HG2      VAL  14  -9.877  -5.300  -8.013
   89    H    THR  15           H        THR  15 -10.660 -10.617  -6.675
   90    HA   THR  15           HA       THR  15  -9.053  -9.929  -4.256
   91    HB   THR  15           HB       THR  15  -9.963 -12.643  -5.275
   92    HG1  THR  15           HG1      THR  15 -11.687 -12.329  -4.121
   93   1HG2  THR  15          1HG2      THR  15  -8.676 -11.792  -2.664
   94   2HG2  THR  15          2HG2      THR  15  -7.918 -12.764  -3.924
   95   3HG2  THR  15          3HG2      THR  15  -9.285 -13.408  -3.017
   96    H    PHE  16           H        PHE  16  -6.844 -10.162  -4.271
   97    HA   PHE  16           HA       PHE  16  -5.604 -11.288  -6.756
   98   1HB   PHE  16          2HB       PHE  16  -4.383  -9.191  -4.947
   99   2HB   PHE  16          1HB       PHE  16  -3.814  -9.698  -6.534
  100    HD1  PHE  16           HD1      PHE  16  -6.134  -7.567  -4.708
  101    HD2  PHE  16           HD2      PHE  16  -5.173  -9.167  -8.577
  102    HE1  PHE  16           HE1      PHE  16  -7.556  -5.839  -5.777
  103    HE2  PHE  16           HE2      PHE  16  -6.596  -7.439  -9.644
  104    HZ   PHE  16           HZ       PHE  16  -7.786  -5.776  -8.244
  105    H    LYS  17           H        LYS  17  -4.198 -12.944  -6.467
  106    HA   LYS  17           HA       LYS  17  -3.447 -13.678  -3.672
  107   1HB   LYS  17          2HB       LYS  17  -4.709 -15.353  -5.107
  108   2HB   LYS  17          1HB       LYS  17  -3.289 -15.422  -6.150
  109   1HG   LYS  17          2HG       LYS  17  -2.809 -15.768  -3.231
  110   2HG   LYS  17          1HG       LYS  17  -3.632 -17.090  -4.058
  111   1HD   LYS  17          2HD       LYS  17  -1.628 -16.515  -5.836
  112   2HD   LYS  17          1HD       LYS  17  -0.835 -16.172  -4.298
  113   1HE   LYS  17          2HE       LYS  17  -0.577 -18.379  -3.935
  114   2HE   LYS  17          1HE       LYS  17  -2.325 -18.595  -3.996
  115   1HZ   LYS  17          1HZ       LYS  17  -0.926 -18.282  -6.542
  116   2HZ   LYS  17          2HZ       LYS  17  -2.270 -19.245  -6.150
  117   3HZ   LYS  17          3HZ       LYS  17  -0.707 -19.748  -5.716
  118    H    ILE  18           H        ILE  18  -1.552 -12.551  -3.313
  119    HA   ILE  18           HA       ILE  18   0.560 -12.560  -5.399
  120    HB   ILE  18           HB       ILE  18   0.567 -11.194  -2.689
  121   1HG1  ILE  18          2HG1      ILE  18   0.249  -9.260  -4.672
  122   2HG1  ILE  18          1HG1      ILE  18  -0.833 -10.557  -5.182
  123   1HG2  ILE  18          1HG2      ILE  18   2.247  -9.725  -3.940
  124   2HG2  ILE  18          2HG2      ILE  18   2.270 -10.977  -5.180
  125   3HG2  ILE  18          3HG2      ILE  18   2.792 -11.353  -3.538
  126   1HD1  ILE  18          1HD1      ILE  18  -1.151  -8.676  -3.004
  127   2HD1  ILE  18          2HD1      ILE  18  -1.187 -10.330  -2.394
  128   3HD1  ILE  18          3HD1      ILE  18  -2.318  -9.830  -3.651
  129    H    THR  19           H        THR  19   2.547 -13.597  -5.110
  130    HA   THR  19           HA       THR  19   2.757 -15.374  -2.707
  131    HB   THR  19           HB       THR  19   4.156 -16.857  -4.211
  132    HG1  THR  19           HG1      THR  19   4.627 -16.088  -6.086
  133   1HG2  THR  19          1HG2      THR  19   2.015 -17.704  -3.901
  134   2HG2  THR  19          2HG2      THR  19   2.042 -17.498  -5.652
  135   3HG2  THR  19          3HG2      THR  19   1.241 -16.300  -4.636
  136    H    LEU  20           H        LEU  20   4.604 -15.207  -1.498
  137    HA   LEU  20           HA       LEU  20   6.515 -13.078  -2.184
  138   1HB   LEU  20          2HB       LEU  20   5.598 -13.479   0.146
  139   2HB   LEU  20          1HB       LEU  20   6.578 -14.940   0.203
  140    HG   LEU  20           HG       LEU  20   8.606 -13.559  -0.231
  141   1HD1  LEU  20          1HD1      LEU  20   7.869 -11.640  -1.364
  142   2HD1  LEU  20          2HD1      LEU  20   8.174 -11.022   0.258
  143   3HD1  LEU  20          3HD1      LEU  20   6.525 -11.383  -0.251
  144   1HD2  LEU  20          1HD2      LEU  20   7.908 -12.081   2.059
  145   2HD2  LEU  20          2HD2      LEU  20   8.687 -13.663   2.022
  146   3HD2  LEU  20          3HD2      LEU  20   6.932 -13.547   2.142
  147    H    THR  21           H        THR  21   8.251 -13.518  -3.431
  148    HA   THR  21           HA       THR  21   9.385 -16.283  -3.376
  149    HB   THR  21           HB       THR  21   8.502 -15.480  -5.577
  150    HG1  THR  21           HG1      THR  21   9.993 -16.753  -6.267
  151   1HG2  THR  21          1HG2      THR  21  10.856 -13.641  -5.793
  152   2HG2  THR  21          2HG2      THR  21   9.400 -13.055  -4.989
  153   3HG2  THR  21          3HG2      THR  21   9.322 -13.603  -6.662
  154    H    SER  22           H        SER  22  10.037 -13.074  -2.395
  155    HA   SER  22           HA       SER  22  12.956 -13.258  -2.673
  156   1HB   SER  22          2HB       SER  22  11.000 -11.205  -1.859
  157   2HB   SER  22          1HB       SER  22  12.500 -11.174  -0.938
  158    HG   SER  22           HG       SER  22  13.112 -10.075  -2.652
  159    H    ASP  23           H        ASP  23  10.711 -13.018   0.127
  160    HA   ASP  23           HA       ASP  23  12.833 -14.174   1.860
  161   1HB   ASP  23          2HB       ASP  23  10.203 -12.795   2.441
  162   2HB   ASP  23          1HB       ASP  23  11.132 -13.611   3.697
  163    HA   PRO  24           HA       PRO  24  10.866 -18.107   2.021
  164   1HB   PRO  24          2HB       PRO  24  11.843 -18.951   4.451
  165   2HB   PRO  24          1HB       PRO  24  12.810 -18.902   2.967
  166   1HG   PRO  24          2HG       PRO  24  12.888 -17.072   5.320
  167   2HG   PRO  24          1HG       PRO  24  14.171 -17.469   4.163
  168   1HD   PRO  24          2HD       PRO  24  12.623 -15.104   4.163
  169   2HD   PRO  24          1HD       PRO  24  13.652 -15.675   2.834
  170    H    LYS  25           H        LYS  25  10.463 -15.858   4.729
  171    HA   LYS  25           HA       LYS  25   8.395 -17.301   6.117
  172   1HB   LYS  25          2HB       LYS  25   9.884 -15.054   6.633
  173   2HB   LYS  25          1HB       LYS  25   8.307 -14.354   6.271
  174   1HG   LYS  25          2HG       LYS  25   7.280 -15.372   8.079
  175   2HG   LYS  25          1HG       LYS  25   8.409 -16.729   8.088
  176   1HD   LYS  25          2HD       LYS  25   9.802 -14.231   8.581
  177   2HD   LYS  25          1HD       LYS  25   8.492 -14.460   9.745
  178   1HE   LYS  25          2HE       LYS  25  10.200 -15.638  10.792
  179   2HE   LYS  25          1HE       LYS  25   9.453 -16.924   9.849
  180   1HZ   LYS  25          1HZ       LYS  25  11.121 -16.849   8.260
  181   2HZ   LYS  25          2HZ       LYS  25  11.977 -16.643   9.710
  182   3HZ   LYS  25          3HZ       LYS  25  11.650 -15.305   8.724
  183    H    LEU  26           H        LEU  26   6.224 -17.415   5.712
  184    HA   LEU  26           HA       LEU  26   4.147 -17.086   4.690
  185   1HB   LEU  26          2HB       LEU  26   5.328 -14.445   4.843
  186   2HB   LEU  26          1HB       LEU  26   4.391 -14.605   3.362
  187    HG   LEU  26           HG       LEU  26   2.992 -13.783   5.227
  188   1HD1  LEU  26          1HD1      LEU  26   1.958 -16.543   4.896
  189   2HD1  LEU  26          2HD1      LEU  26   2.325 -15.679   3.403
  190   3HD1  LEU  26          3HD1      LEU  26   1.179 -14.997   4.558
  191   1HD2  LEU  26          1HD2      LEU  26   3.527 -16.479   6.510
  192   2HD2  LEU  26          2HD2      LEU  26   2.560 -15.161   7.169
  193   3HD2  LEU  26          3HD2      LEU  26   4.307 -14.980   7.015
  194    HA   PRO  27           HA       PRO  27   5.627 -18.471   0.663
  195   1HB   PRO  27          2HB       PRO  27   3.525 -20.204   0.273
  196   2HB   PRO  27          1HB       PRO  27   4.976 -20.608   1.207
  197   1HG   PRO  27          2HG       PRO  27   2.236 -19.945   2.186
  198   2HG   PRO  27          1HG       PRO  27   3.485 -20.947   2.942
  199   1HD   PRO  27          2HD       PRO  27   2.855 -18.294   3.665
  200   2HD   PRO  27          1HD       PRO  27   4.327 -19.173   4.129
  201    H    PHE  28           H        PHE  28   2.165 -17.763   1.340
  202    HA   PHE  28           HA       PHE  28   2.116 -15.932  -0.973
  203   1HB   PHE  28          2HB       PHE  28   0.189 -17.011  -2.033
  204   2HB   PHE  28          1HB       PHE  28   1.535 -18.144  -1.945
  205    HD1  PHE  28           HD1      PHE  28   1.547 -19.948  -0.213
  206    HD2  PHE  28           HD2      PHE  28  -1.849 -17.386  -0.811
  207    HE1  PHE  28           HE1      PHE  28   0.125 -21.538   1.048
  208    HE2  PHE  28           HE2      PHE  28  -3.270 -18.977   0.451
  209    HZ   PHE  28           HZ       PHE  28  -2.284 -21.053   1.381
  210    H    LYS  29           H        LYS  29   0.033 -14.699  -1.053
  211    HA   LYS  29           HA       LYS  29  -1.531 -14.709   1.470
  212   1HB   LYS  29          2HB       LYS  29   0.537 -13.078   1.491
  213   2HB   LYS  29          1HB       LYS  29  -0.482 -12.082   0.453
  214   1HG   LYS  29          2HG       LYS  29  -1.172 -11.283   2.502
  215   2HG   LYS  29          1HG       LYS  29  -2.293 -12.637   2.342
  216   1HD   LYS  29          2HD       LYS  29  -0.154 -13.911   3.430
  217   2HD   LYS  29          1HD       LYS  29   0.029 -12.314   4.156
  218   1HE   LYS  29          2HE       LYS  29  -2.351 -12.414   4.892
  219   2HE   LYS  29          1HE       LYS  29  -2.456 -14.052   4.246
  220   1HZ   LYS  29          1HZ       LYS  29  -0.325 -13.360   6.157
  221   2HZ   LYS  29          2HZ       LYS  29  -1.039 -14.871   5.842
  222   3HZ   LYS  29          3HZ       LYS  29  -1.888 -13.694   6.725
  223    H    VAL  30           H        VAL  30  -3.662 -14.346   1.036
  224    HA   VAL  30           HA       VAL  30  -4.386 -13.421  -1.709
  225    HB   VAL  30           HB       VAL  30  -6.135 -14.806   0.350
  226   1HG1  VAL  30          1HG1      VAL  30  -7.818 -14.662  -1.162
  227   2HG1  VAL  30          2HG1      VAL  30  -6.753 -15.051  -2.513
  228   3HG1  VAL  30          3HG1      VAL  30  -6.851 -13.395  -1.916
  229   1HG2  VAL  30          1HG2      VAL  30  -4.558 -15.925  -1.991
  230   2HG2  VAL  30          2HG2      VAL  30  -5.790 -16.823  -1.105
  231   3HG2  VAL  30          3HG2      VAL  30  -4.320 -16.302  -0.284
  232    H    LEU  31           H        LEU  31  -5.134 -11.371  -1.900
  233    HA   LEU  31           HA       LEU  31  -6.267 -10.041   0.531
  234   1HB   LEU  31          2HB       LEU  31  -4.226  -9.223  -1.351
  235   2HB   LEU  31          1HB       LEU  31  -5.564  -8.075  -1.369
  236    HG   LEU  31           HG       LEU  31  -4.866  -8.914   1.345
  237   1HD1  LEU  31          1HD1      LEU  31  -2.754  -7.374   1.227
  238   2HD1  LEU  31          2HD1      LEU  31  -2.752  -7.795  -0.485
  239   3HD1  LEU  31          3HD1      LEU  31  -2.605  -9.061   0.733
  240   1HD2  LEU  31          1HD2      LEU  31  -4.512  -6.217   1.215
  241   2HD2  LEU  31          2HD2      LEU  31  -6.093  -6.979   1.383
  242   3HD2  LEU  31          3HD2      LEU  31  -5.526  -6.470  -0.207
  243    H    SER  32           H        SER  32  -8.441  -9.863   0.376
  244    HA   SER  32           HA       SER  32  -9.690  -9.649  -2.323
  245   1HB   SER  32          2HB       SER  32 -11.823 -10.141  -1.046
  246   2HB   SER  32          1HB       SER  32 -10.632 -11.436  -1.011
  247    HG   SER  32           HG       SER  32 -11.659 -10.740   1.055
  248    H    VAL  33           H        VAL  33 -10.158  -7.624  -2.981
  249    HA   VAL  33           HA       VAL  33 -11.281  -5.684  -1.022
  250    HB   VAL  33           HB       VAL  33  -9.825  -3.881  -2.058
  251   1HG1  VAL  33          1HG1      VAL  33  -9.367  -4.956   0.166
  252   2HG1  VAL  33          2HG1      VAL  33  -7.915  -4.370  -0.647
  253   3HG1  VAL  33          3HG1      VAL  33  -8.296  -6.092  -0.656
  254   1HG2  VAL  33          1HG2      VAL  33  -9.245  -5.456  -4.041
  255   2HG2  VAL  33          2HG2      VAL  33  -8.049  -6.154  -2.950
  256   3HG2  VAL  33          3HG2      VAL  33  -7.956  -4.448  -3.388
  257    HA   PRO  34           HA       PRO  34 -13.954  -4.705  -4.374
  258   1HB   PRO  34          2HB       PRO  34 -14.527  -2.074  -3.803
  259   2HB   PRO  34          1HB       PRO  34 -15.201  -3.446  -2.905
  260   1HG   PRO  34          2HG       PRO  34 -13.046  -1.547  -2.095
  261   2HG   PRO  34          1HG       PRO  34 -14.177  -2.457  -1.083
  262   1HD   PRO  34          2HD       PRO  34 -11.476  -3.129  -1.529
  263   2HD   PRO  34          1HD       PRO  34 -12.712  -4.208  -0.849
  264    H    GLU  35           H        GLU  35 -14.134  -3.364  -6.343
  265    HA   GLU  35           HA       GLU  35 -11.651  -2.834  -7.628
  266   1HB   GLU  35          2HB       GLU  35 -14.516  -2.183  -8.243
  267   2HB   GLU  35          1HB       GLU  35 -13.241  -1.452  -9.218
  268   1HG   GLU  35          2HG       GLU  35 -13.404  -3.379 -10.428
  269   2HG   GLU  35          1HG       GLU  35 -12.384  -4.037  -9.148
  270    H    SER  36           H        SER  36 -13.738  -0.746  -5.705
  271    HA   SER  36           HA       SER  36 -12.700   1.791  -6.498
  272   1HB   SER  36          2HB       SER  36 -14.371   0.745  -4.368
  273   2HB   SER  36          1HB       SER  36 -13.266   1.968  -3.747
  274    HG   SER  36           HG       SER  36 -15.227   2.845  -4.589
  275    H    THR  37           H        THR  37 -11.561  -0.556  -4.063
  276    HA   THR  37           HA       THR  37  -9.510   1.087  -2.926
  277    HB   THR  37           HB       THR  37  -9.746  -1.928  -3.184
  278    HG1  THR  37           HG1      THR  37 -11.234  -0.591  -1.853
  279   1HG2  THR  37          1HG2      THR  37  -7.758  -0.239  -1.642
  280   2HG2  THR  37          2HG2      THR  37  -7.399  -1.422  -2.899
  281   3HG2  THR  37          3HG2      THR  37  -8.028  -1.956  -1.341
  282    HA   PRO  38           HA       PRO  38  -6.815   1.122  -6.470
  283   1HB   PRO  38          2HB       PRO  38  -4.885   2.690  -5.298
  284   2HB   PRO  38          1HB       PRO  38  -6.399   3.328  -5.962
  285   1HG   PRO  38          2HG       PRO  38  -5.614   2.948  -3.111
  286   2HG   PRO  38          1HG       PRO  38  -6.763   4.097  -3.814
  287   1HD   PRO  38          2HD       PRO  38  -7.426   1.692  -2.474
  288   2HD   PRO  38          1HD       PRO  38  -8.528   2.683  -3.454
  289    H    PHE  39           H        PHE  39  -4.588   0.414  -6.975
  290    HA   PHE  39           HA       PHE  39  -3.788  -1.955  -5.572
  291   1HB   PHE  39          2HB       PHE  39  -3.276  -1.132  -8.037
  292   2HB   PHE  39          1HB       PHE  39  -1.834  -0.453  -7.282
  293    HD1  PHE  39           HD1      PHE  39  -3.826  -3.639  -7.053
  294    HD2  PHE  39           HD2      PHE  39   0.054  -1.816  -7.342
  295    HE1  PHE  39           HE1      PHE  39  -2.772  -5.883  -7.051
  296    HE2  PHE  39           HE2      PHE  39   1.107  -4.061  -7.341
  297    HZ   PHE  39           HZ       PHE  39  -0.306  -6.093  -7.196
  298    H    THR  40           H        THR  40  -3.104   1.398  -5.002
  299    HA   THR  40           HA       THR  40  -0.565   1.226  -3.721
  300    HB   THR  40           HB       THR  40  -1.377   3.258  -2.419
  301    HG1  THR  40           HG1      THR  40  -3.415   3.728  -2.475
  302   1HG2  THR  40          1HG2      THR  40  -1.373   3.006  -5.395
  303   2HG2  THR  40          2HG2      THR  40  -0.276   3.901  -4.343
  304   3HG2  THR  40          3HG2      THR  40  -1.884   4.538  -4.689
  305    H    ALA  41           H        ALA  41  -3.868   0.896  -2.400
  306    HA   ALA  41           HA       ALA  41  -2.946   0.232   0.276
  307   1HB   ALA  41          1HB       ALA  41  -5.091   0.952   0.523
  308   2HB   ALA  41          2HB       ALA  41  -5.515  -0.720   0.156
  309   3HB   ALA  41          3HB       ALA  41  -5.533   0.496  -1.122
  310    H    VAL  42           H        VAL  42  -4.040  -1.637  -2.560
  311    HA   VAL  42           HA       VAL  42  -4.116  -4.207  -1.315
  312    HB   VAL  42           HB       VAL  42  -3.398  -3.494  -4.182
  313   1HG1  VAL  42          1HG1      VAL  42  -2.732  -5.742  -3.907
  314   2HG1  VAL  42          2HG1      VAL  42  -4.381  -5.876  -4.516
  315   3HG1  VAL  42          3HG1      VAL  42  -4.056  -6.094  -2.797
  316   1HG2  VAL  42          1HG2      VAL  42  -5.971  -3.848  -2.682
  317   2HG2  VAL  42          2HG2      VAL  42  -5.899  -4.365  -4.366
  318   3HG2  VAL  42          3HG2      VAL  42  -5.565  -2.686  -3.944
  319    H    LEU  43           H        LEU  43  -1.465  -2.630  -3.138
  320    HA   LEU  43           HA       LEU  43   0.482  -4.680  -2.617
  321   1HB   LEU  43          2HB       LEU  43   0.648  -2.951  -4.434
  322   2HB   LEU  43          1HB       LEU  43   0.980  -1.741  -3.195
  323    HG   LEU  43           HG       LEU  43   2.676  -4.106  -2.908
  324   1HD1  LEU  43          1HD1      LEU  43   4.012  -2.968  -5.017
  325   2HD1  LEU  43          2HD1      LEU  43   2.342  -2.889  -5.577
  326   3HD1  LEU  43          3HD1      LEU  43   3.050  -4.440  -5.128
  327   1HD2  LEU  43          1HD2      LEU  43   3.283  -2.146  -1.728
  328   2HD2  LEU  43          2HD2      LEU  43   3.021  -1.114  -3.133
  329   3HD2  LEU  43          3HD2      LEU  43   4.416  -2.191  -3.078
  330    H    LYS  44           H        LYS  44  -0.454  -1.729  -0.872
  331    HA   LYS  44           HA       LYS  44   1.707  -1.654   0.998
  332   1HB   LYS  44          2HB       LYS  44  -0.366  -0.013   0.544
  333   2HB   LYS  44          1HB       LYS  44  -1.032  -0.891   1.918
  334   1HG   LYS  44          2HG       LYS  44   1.381  -0.428   2.937
  335   2HG   LYS  44          1HG       LYS  44   1.352   0.911   1.791
  336   1HD   LYS  44          2HD       LYS  44   0.326   1.967   3.552
  337   2HD   LYS  44          1HD       LYS  44  -1.103   1.214   2.841
  338   1HE   LYS  44          2HE       LYS  44  -0.993  -0.632   4.388
  339   2HE   LYS  44          1HE       LYS  44   0.585  -0.113   4.977
  340   1HZ   LYS  44          1HZ       LYS  44  -1.434   1.925   5.177
  341   2HZ   LYS  44          2HZ       LYS  44  -0.335   1.364   6.345
  342   3HZ   LYS  44          3HZ       LYS  44  -1.797   0.539   6.085
  343    H    PHE  45           H        PHE  45  -1.530  -3.152   1.263
  344    HA   PHE  45           HA       PHE  45  -1.075  -4.331   3.842
  345   1HB   PHE  45          2HB       PHE  45  -3.107  -4.586   1.683
  346   2HB   PHE  45          1HB       PHE  45  -2.983  -5.936   2.810
  347    HD1  PHE  45           HD1      PHE  45  -4.050  -2.495   2.352
  348    HD2  PHE  45           HD2      PHE  45  -3.195  -5.516   5.283
  349    HE1  PHE  45           HE1      PHE  45  -5.288  -1.190   4.059
  350    HE2  PHE  45           HE2      PHE  45  -4.433  -4.210   6.989
  351    HZ   PHE  45           HZ       PHE  45  -5.479  -2.047   6.377
  352    H    ALA  46           H        ALA  46  -0.699  -5.628   0.527
  353    HA   ALA  46           HA       ALA  46  -0.054  -8.305   1.310
  354   1HB   ALA  46          1HB       ALA  46   1.383  -7.577  -1.071
  355   2HB   ALA  46          2HB       ALA  46  -0.218  -6.843  -1.119
  356   3HB   ALA  46          3HB       ALA  46  -0.054  -8.587  -0.920
  357    H    ALA  47           H        ALA  47   2.041  -5.475   0.684
  358    HA   ALA  47           HA       ALA  47   4.531  -6.838   1.100
  359   1HB   ALA  47          1HB       ALA  47   4.836  -4.779   0.078
  360   2HB   ALA  47          2HB       ALA  47   5.239  -4.364   1.743
  361   3HB   ALA  47          3HB       ALA  47   3.644  -3.976   1.098
  362    H    GLU  48           H        GLU  48   2.502  -4.908   3.335
  363    HA   GLU  48           HA       GLU  48   4.211  -5.244   5.620
  364   1HB   GLU  48          2HB       GLU  48   1.507  -4.211   5.082
  365   2HB   GLU  48          1HB       GLU  48   1.690  -4.922   6.685
  366   1HG   GLU  48          2HG       GLU  48   2.325  -2.658   6.979
  367   2HG   GLU  48          1HG       GLU  48   3.854  -3.528   6.859
  368    H    GLU  49           H        GLU  49   1.433  -7.117   4.407
  369    HA   GLU  49           HA       GLU  49   1.314  -8.928   6.653
  370   1HB   GLU  49          2HB       GLU  49   0.216  -8.932   3.856
  371   2HB   GLU  49          1HB       GLU  49   0.134 -10.404   4.823
  372   1HG   GLU  49          2HG       GLU  49  -1.122  -9.290   6.554
  373   2HG   GLU  49          1HG       GLU  49  -0.870  -7.717   5.798
  374    H    PHE  50           H        PHE  50   3.272  -8.830   3.728
  375    HA   PHE  50           HA       PHE  50   4.149 -11.615   4.010
  376   1HB   PHE  50          2HB       PHE  50   4.583  -9.391   2.080
  377   2HB   PHE  50          1HB       PHE  50   5.906 -10.544   2.240
  378    HD1  PHE  50           HD1      PHE  50   3.308  -9.890   0.180
  379    HD2  PHE  50           HD2      PHE  50   4.696 -13.095   2.676
  380    HE1  PHE  50           HE1      PHE  50   2.068 -11.517  -1.220
  381    HE2  PHE  50           HE2      PHE  50   3.454 -14.724   1.277
  382    HZ   PHE  50           HZ       PHE  50   2.142 -13.934  -0.671
  383    H    LYS  51           H        LYS  51   6.329  -8.841   3.584
  384    HA   LYS  51           HA       LYS  51   7.431  -8.699   6.187
  385   1HB   LYS  51          2HB       LYS  51   8.073 -11.158   4.991
  386   2HB   LYS  51          1HB       LYS  51   9.529 -10.180   4.812
  387   1HG   LYS  51          2HG       LYS  51   8.374  -9.815   7.449
  388   2HG   LYS  51          1HG       LYS  51   8.677 -11.523   7.133
  389   1HD   LYS  51          2HD       LYS  51  10.917 -10.055   6.147
  390   2HD   LYS  51          1HD       LYS  51  10.577  -9.480   7.781
  391   1HE   LYS  51          2HE       LYS  51  10.949 -11.564   8.739
  392   2HE   LYS  51          1HE       LYS  51  10.547 -12.433   7.259
  393   1HZ   LYS  51          1HZ       LYS  51  12.847 -10.681   7.068
  394   2HZ   LYS  51          2HZ       LYS  51  12.632 -12.266   6.493
  395   3HZ   LYS  51          3HZ       LYS  51  13.042 -11.996   8.119
  396    H    VAL  52           H        VAL  52   6.928  -7.002   3.869
  397    HA   VAL  52           HA       VAL  52   9.627  -5.773   3.651
  398    HB   VAL  52           HB       VAL  52   9.051  -5.270   1.187
  399   1HG1  VAL  52          1HG1      VAL  52  10.779  -6.917   2.046
  400   2HG1  VAL  52          2HG1      VAL  52  10.125  -7.288   0.451
  401   3HG1  VAL  52          3HG1      VAL  52   9.559  -8.177   1.864
  402   1HG2  VAL  52          1HG2      VAL  52   7.522  -6.774   0.084
  403   2HG2  VAL  52          2HG2      VAL  52   6.660  -6.066   1.449
  404   3HG2  VAL  52          3HG2      VAL  52   7.290  -7.710   1.561
  405    HA   PRO  53           HA       PRO  53   7.381  -2.045   4.275
  406   1HB   PRO  53          2HB       PRO  53   9.104  -0.265   3.082
  407   2HB   PRO  53          1HB       PRO  53   9.410  -1.023   4.654
  408   1HG   PRO  53          2HG       PRO  53  10.653  -1.619   2.009
  409   2HG   PRO  53          1HG       PRO  53  11.316  -1.842   3.636
  410   1HD   PRO  53          2HD       PRO  53  10.238  -3.879   2.000
  411   2HD   PRO  53          1HD       PRO  53  10.576  -4.010   3.740
  412    H    ALA  54           H        ALA  54   5.687  -1.089   3.212
  413    HA   ALA  54           HA       ALA  54   5.099  -1.622   0.460
  414   1HB   ALA  54          1HB       ALA  54   3.254  -1.191   1.901
  415   2HB   ALA  54          2HB       ALA  54   3.333   0.205   0.825
  416   3HB   ALA  54          3HB       ALA  54   3.956   0.322   2.471
  417    H    ALA  55           H        ALA  55   6.722   1.084   2.048
  418    HA   ALA  55           HA       ALA  55   6.585   3.005  -0.043
  419   1HB   ALA  55          1HB       ALA  55   7.745   4.186   1.477
  420   2HB   ALA  55          2HB       ALA  55   9.152   3.154   1.226
  421   3HB   ALA  55          3HB       ALA  55   7.950   2.726   2.443
  422    H    THR  56           H        THR  56   8.872   0.324   0.483
  423    HA   THR  56           HA       THR  56   9.950   0.836  -2.264
  424    HB   THR  56           HB       THR  56  11.838  -0.774  -1.041
  425    HG1  THR  56           HG1      THR  56  11.128   1.210   0.850
  426   1HG2  THR  56          1HG2      THR  56  11.791   2.255  -1.081
  427   2HG2  THR  56          2HG2      THR  56  12.206   1.235  -2.458
  428   3HG2  THR  56          3HG2      THR  56  13.227   1.233  -1.021
  429    H    SER  57           H        SER  57   7.622  -0.609  -2.073
  430    HA   SER  57           HA       SER  57   8.544  -3.427  -2.495
  431   1HB   SER  57          2HB       SER  57   6.437  -2.384  -0.821
  432   2HB   SER  57          1HB       SER  57   5.755  -3.440  -2.051
  433    HG   SER  57           HG       SER  57   7.508  -3.993   0.038
  434    H    ALA  58           H        ALA  58   7.258  -4.628  -4.091
  435    HA   ALA  58           HA       ALA  58   5.605  -3.131  -5.996
  436   1HB   ALA  58          1HB       ALA  58   8.309  -4.235  -6.827
  437   2HB   ALA  58          2HB       ALA  58   7.857  -2.532  -6.779
  438   3HB   ALA  58          3HB       ALA  58   7.085  -3.617  -7.935
  439    H    ILE  59           H        ILE  59   4.532  -4.586  -7.507
  440    HA   ILE  59           HA       ILE  59   4.825  -7.477  -6.782
  441    HB   ILE  59           HB       ILE  59   2.370  -5.773  -7.142
  442   1HG1  ILE  59          2HG1      ILE  59   2.881  -8.053  -5.223
  443   2HG1  ILE  59          1HG1      ILE  59   3.477  -6.425  -4.899
  444   1HG2  ILE  59          1HG2      ILE  59   1.053  -7.917  -7.270
  445   2HG2  ILE  59          2HG2      ILE  59   2.567  -8.771  -7.561
  446   3HG2  ILE  59          3HG2      ILE  59   1.992  -7.572  -8.721
  447   1HD1  ILE  59          1HD1      ILE  59   1.157  -7.065  -3.941
  448   2HD1  ILE  59          2HD1      ILE  59   0.583  -6.907  -5.601
  449   3HD1  ILE  59          3HD1      ILE  59   1.298  -5.520  -4.780
  450    H    ILE  60           H        ILE  60   5.464  -8.685  -8.497
  451    HA   ILE  60           HA       ILE  60   5.082  -7.582 -11.235
  452    HB   ILE  60           HB       ILE  60   6.763  -9.248 -11.934
  453   1HG1  ILE  60          2HG1      ILE  60   7.591 -10.012  -9.234
  454   2HG1  ILE  60          1HG1      ILE  60   5.975 -10.599  -9.623
  455   1HG2  ILE  60          1HG2      ILE  60   7.920  -7.335 -11.402
  456   2HG2  ILE  60          2HG2      ILE  60   8.590  -8.395 -10.163
  457   3HG2  ILE  60          3HG2      ILE  60   7.286  -7.280  -9.758
  458   1HD1  ILE  60          1HD1      ILE  60   7.744 -12.212 -10.302
  459   2HD1  ILE  60          2HD1      ILE  60   8.422 -10.987 -11.371
  460   3HD1  ILE  60          3HD1      ILE  60   6.811 -11.631 -11.680
  461    H    THR  61           H        THR  61   4.668  -9.365 -12.961
  462    HA   THR  61           HA       THR  61   2.410 -11.059 -11.980
  463    HB   THR  61           HB       THR  61   1.678 -11.082 -14.360
  464    HG1  THR  61           HG1      THR  61   2.910 -10.279 -15.860
  465   1HG2  THR  61          1HG2      THR  61   2.043  -8.556 -12.808
  466   2HG2  THR  61          2HG2      THR  61   0.558  -9.396 -13.254
  467   3HG2  THR  61          3HG2      THR  61   1.422  -8.437 -14.454
  468    H    ASN  62           H        ASN  62   2.117 -13.082 -13.514
  469    HA   ASN  62           HA       ASN  62   4.439 -14.767 -13.150
  470   1HB   ASN  62          2HB       ASN  62   1.756 -15.135 -14.480
  471   2HB   ASN  62          1HB       ASN  62   3.001 -16.380 -14.594
  472   1HD2  ASN  62          1HD2      ASN  62   3.712 -17.417 -12.554
  473   2HD2  ASN  62          2HD2      ASN  62   2.737 -17.340 -11.166
  474    H    ASP  63           H        ASP  63   3.275 -12.805 -15.809
  475    HA   ASP  63           HA       ASP  63   4.882 -14.159 -17.847
  476   1HB   ASP  63          2HB       ASP  63   3.406 -11.509 -17.821
  477   2HB   ASP  63          1HB       ASP  63   4.273 -12.126 -19.226
  478    H    GLY  64           H        GLY  64   5.142 -11.176 -15.914
  479   1HA   GLY  64          2HA       GLY  64   7.598 -10.830 -15.167
  480   2HA   GLY  64          1HA       GLY  64   7.944 -10.840 -16.896
  481    H    VAL  65           H        VAL  65   5.268  -9.322 -15.066
  482    HA   VAL  65           HA       VAL  65   6.129  -6.688 -16.202
  483    HB   VAL  65           HB       VAL  65   3.306  -7.622 -15.573
  484   1HG1  VAL  65          1HG1      VAL  65   3.440  -5.250 -15.251
  485   2HG1  VAL  65          2HG1      VAL  65   2.746  -5.491 -16.855
  486   3HG1  VAL  65          3HG1      VAL  65   4.444  -5.047 -16.687
  487   1HG2  VAL  65          1HG2      VAL  65   4.958  -8.097 -17.846
  488   2HG2  VAL  65          2HG2      VAL  65   3.758  -6.897 -18.319
  489   3HG2  VAL  65          3HG2      VAL  65   3.240  -8.452 -17.668
  490    H    GLY  66           H        GLY  66   6.888  -5.410 -14.606
  491   1HA   GLY  66          2HA       GLY  66   6.399  -5.950 -11.799
  492   2HA   GLY  66          1HA       GLY  66   7.313  -4.590 -12.445
  493    H    VAL  67           H        VAL  67   4.083  -5.754 -11.694
  494    HA   VAL  67           HA       VAL  67   2.634  -3.381 -12.420
  495    HB   VAL  67           HB       VAL  67   1.928  -5.367 -10.233
  496   1HG1  VAL  67          1HG1      VAL  67  -0.237  -4.541 -10.347
  497   2HG1  VAL  67          2HG1      VAL  67  -0.042  -3.963 -12.002
  498   3HG1  VAL  67          3HG1      VAL  67   0.677  -3.067 -10.665
  499   1HG2  VAL  67          1HG2      VAL  67   1.576  -5.463 -13.235
  500   2HG2  VAL  67          2HG2      VAL  67   0.559  -6.405 -12.144
  501   3HG2  VAL  67          3HG2      VAL  67   2.299  -6.681 -12.185
  502    H    ASN  68           H        ASN  68   2.591  -1.432 -11.423
  503    HA   ASN  68           HA       ASN  68   3.853  -1.191  -8.730
  504   1HB   ASN  68          2HB       ASN  68   3.548   0.657 -11.076
  505   2HB   ASN  68          1HB       ASN  68   3.735   1.344  -9.463
  506   1HD2  ASN  68          1HD2      ASN  68   5.903   1.859  -9.114
  507   2HD2  ASN  68          2HD2      ASN  68   7.222   0.912  -9.610
  508    HA   PRO  69           HA       PRO  69   0.043   0.021  -6.893
  509   1HB   PRO  69          2HB       PRO  69   0.964   1.783  -4.987
  510   2HB   PRO  69          1HB       PRO  69   1.153   0.025  -4.870
  511   1HG   PRO  69          2HG       PRO  69   3.197   2.092  -5.531
  512   2HG   PRO  69          1HG       PRO  69   3.415   0.488  -4.810
  513   1HD   PRO  69          2HD       PRO  69   3.905   1.178  -7.513
  514   2HD   PRO  69          1HD       PRO  69   3.814  -0.468  -6.853
  515    H    ALA  70           H        ALA  70  -0.131   1.244  -9.176
  516    HA   ALA  70           HA       ALA  70  -0.668   4.125  -8.574
  517   1HB   ALA  70          1HB       ALA  70   0.124   4.753 -10.772
  518   2HB   ALA  70          2HB       ALA  70   0.360   3.063 -11.219
  519   3HB   ALA  70          3HB       ALA  70   1.386   3.803  -9.990
  520    H    GLN  71           H        GLN  71  -1.747   1.162 -10.112
  521    HA   GLN  71           HA       GLN  71  -4.065   2.556 -11.346
  522   1HB   GLN  71          2HB       GLN  71  -3.056  -0.296 -11.568
  523   2HB   GLN  71          1HB       GLN  71  -4.500   0.308 -12.378
  524   1HG   GLN  71          2HG       GLN  71  -3.276   1.272 -14.008
  525   2HG   GLN  71          1HG       GLN  71  -2.229   2.068 -12.831
  526   1HE2  GLN  71          1HE2      GLN  71  -0.276   0.914 -12.131
  527   2HE2  GLN  71          2HE2      GLN  71   0.313  -0.420 -12.999
  528    HA   PRO  72           HA       PRO  72  -6.885   1.116  -8.276
  529   1HB   PRO  72          2HB       PRO  72  -9.130   0.708  -9.810
  530   2HB   PRO  72          1HB       PRO  72  -8.527   2.314  -9.364
  531   1HG   PRO  72          2HG       PRO  72  -8.365   0.910 -11.991
  532   2HG   PRO  72          1HG       PRO  72  -8.383   2.648 -11.646
  533   1HD   PRO  72          2HD       PRO  72  -6.096   1.116 -12.286
  534   2HD   PRO  72          1HD       PRO  72  -6.093   2.755 -11.604
  535    H    ALA  73           H        ALA  73  -7.974  -0.815  -7.485
  536    HA   ALA  73           HA       ALA  73  -6.822  -3.302  -8.178
  537   1HB   ALA  73          1HB       ALA  73  -9.553  -2.892  -6.926
  538   2HB   ALA  73          2HB       ALA  73  -8.031  -2.811  -6.039
  539   3HB   ALA  73          3HB       ALA  73  -8.535  -4.324  -6.788
  540    H    GLY  74           H        GLY  74  -9.865  -1.831  -9.316
  541   1HA   GLY  74          2HA       GLY  74 -10.893  -4.053 -10.754
  542   2HA   GLY  74          1HA       GLY  74 -11.224  -2.369 -11.151
  543    H    ASN  75           H        ASN  75  -8.706  -1.437 -11.855
  544    HA   ASN  75           HA       ASN  75  -8.409  -2.482 -14.532
  545   1HB   ASN  75          2HB       ASN  75  -7.906  -0.104 -13.747
  546   2HB   ASN  75          1HB       ASN  75  -6.410  -0.743 -13.067
  547   1HD2  ASN  75          1HD2      ASN  75  -8.202  -0.438 -16.167
  548   2HD2  ASN  75          2HD2      ASN  75  -6.821  -0.520 -17.150
  549    H    ILE  76           H        ILE  76  -6.543  -2.886 -11.526
  550    HA   ILE  76           HA       ILE  76  -4.314  -4.297 -12.608
  551    HB   ILE  76           HB       ILE  76  -5.647  -4.507  -9.888
  552   1HG1  ILE  76          2HG1      ILE  76  -4.754  -2.265 -10.508
  553   2HG1  ILE  76          1HG1      ILE  76  -3.868  -2.986  -9.169
  554   1HG2  ILE  76          1HG2      ILE  76  -2.781  -5.192 -10.185
  555   2HG2  ILE  76          2HG2      ILE  76  -3.905  -6.355 -10.884
  556   3HG2  ILE  76          3HG2      ILE  76  -4.020  -5.936  -9.176
  557   1HD1  ILE  76          1HD1      ILE  76  -2.278  -3.897 -11.038
  558   2HD1  ILE  76          2HD1      ILE  76  -2.143  -2.208 -10.554
  559   3HD1  ILE  76          3HD1      ILE  76  -3.006  -2.635 -12.031
  560    H    PHE  77           H        PHE  77  -7.472  -5.464 -11.446
  561    HA   PHE  77           HA       PHE  77  -6.887  -8.269 -11.891
  562   1HB   PHE  77          2HB       PHE  77  -8.691  -7.185 -10.367
  563   2HB   PHE  77          1HB       PHE  77  -9.655  -7.071 -11.838
  564    HD1  PHE  77           HD1      PHE  77 -10.236  -9.157 -13.115
  565    HD2  PHE  77           HD2      PHE  77  -8.357  -9.282  -9.253
  566    HE1  PHE  77           HE1      PHE  77 -10.896 -11.535 -12.870
  567    HE2  PHE  77           HE2      PHE  77  -9.017 -11.660  -9.011
  568    HZ   PHE  77           HZ       PHE  77 -10.287 -12.785 -10.817
  569    H    LEU  78           H        LEU  78  -8.432  -5.709 -13.813
  570    HA   LEU  78           HA       LEU  78  -9.370  -7.452 -15.922
  571   1HB   LEU  78          2HB       LEU  78  -8.898  -4.473 -15.740
  572   2HB   LEU  78          1HB       LEU  78  -9.472  -5.240 -17.221
  573    HG   LEU  78           HG       LEU  78 -10.839  -5.684 -14.564
  574   1HD1  LEU  78          1HD1      LEU  78 -11.696  -3.666 -16.645
  575   2HD1  LEU  78          2HD1      LEU  78 -10.714  -3.220 -15.250
  576   3HD1  LEU  78          3HD1      LEU  78 -12.332  -3.882 -15.014
  577   1HD2  LEU  78          1HD2      LEU  78 -11.609  -6.030 -17.476
  578   2HD2  LEU  78          2HD2      LEU  78 -12.770  -6.138 -16.153
  579   3HD2  LEU  78          3HD2      LEU  78 -11.442  -7.292 -16.255
  580    H    LYS  79           H        LYS  79  -6.360  -5.626 -15.419
  581    HA   LYS  79           HA       LYS  79  -5.369  -6.315 -18.104
  582   1HB   LYS  79          2HB       LYS  79  -4.583  -4.502 -15.931
  583   2HB   LYS  79          1HB       LYS  79  -3.213  -5.311 -16.692
  584   1HG   LYS  79          2HG       LYS  79  -4.849  -4.587 -18.836
  585   2HG   LYS  79          1HG       LYS  79  -4.926  -3.201 -17.748
  586   1HD   LYS  79          2HD       LYS  79  -2.366  -4.519 -18.711
  587   2HD   LYS  79          1HD       LYS  79  -3.032  -3.015 -19.351
  588   1HE   LYS  79          2HE       LYS  79  -2.574  -1.823 -17.391
  589   2HE   LYS  79          1HE       LYS  79  -2.542  -3.278 -16.395
  590   1HZ   LYS  79          1HZ       LYS  79  -0.428  -2.040 -17.903
  591   2HZ   LYS  79          2HZ       LYS  79  -0.545  -3.714 -18.168
  592   3HZ   LYS  79          3HZ       LYS  79  -0.340  -3.113 -16.593
  593    H    HIS  80           H        HIS  80  -4.326  -7.016 -14.738
  594    HA   HIS  80           HA       HIS  80  -2.622  -9.208 -15.783
  595   1HB   HIS  80          2HB       HIS  80  -2.872  -8.184 -12.942
  596   2HB   HIS  80          1HB       HIS  80  -1.610  -9.238 -13.579
  597    HD1  HIS  80           HD1      HIS  80  -0.339  -8.063 -15.810
  598    HD2  HIS  80           HD2      HIS  80  -2.090  -5.539 -12.990
  599    HE1  HIS  80           HE1      HIS  80   0.691  -5.776 -16.157
  600    H    GLY  81           H        GLY  81  -4.811  -8.925 -12.937
  601   1HA   GLY  81          2HA       GLY  81  -6.794 -10.618 -13.160
  602   2HA   GLY  81          1HA       GLY  81  -5.499 -11.801 -13.340
  603    H    SER  82           H        SER  82  -5.057 -12.860 -11.473
  604    HA   SER  82           HA       SER  82  -5.248 -11.331  -8.907
  605   1HB   SER  82          2HB       SER  82  -6.039 -13.479  -7.849
  606   2HB   SER  82          1HB       SER  82  -7.182 -12.773  -8.989
  607    HG   SER  82           HG       SER  82  -6.913 -15.004  -9.355
  608    H    GLU  83           H        GLU  83  -3.884 -14.305 -10.398
  609    HA   GLU  83           HA       GLU  83  -1.957 -14.825  -8.369
  610   1HB   GLU  83          2HB       GLU  83  -2.617 -15.891 -10.927
  611   2HB   GLU  83          1HB       GLU  83  -0.883 -15.568 -10.925
  612   1HG   GLU  83          2HG       GLU  83  -2.198 -16.960  -8.596
  613   2HG   GLU  83          1HG       GLU  83  -1.689 -17.864 -10.021
  614    H    LEU  84           H        LEU  84  -0.416 -13.434  -7.703
  615    HA   LEU  84           HA       LEU  84   1.235 -12.028  -9.750
  616   1HB   LEU  84          2HB       LEU  84  -0.083 -10.771  -7.326
  617   2HB   LEU  84          1HB       LEU  84   1.215 -10.001  -8.236
  618    HG   LEU  84           HG       LEU  84  -1.187 -11.008  -9.723
  619   1HD1  LEU  84          1HD1      LEU  84  -2.275  -8.796  -9.369
  620   2HD1  LEU  84          2HD1      LEU  84  -1.038  -8.403  -8.176
  621   3HD1  LEU  84          3HD1      LEU  84  -2.160  -9.729  -7.878
  622   1HD2  LEU  84          1HD2      LEU  84   0.411  -8.472 -10.114
  623   2HD2  LEU  84          2HD2      LEU  84  -0.556  -9.349 -11.300
  624   3HD2  LEU  84          3HD2      LEU  84   0.975 -10.020 -10.739
  625    H    ARG  85           H        ARG  85   3.250 -11.059  -8.623
  626    HA   ARG  85           HA       ARG  85   4.161 -12.883  -6.424
  627   1HB   ARG  85          2HB       ARG  85   5.234 -12.530  -9.057
  628   2HB   ARG  85          1HB       ARG  85   6.398 -11.887  -7.899
  629   1HG   ARG  85          2HG       ARG  85   6.831 -13.936  -6.993
  630   2HG   ARG  85          1HG       ARG  85   5.156 -14.467  -7.145
  631   1HD   ARG  85          2HD       ARG  85   6.570 -14.062  -9.711
  632   2HD   ARG  85          1HD       ARG  85   7.190 -15.382  -8.720
  633    HE   ARG  85           HE       ARG  85   5.292 -16.577  -9.410
  634   1HH1  ARG  85          2HH1      ARG  85   4.704 -13.872 -11.035
  635   2HH1  ARG  85          1HH1      ARG  85   3.009 -13.743 -10.706
  636   1HH2  ARG  85          1HH2      ARG  85   3.045 -16.134  -8.187
  637   2HH2  ARG  85          2HH2      ARG  85   2.069 -15.026  -9.091
  638    H    LEU  86           H        LEU  86   5.433 -11.910  -4.784
  639    HA   LEU  86           HA       LEU  86   5.321  -8.932  -4.756
  640   1HB   LEU  86          2HB       LEU  86   4.350 -10.485  -2.872
  641   2HB   LEU  86          1HB       LEU  86   6.033 -10.588  -2.354
  642    HG   LEU  86           HG       LEU  86   5.701  -7.881  -2.846
  643   1HD1  LEU  86          1HD1      LEU  86   3.640  -7.286  -1.581
  644   2HD1  LEU  86          2HD1      LEU  86   3.199  -8.992  -1.540
  645   3HD1  LEU  86          3HD1      LEU  86   3.280  -8.139  -3.081
  646   1HD2  LEU  86          1HD2      LEU  86   5.251  -9.280  -0.195
  647   2HD2  LEU  86          2HD2      LEU  86   5.882  -7.653  -0.444
  648   3HD2  LEU  86          3HD2      LEU  86   6.839  -9.053  -0.927
  649    H    ILE  87           H        ILE  87   7.154  -7.739  -4.755
  650    HA   ILE  87           HA       ILE  87   9.759  -8.955  -4.059
  651    HB   ILE  87           HB       ILE  87   9.609  -9.437  -6.441
  652   1HG1  ILE  87          2HG1      ILE  87  11.298  -6.934  -6.180
  653   2HG1  ILE  87          1HG1      ILE  87  11.761  -8.469  -5.448
  654   1HG2  ILE  87          1HG2      ILE  87   9.052  -6.478  -6.816
  655   2HG2  ILE  87          2HG2      ILE  87   7.845  -7.756  -6.951
  656   3HG2  ILE  87          3HG2      ILE  87   9.185  -7.685  -8.094
  657   1HD1  ILE  87          1HD1      ILE  87  11.005  -8.991  -8.153
  658   2HD1  ILE  87          2HD1      ILE  87  12.599  -9.157  -7.415
  659   3HD1  ILE  87          3HD1      ILE  87  12.125  -7.629  -8.155
  660    HA   PRO  88           HA       PRO  88  10.093  -4.852  -2.415
  661   1HB   PRO  88          2HB       PRO  88  12.716  -5.052  -1.592
  662   2HB   PRO  88          1HB       PRO  88  11.346  -5.745  -0.708
  663   1HG   PRO  88          2HG       PRO  88  13.384  -7.124  -2.397
  664   2HG   PRO  88          1HG       PRO  88  12.453  -7.749  -1.026
  665   1HD   PRO  88          2HD       PRO  88  11.907  -8.268  -3.740
  666   2HD   PRO  88          1HD       PRO  88  10.787  -8.544  -2.391
  667    H    ARG  89           H        ARG  89   9.974  -3.586  -4.315
  668    HA   ARG  89           HA       ARG  89  10.742  -2.136  -5.971
  669   1HB   ARG  89          2HB       ARG  89  12.851  -2.246  -3.972
  670   2HB   ARG  89          1HB       ARG  89  13.520  -1.981  -5.582
  671   1HG   ARG  89          2HG       ARG  89  11.163  -0.401  -4.538
  672   2HG   ARG  89          1HG       ARG  89  12.831   0.120  -4.293
  673   1HD   ARG  89          2HD       ARG  89  13.063   0.776  -6.450
  674   2HD   ARG  89          1HD       ARG  89  12.248  -0.660  -7.067
  675    HE   ARG  89           HE       ARG  89  10.955   1.899  -6.371
  676   1HH1  ARG  89          2HH1      ARG  89  10.546   0.356  -8.940
  677   2HH1  ARG  89          1HH1      ARG  89   8.973  -0.324  -8.692
  678   1HH2  ARG  89          1HH2      ARG  89   8.975   0.251  -5.269
  679   2HH2  ARG  89          2HH2      ARG  89   8.083  -0.382  -6.611
  680    H    ASP  90           H        ASP  90  10.321  -3.621  -7.661
  681    HA   ASP  90           HA       ASP  90  12.477  -5.454  -8.508
  682   1HB   ASP  90          2HB       ASP  90  10.882  -6.497  -9.869
  683   2HB   ASP  90          1HB       ASP  90   9.912  -5.944  -8.509
  684    H    ARG  91           H        ARG  91  13.314  -5.408 -10.703
  685    HA   ARG  91           HA       ARG  91  13.601  -2.629 -11.716
  686   1HB   ARG  91          2HB       ARG  91  15.384  -4.847 -11.429
  687   2HB   ARG  91          1HB       ARG  91  15.235  -4.498 -13.152
  688   1HG   ARG  91          2HG       ARG  91  15.631  -2.232 -11.216
  689   2HG   ARG  91          1HG       ARG  91  17.018  -3.201 -11.715
  690   1HD   ARG  91          2HD       ARG  91  17.042  -1.590 -13.382
  691   2HD   ARG  91          1HD       ARG  91  15.996  -2.793 -14.138
  692    HE   ARG  91           HE       ARG  91  14.093  -1.343 -13.037
  693   1HH1  ARG  91          2HH1      ARG  91  15.125  -0.518 -15.760
  694   2HH1  ARG  91          1HH1      ARG  91  15.413   1.172 -15.522
  695   1HH2  ARG  91          1HH2      ARG  91  15.323   0.966 -12.054
  696   2HH2  ARG  91          2HH2      ARG  91  15.527   2.017 -13.416
  697    H    VAL  92           H        VAL  92  11.917  -2.206 -13.121
  698    HA   VAL  92           HA       VAL  92  11.722  -3.942 -15.513
  699    HB   VAL  92           HB       VAL  92   9.956  -4.779 -14.024
  700   1HG1  VAL  92          1HG1      VAL  92   8.289  -2.365 -14.136
  701   2HG1  VAL  92          2HG1      VAL  92   9.751  -2.142 -13.176
  702   3HG1  VAL  92          3HG1      VAL  92   8.622  -3.432 -12.773
  703   1HG2  VAL  92          1HG2      VAL  92   8.028  -4.379 -15.561
  704   2HG2  VAL  92          2HG2      VAL  92   9.516  -4.756 -16.428
  705   3HG2  VAL  92          3HG2      VAL  92   8.947  -3.090 -16.336
  706    H    GLY  93           H        GLY  93  12.501  -2.380 -16.892
  707   1HA   GLY  93          2HA       GLY  93  12.406  -0.515 -18.308
  708   2HA   GLY  93          1HA       GLY  93  10.722  -0.337 -17.824
  709    H    HIS  94           HN       HIS  94  10.268   0.878 -15.852
  710    HA   HIS  94           HA       HIS  94  10.524   2.701 -14.424
  711   1HB   HIS  94          2HB       HIS  94  13.282   1.521 -14.479
  712   2HB   HIS  94          1HB       HIS  94  13.056   3.094 -13.718
  713    HD1  HIS  94           HD1      HIS  94  11.223  -0.262 -13.645
  714    HD2  HIS  94           HD2      HIS  94  12.397   2.781 -11.053
  715    HE1  HIS  94           HE1      HIS  94  10.492  -0.977 -11.332
  Start of MODEL   17
    1   1H    MET   1          1H        MET   1 -25.674 -16.332 -16.322
    2   2H    MET   1          2H        MET   1 -26.305 -15.281 -17.496
    3   3H    MET   1          3H        MET   1 -26.128 -16.935 -17.840
    4    HA   MET   1           HA       MET   1 -27.763 -17.464 -16.105
    5   1HB   MET   1          2HB       MET   1 -27.226 -14.970 -15.161
    6   2HB   MET   1          1HB       MET   1 -28.704 -14.652 -16.068
    7   1HG   MET   1          2HG       MET   1 -29.970 -15.697 -14.525
    8   2HG   MET   1          1HG       MET   1 -28.926 -17.118 -14.548
    9   1HE   MET   1          1HE       MET   1 -29.646 -14.800 -11.053
   10   2HE   MET   1          2HE       MET   1 -30.565 -15.738 -12.223
   11   3HE   MET   1          3HE       MET   1 -30.123 -14.075 -12.596
   12    H    SER   2           H        SER   2 -29.590 -18.162 -17.129
   13    HA   SER   2           HA       SER   2 -30.163 -17.087 -19.819
   14   1HB   SER   2          2HB       SER   2 -30.808 -19.570 -18.308
   15   2HB   SER   2          1HB       SER   2 -31.976 -19.057 -19.525
   16    HG   SER   2           HG       SER   2 -30.556 -20.187 -20.690
   17    H    GLY   3           H        GLY   3 -31.812 -15.682 -20.219
   18   1HA   GLY   3          2HA       GLY   3 -33.962 -14.691 -19.991
   19   2HA   GLY   3          1HA       GLY   3 -34.236 -15.681 -18.557
   20    H    GLY   4           H        GLY   4 -32.383 -12.848 -19.698
   21   1HA   GLY   4          2HA       GLY   4 -32.868 -10.825 -18.137
   22   2HA   GLY   4          1HA       GLY   4 -32.245 -11.885 -16.873
   23    H    THR   5           H        THR   5 -30.020 -12.276 -16.754
   24    HA   THR   5           HA       THR   5 -28.334 -10.498 -18.457
   25    HB   THR   5           HB       THR   5 -26.619 -10.903 -16.613
   26    HG1  THR   5           HG1      THR   5 -27.173 -12.073 -14.942
   27   1HG2  THR   5          1HG2      THR   5 -28.151  -9.553 -14.908
   28   2HG2  THR   5          2HG2      THR   5 -29.221  -9.472 -16.307
   29   3HG2  THR   5          3HG2      THR   5 -27.586  -8.818 -16.408
   30    H    ALA   6           H        ALA   6 -28.229 -11.988 -20.259
   31    HA   ALA   6           HA       ALA   6 -27.234 -14.712 -19.921
   32   1HB   ALA   6          1HB       ALA   6 -28.557 -14.404 -21.855
   33   2HB   ALA   6          2HB       ALA   6 -26.910 -14.477 -22.481
   34   3HB   ALA   6          3HB       ALA   6 -27.715 -12.919 -22.298
   35    H    ALA   7           H        ALA   7 -25.131 -15.351 -19.811
   36    HA   ALA   7           HA       ALA   7 -22.794 -15.155 -19.599
   37   1HB   ALA   7          1HB       ALA   7 -22.818 -15.316 -22.000
   38   2HB   ALA   7          2HB       ALA   7 -21.715 -14.001 -21.597
   39   3HB   ALA   7          3HB       ALA   7 -23.344 -13.641 -22.167
   40    H    THR   8           H        THR   8 -23.349 -13.771 -17.661
   41    HA   THR   8           HA       THR   8 -22.347 -10.977 -18.059
   42    HB   THR   8           HB       THR   8 -24.552 -11.926 -16.201
   43    HG1  THR   8           HG1      THR   8 -25.276 -11.758 -18.284
   44   1HG2  THR   8          1HG2      THR   8 -22.897  -9.885 -15.626
   45   2HG2  THR   8          2HG2      THR   8 -24.617  -9.836 -15.251
   46   3HG2  THR   8          3HG2      THR   8 -24.009  -9.042 -16.700
   47    H    THR   9           H        THR   9 -21.059 -10.133 -16.388
   48    HA   THR   9           HA       THR   9 -20.085 -12.135 -14.393
   49    HB   THR   9           HB       THR   9 -18.605  -9.969 -15.916
   50    HG1  THR   9           HG1      THR   9 -18.176 -11.672 -17.053
   51   1HG2  THR   9          1HG2      THR   9 -16.621 -10.700 -14.554
   52   2HG2  THR   9          2HG2      THR   9 -17.731 -11.581 -13.506
   53   3HG2  THR   9          3HG2      THR   9 -17.838  -9.824 -13.628
   54    H    ALA  10           H        ALA  10 -20.003 -11.446 -12.243
   55    HA   ALA  10           HA       ALA  10 -21.369  -8.909 -11.606
   56   1HB   ALA  10          1HB       ALA  10 -20.697 -11.414 -10.131
   57   2HB   ALA  10          2HB       ALA  10 -22.208 -10.526 -10.196
   58   3HB   ALA  10          3HB       ALA  10 -20.892  -9.943  -9.191
   59    H    GLY  11           H        GLY  11 -19.972  -7.189 -11.801
   60   1HA   GLY  11          2HA       GLY  11 -17.187  -7.371 -10.873
   61   2HA   GLY  11          1HA       GLY  11 -17.959  -5.961 -11.595
   62    H    SER  12           H        SER  12 -17.835  -7.875  -8.598
   63    HA   SER  12           HA       SER  12 -18.828  -5.499  -7.098
   64   1HB   SER  12          2HB       SER  12 -18.966  -8.429  -6.699
   65   2HB   SER  12          1HB       SER  12 -18.673  -7.485  -5.242
   66    HG   SER  12           HG       SER  12 -20.948  -7.856  -5.953
   67    H    LYS  13           H        LYS  13 -16.426  -8.130  -6.567
   68    HA   LYS  13           HA       LYS  13 -14.444  -6.059  -5.761
   69   1HB   LYS  13          2HB       LYS  13 -14.954  -8.580  -4.151
   70   2HB   LYS  13          1HB       LYS  13 -13.821  -7.288  -3.762
   71   1HG   LYS  13          2HG       LYS  13 -16.182  -5.900  -4.025
   72   2HG   LYS  13          1HG       LYS  13 -16.733  -7.427  -3.336
   73   1HD   LYS  13          2HD       LYS  13 -14.293  -6.378  -2.071
   74   2HD   LYS  13          1HD       LYS  13 -15.696  -5.327  -1.880
   75   1HE   LYS  13          2HE       LYS  13 -16.820  -6.838  -0.577
   76   2HE   LYS  13          1HE       LYS  13 -16.177  -8.226  -1.454
   77   1HZ   LYS  13          1HZ       LYS  13 -14.776  -6.587   0.583
   78   2HZ   LYS  13          2HZ       LYS  13 -14.004  -7.757  -0.377
   79   3HZ   LYS  13          3HZ       LYS  13 -15.227  -8.217   0.710
   80    H    VAL  14           H        VAL  14 -12.264  -6.731  -6.038
   81    HA   VAL  14           HA       VAL  14 -11.922  -9.183  -7.724
   82    HB   VAL  14           HB       VAL  14  -9.836  -7.983  -8.568
   83   1HG1  VAL  14          1HG1      VAL  14 -11.689  -8.067 -10.042
   84   2HG1  VAL  14          2HG1      VAL  14 -11.237  -6.364  -9.991
   85   3HG1  VAL  14          3HG1      VAL  14 -12.624  -6.936  -9.065
   86   1HG2  VAL  14          1HG2      VAL  14  -9.282  -5.930  -7.801
   87   2HG2  VAL  14          2HG2      VAL  14 -10.439  -6.205  -6.502
   88   3HG2  VAL  14          3HG2      VAL  14 -10.935  -5.343  -7.959
   89    H    THR  15           H        THR  15 -10.454 -10.707  -7.025
   90    HA   THR  15           HA       THR  15  -9.058 -10.154  -4.450
   91    HB   THR  15           HB       THR  15 -10.572 -12.130  -4.563
   92    HG1  THR  15           HG1      THR  15  -9.152 -12.637  -3.106
   93   1HG2  THR  15          1HG2      THR  15 -10.565 -13.362  -6.446
   94   2HG2  THR  15          2HG2      THR  15  -9.000 -14.002  -5.946
   95   3HG2  THR  15          3HG2      THR  15  -9.079 -12.597  -7.008
   96    H    PHE  16           H        PHE  16  -6.813 -10.745  -4.188
   97    HA   PHE  16           HA       PHE  16  -5.295 -11.161  -6.730
   98   1HB   PHE  16          2HB       PHE  16  -4.565  -9.173  -4.559
   99   2HB   PHE  16          1HB       PHE  16  -3.623  -9.511  -6.006
  100    HD1  PHE  16           HD1      PHE  16  -6.262  -7.544  -4.593
  101    HD2  PHE  16           HD2      PHE  16  -4.771  -9.135  -8.293
  102    HE1  PHE  16           HE1      PHE  16  -7.579  -5.860  -5.848
  103    HE2  PHE  16           HE2      PHE  16  -6.089  -7.451  -9.549
  104    HZ   PHE  16           HZ       PHE  16  -7.491  -5.814  -8.325
  105    H    LYS  17           H        LYS  17  -3.559 -12.533  -6.532
  106    HA   LYS  17           HA       LYS  17  -2.935 -13.566  -3.791
  107   1HB   LYS  17          2HB       LYS  17  -3.699 -14.956  -6.199
  108   2HB   LYS  17          1HB       LYS  17  -2.063 -15.431  -5.745
  109   1HG   LYS  17          2HG       LYS  17  -2.732 -16.260  -3.662
  110   2HG   LYS  17          1HG       LYS  17  -4.207 -15.294  -3.642
  111   1HD   LYS  17          2HD       LYS  17  -3.643 -17.751  -5.325
  112   2HD   LYS  17          1HD       LYS  17  -4.863 -17.573  -4.064
  113   1HE   LYS  17          2HE       LYS  17  -5.420 -15.481  -5.821
  114   2HE   LYS  17          1HE       LYS  17  -4.997 -16.819  -6.886
  115   1HZ   LYS  17          1HZ       LYS  17  -7.271 -17.046  -6.505
  116   2HZ   LYS  17          2HZ       LYS  17  -7.136 -16.693  -4.848
  117   3HZ   LYS  17          3HZ       LYS  17  -6.573 -18.178  -5.454
  118    H    ILE  18           H        ILE  18  -1.076 -12.487  -3.256
  119    HA   ILE  18           HA       ILE  18   1.045 -12.221  -5.334
  120    HB   ILE  18           HB       ILE  18   0.792 -10.828  -2.650
  121   1HG1  ILE  18          2HG1      ILE  18   0.542  -8.952  -4.692
  122   2HG1  ILE  18          1HG1      ILE  18  -0.404 -10.320  -5.278
  123   1HG2  ILE  18          1HG2      ILE  18   2.684 -10.523  -4.992
  124   2HG2  ILE  18          2HG2      ILE  18   3.093 -10.902  -3.321
  125   3HG2  ILE  18          3HG2      ILE  18   2.502  -9.295  -3.739
  126   1HD1  ILE  18          1HD1      ILE  18  -1.838 -10.286  -3.405
  127   2HD1  ILE  18          2HD1      ILE  18  -1.598  -8.578  -3.770
  128   3HD1  ILE  18          3HD1      ILE  18  -0.708  -9.330  -2.447
  129    H    THR  19           H        THR  19   2.672 -13.662  -5.242
  130    HA   THR  19           HA       THR  19   3.322 -14.946  -2.615
  131    HB   THR  19           HB       THR  19   3.980 -16.061  -5.356
  132    HG1  THR  19           HG1      THR  19   1.897 -16.339  -5.464
  133   1HG2  THR  19          1HG2      THR  19   3.525 -17.862  -3.082
  134   2HG2  THR  19          2HG2      THR  19   4.871 -16.749  -2.835
  135   3HG2  THR  19          3HG2      THR  19   4.858 -17.820  -4.236
  136    H    LEU  20           H        LEU  20   5.350 -14.522  -1.823
  137    HA   LEU  20           HA       LEU  20   7.095 -12.649  -3.115
  138   1HB   LEU  20          2HB       LEU  20   6.966 -13.976  -0.584
  139   2HB   LEU  20          1HB       LEU  20   8.584 -14.219  -1.239
  140    HG   LEU  20           HG       LEU  20   7.223 -11.515  -1.125
  141   1HD1  LEU  20          1HD1      LEU  20   7.994 -12.930   1.082
  142   2HD1  LEU  20          2HD1      LEU  20   8.019 -11.170   0.981
  143   3HD1  LEU  20          3HD1      LEU  20   9.492 -12.091   0.681
  144   1HD2  LEU  20          1HD2      LEU  20  10.169 -12.163  -1.366
  145   2HD2  LEU  20          2HD2      LEU  20   9.359 -10.635  -1.709
  146   3HD2  LEU  20          3HD2      LEU  20   9.131 -12.014  -2.784
  147    H    THR  21           H        THR  21   8.107 -13.135  -5.001
  148    HA   THR  21           HA       THR  21   8.876 -15.863  -5.691
  149    HB   THR  21           HB       THR  21   8.148 -14.230  -7.415
  150    HG1  THR  21           HG1      THR  21   9.317 -15.493  -8.585
  151   1HG2  THR  21          1HG2      THR  21  10.583 -12.783  -7.780
  152   2HG2  THR  21          2HG2      THR  21  10.065 -12.559  -6.110
  153   3HG2  THR  21          3HG2      THR  21   8.977 -12.143  -7.432
  154    H    SER  22           H        SER  22  10.474 -13.077  -4.269
  155    HA   SER  22           HA       SER  22  13.174 -14.143  -4.655
  156   1HB   SER  22          2HB       SER  22  11.962 -11.689  -3.618
  157   2HB   SER  22          1HB       SER  22  13.307 -12.243  -2.625
  158    HG   SER  22           HG       SER  22  13.836 -10.865  -4.480
  159    H    ASP  23           H        ASP  23  10.749 -14.070  -2.059
  160    HA   ASP  23           HA       ASP  23  12.578 -15.731  -0.377
  161   1HB   ASP  23          2HB       ASP  23  11.385 -13.440   0.370
  162   2HB   ASP  23          1HB       ASP  23  10.088 -14.566   0.775
  163    HA   PRO  24           HA       PRO  24   9.615 -18.907  -1.552
  164   1HB   PRO  24          2HB       PRO  24  11.263 -20.982  -0.813
  165   2HB   PRO  24          1HB       PRO  24  11.372 -20.148  -2.372
  166   1HG   PRO  24          2HG       PRO  24  13.164 -19.931   0.002
  167   2HG   PRO  24          1HG       PRO  24  13.528 -19.656  -1.710
  168   1HD   PRO  24          2HD       PRO  24  13.069 -17.647   0.229
  169   2HD   PRO  24          1HD       PRO  24  13.102 -17.412  -1.532
  170    H    LYS  25           H        LYS  25  11.258 -18.412   1.528
  171    HA   LYS  25           HA       LYS  25   9.873 -20.371   3.093
  172   1HB   LYS  25          2HB       LYS  25  11.931 -18.813   3.660
  173   2HB   LYS  25          1HB       LYS  25  10.679 -17.721   4.253
  174   1HG   LYS  25          2HG       LYS  25  10.480 -20.576   5.084
  175   2HG   LYS  25          1HG       LYS  25  11.771 -19.619   5.810
  176   1HD   LYS  25          2HD       LYS  25   9.487 -17.967   5.860
  177   2HD   LYS  25          1HD       LYS  25   8.931 -19.560   6.371
  178   1HE   LYS  25          2HE       LYS  25  10.256 -19.571   8.261
  179   2HE   LYS  25          1HE       LYS  25  11.494 -18.552   7.528
  180   1HZ   LYS  25          1HZ       LYS  25   8.851 -17.377   7.959
  181   2HZ   LYS  25          2HZ       LYS  25  10.389 -16.661   8.051
  182   3HZ   LYS  25          3HZ       LYS  25   9.823 -17.632   9.326
  183    H    LEU  26           H        LEU  26   9.185 -16.898   2.531
  184    HA   LEU  26           HA       LEU  26   6.732 -16.915   4.059
  185   1HB   LEU  26          2HB       LEU  26   8.072 -15.019   2.168
  186   2HB   LEU  26          1HB       LEU  26   6.366 -14.766   2.537
  187    HG   LEU  26           HG       LEU  26   8.025 -15.344   4.902
  188   1HD1  LEU  26          1HD1      LEU  26   8.785 -12.846   4.851
  189   2HD1  LEU  26          2HD1      LEU  26   8.584 -12.992   3.107
  190   3HD1  LEU  26          3HD1      LEU  26   9.728 -14.034   3.953
  191   1HD2  LEU  26          1HD2      LEU  26   6.720 -12.937   5.255
  192   2HD2  LEU  26          2HD2      LEU  26   6.038 -14.518   5.632
  193   3HD2  LEU  26          3HD2      LEU  26   5.688 -13.754   4.084
  194    HA   PRO  27           HA       PRO  27   4.218 -18.878   0.964
  195   1HB   PRO  27          2HB       PRO  27   1.860 -18.641   2.359
  196   2HB   PRO  27          1HB       PRO  27   3.092 -19.866   2.710
  197   1HG   PRO  27          2HG       PRO  27   2.435 -17.378   4.219
  198   2HG   PRO  27          1HG       PRO  27   3.139 -18.893   4.805
  199   1HD   PRO  27          2HD       PRO  27   4.561 -16.509   4.277
  200   2HD   PRO  27          1HD       PRO  27   5.277 -18.117   4.522
  201    H    PHE  28           H        PHE  28   1.986 -18.313  -0.098
  202    HA   PHE  28           HA       PHE  28   2.147 -15.589  -1.118
  203   1HB   PHE  28          2HB       PHE  28   0.351 -16.231  -2.610
  204   2HB   PHE  28          1HB       PHE  28   1.493 -17.568  -2.518
  205    HD1  PHE  28           HD1      PHE  28   0.919 -19.649  -1.359
  206    HD2  PHE  28           HD2      PHE  28  -1.862 -16.380  -1.564
  207    HE1  PHE  28           HE1      PHE  28  -0.907 -21.155  -0.621
  208    HE2  PHE  28           HE2      PHE  28  -3.686 -17.888  -0.824
  209    HZ   PHE  28           HZ       PHE  28  -3.209 -20.274  -0.353
  210    H    LYS  29           H        LYS  29   0.197 -14.143  -1.180
  211    HA   LYS  29           HA       LYS  29  -1.458 -14.370   1.303
  212   1HB   LYS  29          2HB       LYS  29   0.322 -12.185   0.390
  213   2HB   LYS  29          1HB       LYS  29  -1.270 -11.671   0.948
  214   1HG   LYS  29          2HG       LYS  29  -0.338 -11.761   3.019
  215   2HG   LYS  29          1HG       LYS  29  -0.588 -13.501   2.873
  216   1HD   LYS  29          2HD       LYS  29   1.724 -13.512   1.683
  217   2HD   LYS  29          1HD       LYS  29   1.936 -11.919   2.410
  218   1HE   LYS  29          2HE       LYS  29   2.028 -12.757   4.558
  219   2HE   LYS  29          1HE       LYS  29   0.986 -14.128   4.180
  220   1HZ   LYS  29          1HZ       LYS  29   2.871 -14.998   2.811
  221   2HZ   LYS  29          2HZ       LYS  29   3.154 -14.970   4.486
  222   3HZ   LYS  29          3HZ       LYS  29   3.845 -13.784   3.485
  223    H    VAL  30           H        VAL  30  -3.624 -14.045   0.980
  224    HA   VAL  30           HA       VAL  30  -4.506 -13.325  -1.774
  225    HB   VAL  30           HB       VAL  30  -6.110 -14.523   0.511
  226   1HG1  VAL  30          1HG1      VAL  30  -7.591 -13.428  -1.018
  227   2HG1  VAL  30          2HG1      VAL  30  -7.637 -15.139  -1.439
  228   3HG1  VAL  30          3HG1      VAL  30  -6.692 -14.016  -2.416
  229   1HG2  VAL  30          1HG2      VAL  30  -5.406 -16.581  -0.127
  230   2HG2  VAL  30          2HG2      VAL  30  -4.102 -15.748  -0.973
  231   3HG2  VAL  30          3HG2      VAL  30  -5.573 -16.193  -1.839
  232    H    LEU  31           H        LEU  31  -5.397 -11.348  -2.136
  233    HA   LEU  31           HA       LEU  31  -6.349  -9.777   0.229
  234   1HB   LEU  31          2HB       LEU  31  -4.378  -9.139  -1.803
  235   2HB   LEU  31          1HB       LEU  31  -5.695  -7.968  -1.828
  236    HG   LEU  31           HG       LEU  31  -4.898  -8.637   0.896
  237   1HD1  LEU  31          1HD1      LEU  31  -2.761  -8.572  -0.899
  238   2HD1  LEU  31          2HD1      LEU  31  -2.659  -8.336   0.845
  239   3HD1  LEU  31          3HD1      LEU  31  -2.802  -6.942  -0.226
  240   1HD2  LEU  31          1HD2      LEU  31  -5.077  -6.103  -0.761
  241   2HD2  LEU  31          2HD2      LEU  31  -4.702  -6.113   0.961
  242   3HD2  LEU  31          3HD2      LEU  31  -6.263  -6.705   0.396
  243    H    SER  32           H        SER  32  -8.544  -9.781   0.116
  244    HA   SER  32           HA       SER  32  -9.857  -9.612  -2.556
  245   1HB   SER  32          2HB       SER  32 -10.508 -10.922  -0.041
  246   2HB   SER  32          1HB       SER  32 -11.836  -9.901  -0.586
  247    HG   SER  32           HG       SER  32 -11.721 -12.138  -1.427
  248    H    VAL  33           H        VAL  33 -10.174  -7.527  -3.161
  249    HA   VAL  33           HA       VAL  33 -11.477  -5.676  -1.221
  250    HB   VAL  33           HB       VAL  33 -10.004  -3.820  -2.136
  251   1HG1  VAL  33          1HG1      VAL  33  -8.233  -4.251  -0.586
  252   2HG1  VAL  33          2HG1      VAL  33  -8.437  -5.997  -0.737
  253   3HG1  VAL  33          3HG1      VAL  33  -9.668  -5.033   0.078
  254   1HG2  VAL  33          1HG2      VAL  33  -9.286  -5.356  -4.114
  255   2HG2  VAL  33          2HG2      VAL  33  -8.128  -6.032  -2.970
  256   3HG2  VAL  33          3HG2      VAL  33  -8.064  -4.319  -3.381
  257    HA   PRO  34           HA       PRO  34 -14.016  -4.647  -4.658
  258   1HB   PRO  34          2HB       PRO  34 -14.623  -2.028  -4.060
  259   2HB   PRO  34          1HB       PRO  34 -15.333  -3.421  -3.225
  260   1HG   PRO  34          2HG       PRO  34 -13.206  -1.545  -2.282
  261   2HG   PRO  34          1HG       PRO  34 -14.399  -2.455  -1.339
  262   1HD   PRO  34          2HD       PRO  34 -11.696  -3.160  -1.631
  263   2HD   PRO  34          1HD       PRO  34 -12.987  -4.250  -1.084
  264    H    GLU  35           H        GLU  35 -14.114  -3.301  -6.612
  265    HA   GLU  35           HA       GLU  35 -11.599  -2.740  -7.802
  266   1HB   GLU  35          2HB       GLU  35 -14.433  -1.985  -8.495
  267   2HB   GLU  35          1HB       GLU  35 -13.084  -1.377  -9.456
  268   1HG   GLU  35          2HG       GLU  35 -13.456  -3.338 -10.602
  269   2HG   GLU  35          1HG       GLU  35 -12.373  -3.966  -9.361
  270    H    SER  36           H        SER  36 -13.732  -0.671  -5.902
  271    HA   SER  36           HA       SER  36 -12.683   1.875  -6.638
  272   1HB   SER  36          2HB       SER  36 -14.357   0.790  -4.516
  273   2HB   SER  36          1HB       SER  36 -13.289   2.053  -3.911
  274    HG   SER  36           HG       SER  36 -15.338   2.777  -4.821
  275    H    THR  37           H        THR  37 -11.571  -0.486  -4.198
  276    HA   THR  37           HA       THR  37  -9.530   1.172  -3.050
  277    HB   THR  37           HB       THR  37  -9.814  -1.842  -3.241
  278    HG1  THR  37           HG1      THR  37 -11.183  -1.323  -1.738
  279   1HG2  THR  37          1HG2      THR  37  -7.408  -1.067  -3.006
  280   2HG2  THR  37          2HG2      THR  37  -8.002  -2.061  -1.678
  281   3HG2  THR  37          3HG2      THR  37  -7.881  -0.312  -1.484
  282    HA   PRO  38           HA       PRO  38  -6.781   1.111  -6.547
  283   1HB   PRO  38          2HB       PRO  38  -4.857   2.688  -5.379
  284   2HB   PRO  38          1HB       PRO  38  -6.356   3.323  -6.079
  285   1HG   PRO  38          2HG       PRO  38  -5.614   3.000  -3.210
  286   2HG   PRO  38          1HG       PRO  38  -6.749   4.138  -3.954
  287   1HD   PRO  38          2HD       PRO  38  -7.438   1.761  -2.574
  288   2HD   PRO  38          1HD       PRO  38  -8.524   2.741  -3.582
  289    H    PHE  39           H        PHE  39  -4.474   0.486  -6.955
  290    HA   PHE  39           HA       PHE  39  -3.739  -1.909  -5.541
  291   1HB   PHE  39          2HB       PHE  39  -3.165  -1.091  -7.990
  292   2HB   PHE  39          1HB       PHE  39  -1.744  -0.406  -7.202
  293    HD1  PHE  39           HD1      PHE  39  -3.735  -3.595  -7.033
  294    HD2  PHE  39           HD2      PHE  39   0.147  -1.762  -7.191
  295    HE1  PHE  39           HE1      PHE  39  -2.675  -5.836  -7.000
  296    HE2  PHE  39           HE2      PHE  39   1.206  -4.003  -7.159
  297    HZ   PHE  39           HZ       PHE  39  -0.206  -6.040  -7.063
  298    H    THR  40           H        THR  40  -3.103   1.435  -4.912
  299    HA   THR  40           HA       THR  40  -0.585   1.253  -3.568
  300    HB   THR  40           HB       THR  40  -1.434   3.292  -2.291
  301    HG1  THR  40           HG1      THR  40  -3.466   3.757  -2.419
  302   1HG2  THR  40          1HG2      THR  40  -0.195   3.704  -4.276
  303   2HG2  THR  40          2HG2      THR  40  -1.658   4.677  -4.432
  304   3HG2  THR  40          3HG2      THR  40  -1.516   3.151  -5.305
  305    H    ALA  41           H        ALA  41  -3.935   0.888  -2.392
  306    HA   ALA  41           HA       ALA  41  -3.115   0.243   0.330
  307   1HB   ALA  41          1HB       ALA  41  -5.786  -0.603  -0.691
  308   2HB   ALA  41          2HB       ALA  41  -5.442   1.126  -0.689
  309   3HB   ALA  41          3HB       ALA  41  -5.364   0.211   0.816
  310    H    VAL  42           H        VAL  42  -4.045  -1.602  -2.571
  311    HA   VAL  42           HA       VAL  42  -4.179  -4.189  -1.352
  312    HB   VAL  42           HB       VAL  42  -3.351  -3.432  -4.177
  313   1HG1  VAL  42          1HG1      VAL  42  -4.216  -6.071  -2.957
  314   2HG1  VAL  42          2HG1      VAL  42  -2.661  -5.708  -3.704
  315   3HG1  VAL  42          3HG1      VAL  42  -4.119  -5.774  -4.693
  316   1HG2  VAL  42          1HG2      VAL  42  -5.738  -2.897  -3.035
  317   2HG2  VAL  42          2HG2      VAL  42  -6.026  -4.568  -3.521
  318   3HG2  VAL  42          3HG2      VAL  42  -5.582  -3.362  -4.729
  319    H    LEU  43           H        LEU  43  -1.458  -2.524  -2.975
  320    HA   LEU  43           HA       LEU  43   0.490  -4.575  -2.491
  321   1HB   LEU  43          2HB       LEU  43   0.656  -2.620  -4.132
  322   2HB   LEU  43          1HB       LEU  43   1.069  -1.613  -2.745
  323    HG   LEU  43           HG       LEU  43   2.610  -4.110  -2.851
  324   1HD1  LEU  43          1HD1      LEU  43   2.205  -3.351  -5.329
  325   2HD1  LEU  43          2HD1      LEU  43   3.842  -3.748  -4.807
  326   3HD1  LEU  43          3HD1      LEU  43   3.339  -2.062  -4.930
  327   1HD2  LEU  43          1HD2      LEU  43   3.045  -2.123  -1.374
  328   2HD2  LEU  43          2HD2      LEU  43   3.457  -1.195  -2.816
  329   3HD2  LEU  43          3HD2      LEU  43   4.439  -2.583  -2.350
  330    H    LYS  44           H        LYS  44  -0.584  -1.781  -0.587
  331    HA   LYS  44           HA       LYS  44   1.489  -1.838   1.384
  332   1HB   LYS  44          2HB       LYS  44  -0.586  -0.172   0.898
  333   2HB   LYS  44          1HB       LYS  44  -1.251  -1.080   2.257
  334   1HG   LYS  44          2HG       LYS  44   0.699  -0.550   3.620
  335   2HG   LYS  44          1HG       LYS  44   1.472   0.252   2.254
  336   1HD   LYS  44          2HD       LYS  44  -1.108   1.406   2.531
  337   2HD   LYS  44          1HD       LYS  44  -0.396   1.348   4.143
  338   1HE   LYS  44          2HE       LYS  44   1.400   2.706   3.548
  339   2HE   LYS  44          1HE       LYS  44   1.278   2.291   1.840
  340   1HZ   LYS  44          1HZ       LYS  44   0.215   4.221   1.641
  341   2HZ   LYS  44          2HZ       LYS  44  -0.038   4.373   3.314
  342   3HZ   LYS  44          3HZ       LYS  44  -1.112   3.455   2.369
  343    H    PHE  45           H        PHE  45  -1.791  -3.292   1.431
  344    HA   PHE  45           HA       PHE  45  -1.504  -4.606   3.951
  345   1HB   PHE  45          2HB       PHE  45  -3.551  -4.299   2.171
  346   2HB   PHE  45          1HB       PHE  45  -3.134  -5.991   1.905
  347    HD1  PHE  45           HD1      PHE  45  -4.218  -7.558   3.233
  348    HD2  PHE  45           HD2      PHE  45  -3.528  -3.617   4.798
  349    HE1  PHE  45           HE1      PHE  45  -5.400  -8.180   5.322
  350    HE2  PHE  45           HE2      PHE  45  -4.709  -4.240   6.888
  351    HZ   PHE  45           HZ       PHE  45  -5.645  -6.522   7.149
  352    H    ALA  46           H        ALA  46  -0.871  -5.752   0.623
  353    HA   ALA  46           HA       ALA  46  -0.109  -8.419   1.302
  354   1HB   ALA  46          1HB       ALA  46   1.024  -6.756  -0.967
  355   2HB   ALA  46          2HB       ALA  46  -0.557  -7.535  -1.025
  356   3HB   ALA  46          3HB       ALA  46   0.904  -8.514  -0.890
  357    H    ALA  47           H        ALA  47   1.843  -5.439   0.992
  358    HA   ALA  47           HA       ALA  47   4.374  -6.668   1.571
  359   1HB   ALA  47          1HB       ALA  47   3.307  -3.926   1.350
  360   2HB   ALA  47          2HB       ALA  47   4.840  -4.585   0.781
  361   3HB   ALA  47          3HB       ALA  47   4.664  -4.086   2.463
  362    H    GLU  48           H        GLU  48   1.876  -5.212   3.646
  363    HA   GLU  48           HA       GLU  48   3.323  -5.210   6.099
  364   1HB   GLU  48          2HB       GLU  48   0.524  -4.983   5.261
  365   2HB   GLU  48          1HB       GLU  48   0.700  -5.796   6.816
  366   1HG   GLU  48          2HG       GLU  48   0.712  -3.625   7.575
  367   2HG   GLU  48          1HG       GLU  48   2.432  -3.782   7.219
  368    H    GLU  49           H        GLU  49   1.265  -7.736   4.629
  369    HA   GLU  49           HA       GLU  49   1.710  -9.641   6.774
  370   1HB   GLU  49          2HB       GLU  49   0.495  -9.744   4.030
  371   2HB   GLU  49          1HB       GLU  49   0.885 -11.254   4.851
  372   1HG   GLU  49          2HG       GLU  49  -1.195 -10.992   5.757
  373   2HG   GLU  49          1HG       GLU  49  -0.348  -9.919   6.871
  374    H    PHE  50           H        PHE  50   3.419  -8.796   3.826
  375    HA   PHE  50           HA       PHE  50   5.048 -11.244   3.834
  376   1HB   PHE  50          2HB       PHE  50   4.747  -8.854   2.091
  377   2HB   PHE  50          1HB       PHE  50   6.329  -9.630   2.096
  378    HD1  PHE  50           HD1      PHE  50   3.322  -9.592   0.405
  379    HD2  PHE  50           HD2      PHE  50   6.056 -12.379   2.198
  380    HE1  PHE  50           HE1      PHE  50   2.450 -11.392  -1.060
  381    HE2  PHE  50           HE2      PHE  50   5.183 -14.177   0.733
  382    HZ   PHE  50           HZ       PHE  50   3.381 -13.684  -0.895
  383    H    LYS  51           H        LYS  51   5.096  -8.585   5.796
  384    HA   LYS  51           HA       LYS  51   6.698  -7.681   7.230
  385   1HB   LYS  51          2HB       LYS  51   7.902 -10.293   6.409
  386   2HB   LYS  51          1HB       LYS  51   8.948  -9.129   7.221
  387   1HG   LYS  51          2HG       LYS  51   8.068  -9.794   9.181
  388   2HG   LYS  51          1HG       LYS  51   6.528  -9.107   8.667
  389   1HD   LYS  51          2HD       LYS  51   6.384 -11.423   7.325
  390   2HD   LYS  51          1HD       LYS  51   7.442 -11.950   8.633
  391   1HE   LYS  51          2HE       LYS  51   5.832 -11.269  10.303
  392   2HE   LYS  51          1HE       LYS  51   4.816 -10.506   9.080
  393   1HZ   LYS  51          1HZ       LYS  51   3.760 -12.458   9.055
  394   2HZ   LYS  51          2HZ       LYS  51   5.035 -13.283   9.817
  395   3HZ   LYS  51          3HZ       LYS  51   5.073 -13.021   8.140
  396    H    VAL  52           H        VAL  52   6.524  -6.724   4.505
  397    HA   VAL  52           HA       VAL  52   9.301  -5.668   4.208
  398    HB   VAL  52           HB       VAL  52   8.944  -5.663   1.718
  399   1HG1  VAL  52          1HG1      VAL  52  10.280  -7.457   2.035
  400   2HG1  VAL  52          2HG1      VAL  52   8.823  -8.424   1.816
  401   3HG1  VAL  52          3HG1      VAL  52   9.362  -7.999   3.439
  402   1HG2  VAL  52          1HG2      VAL  52   6.769  -5.930   1.099
  403   2HG2  VAL  52          2HG2      VAL  52   6.348  -6.769   2.589
  404   3HG2  VAL  52          3HG2      VAL  52   7.107  -7.652   1.268
  405    HA   PRO  53           HA       PRO  53   7.295  -1.755   4.096
  406   1HB   PRO  53          2HB       PRO  53   9.173  -0.324   2.686
  407   2HB   PRO  53          1HB       PRO  53   9.364  -0.801   4.381
  408   1HG   PRO  53          2HG       PRO  53  10.671  -1.936   1.950
  409   2HG   PRO  53          1HG       PRO  53  11.251  -1.906   3.624
  410   1HD   PRO  53          2HD       PRO  53  10.100  -4.133   2.315
  411   2HD   PRO  53          1HD       PRO  53  10.362  -3.974   4.065
  412    H    ALA  54           H        ALA  54   5.625  -1.094   2.830
  413    HA   ALA  54           HA       ALA  54   5.264  -1.972   0.109
  414   1HB   ALA  54          1HB       ALA  54   3.278  -1.560   1.334
  415   2HB   ALA  54          2HB       ALA  54   3.361  -0.228   0.181
  416   3HB   ALA  54          3HB       ALA  54   3.833   0.029   1.861
  417    H    ALA  55           H        ALA  55   6.424   1.059   1.545
  418    HA   ALA  55           HA       ALA  55   6.414   2.648  -0.833
  419   1HB   ALA  55          1HB       ALA  55   8.035   4.074   0.359
  420   2HB   ALA  55          2HB       ALA  55   8.281   2.800   1.554
  421   3HB   ALA  55          3HB       ALA  55   6.715   3.601   1.428
  422    H    THR  56           H        THR  56   8.787   0.344   0.465
  423    HA   THR  56           HA       THR  56  10.469   0.807  -1.966
  424    HB   THR  56           HB       THR  56  11.436  -0.710   0.449
  425    HG1  THR  56           HG1      THR  56  11.366   1.028   1.592
  426   1HG2  THR  56          1HG2      THR  56  12.697  -0.534  -1.760
  427   2HG2  THR  56          2HG2      THR  56  13.588  -0.025  -0.327
  428   3HG2  THR  56          3HG2      THR  56  12.890   1.182  -1.406
  429    H    SER  57           H        SER  57   8.126  -0.765  -2.199
  430    HA   SER  57           HA       SER  57   9.335  -3.346  -2.973
  431   1HB   SER  57          2HB       SER  57   8.484  -3.681  -0.648
  432   2HB   SER  57          1HB       SER  57   6.874  -3.240  -1.205
  433    HG   SER  57           HG       SER  57   7.281  -5.526  -1.192
  434    H    ALA  58           H        ALA  58   8.186  -4.398  -4.619
  435    HA   ALA  58           HA       ALA  58   5.795  -2.972  -5.711
  436   1HB   ALA  58          1HB       ALA  58   7.660  -2.284  -7.087
  437   2HB   ALA  58          2HB       ALA  58   6.732  -3.469  -8.006
  438   3HB   ALA  58          3HB       ALA  58   8.238  -3.945  -7.221
  439    H    ILE  59           H        ILE  59   4.732  -4.447  -7.460
  440    HA   ILE  59           HA       ILE  59   4.920  -7.312  -6.615
  441    HB   ILE  59           HB       ILE  59   2.489  -5.549  -6.906
  442   1HG1  ILE  59          2HG1      ILE  59   3.110  -7.716  -4.886
  443   2HG1  ILE  59          1HG1      ILE  59   3.679  -6.058  -4.690
  444   1HG2  ILE  59          1HG2      ILE  59   1.084  -7.276  -7.460
  445   2HG2  ILE  59          2HG2      ILE  59   2.076  -8.484  -6.646
  446   3HG2  ILE  59          3HG2      ILE  59   2.531  -7.903  -8.245
  447   1HD1  ILE  59          1HD1      ILE  59   0.895  -7.136  -4.556
  448   2HD1  ILE  59          2HD1      ILE  59   1.118  -5.507  -5.191
  449   3HD1  ILE  59          3HD1      ILE  59   1.669  -5.901  -3.564
  450    H    ILE  60           H        ILE  60   5.400  -8.574  -8.343
  451    HA   ILE  60           HA       ILE  60   4.905  -7.491 -11.070
  452    HB   ILE  60           HB       ILE  60   6.436  -9.280 -11.839
  453   1HG1  ILE  60          2HG1      ILE  60   7.389  -9.978  -9.149
  454   2HG1  ILE  60          1HG1      ILE  60   5.744 -10.533  -9.462
  455   1HG2  ILE  60          1HG2      ILE  60   7.101  -6.965 -10.548
  456   2HG2  ILE  60          2HG2      ILE  60   8.267  -8.028 -11.334
  457   3HG2  ILE  60          3HG2      ILE  60   7.995  -8.151  -9.597
  458   1HD1  ILE  60          1HD1      ILE  60   6.399 -11.858 -11.283
  459   2HD1  ILE  60          2HD1      ILE  60   7.736 -12.072 -10.155
  460   3HD1  ILE  60          3HD1      ILE  60   7.901 -10.963 -11.517
  461    H    THR  61           H        THR  61   4.345  -9.351 -12.717
  462    HA   THR  61           HA       THR  61   2.034 -10.853 -11.564
  463    HB   THR  61           HB       THR  61   2.572 -10.181 -14.477
  464    HG1  THR  61           HG1      THR  61   2.097  -8.259 -13.712
  465   1HG2  THR  61          1HG2      THR  61  -0.006 -10.985 -13.107
  466   2HG2  THR  61          2HG2      THR  61   1.048 -12.131 -13.934
  467   3HG2  THR  61          3HG2      THR  61   0.282 -10.828 -14.840
  468    H    ASN  62           H        ASN  62   1.699 -13.063 -12.293
  469    HA   ASN  62           HA       ASN  62   3.958 -14.743 -12.189
  470   1HB   ASN  62          2HB       ASN  62   1.102 -15.059 -12.865
  471   2HB   ASN  62          1HB       ASN  62   2.159 -16.278 -13.575
  472   1HD2  ASN  62          1HD2      ASN  62   1.587 -14.663 -10.390
  473   2HD2  ASN  62          2HD2      ASN  62   1.925 -16.047  -9.468
  474    H    ASP  63           H        ASP  63   2.590 -13.080 -14.968
  475    HA   ASP  63           HA       ASP  63   3.976 -14.729 -16.945
  476   1HB   ASP  63          2HB       ASP  63   2.598 -12.033 -17.152
  477   2HB   ASP  63          1HB       ASP  63   3.268 -12.908 -18.529
  478    H    GLY  64           H        GLY  64   4.412 -11.392 -15.692
  479   1HA   GLY  64          2HA       GLY  64   7.003 -11.151 -15.155
  480   2HA   GLY  64          1HA       GLY  64   7.125 -11.329 -16.904
  481    H    VAL  65           H        VAL  65   4.951  -9.485 -14.721
  482    HA   VAL  65           HA       VAL  65   5.724  -7.009 -16.205
  483    HB   VAL  65           HB       VAL  65   2.900  -7.705 -15.332
  484   1HG1  VAL  65          1HG1      VAL  65   4.189  -5.246 -16.027
  485   2HG1  VAL  65          2HG1      VAL  65   2.486  -5.519 -15.661
  486   3HG1  VAL  65          3HG1      VAL  65   3.065  -5.660 -17.321
  487   1HG2  VAL  65          1HG2      VAL  65   3.472  -9.131 -17.195
  488   2HG2  VAL  65          2HG2      VAL  65   4.251  -7.796 -18.046
  489   3HG2  VAL  65          3HG2      VAL  65   2.500  -7.805 -17.835
  490    H    GLY  66           H        GLY  66   6.516  -5.552 -14.782
  491   1HA   GLY  66          2HA       GLY  66   6.284  -5.922 -11.915
  492   2HA   GLY  66          1HA       GLY  66   7.103  -4.587 -12.722
  493    H    VAL  67           H        VAL  67   4.029  -5.739 -11.509
  494    HA   VAL  67           HA       VAL  67   2.492  -3.399 -12.292
  495    HB   VAL  67           HB       VAL  67   1.871  -5.339 -10.043
  496   1HG1  VAL  67          1HG1      VAL  67  -0.277  -4.501 -10.096
  497   2HG1  VAL  67          2HG1      VAL  67  -0.179  -4.065 -11.802
  498   3HG1  VAL  67          3HG1      VAL  67   0.597  -3.051 -10.585
  499   1HG2  VAL  67          1HG2      VAL  67   0.744  -5.629 -12.802
  500   2HG2  VAL  67          2HG2      VAL  67   1.008  -6.859 -11.570
  501   3HG2  VAL  67          3HG2      VAL  67   2.369  -6.237 -12.500
  502    H    ASN  68           H        ASN  68   2.377  -1.459 -11.263
  503    HA   ASN  68           HA       ASN  68   3.761  -1.198  -8.626
  504   1HB   ASN  68          2HB       ASN  68   3.391   0.665 -10.960
  505   2HB   ASN  68          1HB       ASN  68   3.688   1.323  -9.351
  506   1HD2  ASN  68          1HD2      ASN  68   5.336   0.527 -12.095
  507   2HD2  ASN  68          2HD2      ASN  68   6.829   0.077 -11.423
  508    HA   PRO  69           HA       PRO  69   0.000   0.065  -6.722
  509   1HB   PRO  69          2HB       PRO  69   0.963   1.866  -4.875
  510   2HB   PRO  69          1HB       PRO  69   1.156   0.111  -4.726
  511   1HG   PRO  69          2HG       PRO  69   3.181   2.164  -5.477
  512   2HG   PRO  69          1HG       PRO  69   3.418   0.578  -4.727
  513   1HD   PRO  69          2HD       PRO  69   3.846   1.209  -7.455
  514   2HD   PRO  69          1HD       PRO  69   3.769  -0.423  -6.758
  515    H    ALA  70           H        ALA  70  -0.246   1.234  -9.017
  516    HA   ALA  70           HA       ALA  70  -0.797   4.119  -8.460
  517   1HB   ALA  70          1HB       ALA  70   1.272   3.800  -9.870
  518   2HB   ALA  70          2HB       ALA  70   0.003   4.749 -10.646
  519   3HB   ALA  70          3HB       ALA  70   0.245   3.062 -11.101
  520    H    GLN  71           H        GLN  71  -1.702   1.175 -10.216
  521    HA   GLN  71           HA       GLN  71  -4.079   2.485 -11.387
  522   1HB   GLN  71          2HB       GLN  71  -2.947  -0.319 -11.569
  523   2HB   GLN  71          1HB       GLN  71  -4.470   0.152 -12.322
  524   1HG   GLN  71          2HG       GLN  71  -3.439   1.364 -13.957
  525   2HG   GLN  71          1HG       GLN  71  -2.184   1.952 -12.867
  526   1HE2  GLN  71          1HE2      GLN  71  -0.328   0.488 -12.433
  527   2HE2  GLN  71          2HE2      GLN  71   0.040  -0.764 -13.519
  528    HA   PRO  72           HA       PRO  72  -6.920   1.060  -8.330
  529   1HB   PRO  72          2HB       PRO  72  -9.143   0.625  -9.889
  530   2HB   PRO  72          1HB       PRO  72  -8.554   2.237  -9.450
  531   1HG   PRO  72          2HG       PRO  72  -8.352   0.812 -12.061
  532   2HG   PRO  72          1HG       PRO  72  -8.380   2.551 -11.732
  533   1HD   PRO  72          2HD       PRO  72  -6.081   1.019 -12.328
  534   2HD   PRO  72          1HD       PRO  72  -6.092   2.667 -11.666
  535    H    ALA  73           H        ALA  73  -8.007  -0.869  -7.531
  536    HA   ALA  73           HA       ALA  73  -6.834  -3.358  -8.177
  537   1HB   ALA  73          1HB       ALA  73  -9.606  -3.002  -7.005
  538   2HB   ALA  73          2HB       ALA  73  -8.121  -2.796  -6.075
  539   3HB   ALA  73          3HB       ALA  73  -8.512  -4.367  -6.773
  540    H    GLY  74           H        GLY  74  -9.878  -1.932  -9.376
  541   1HA   GLY  74          2HA       GLY  74 -10.848  -4.183 -10.811
  542   2HA   GLY  74          1HA       GLY  74 -11.205  -2.506 -11.222
  543    H    ASN  75           H        ASN  75  -8.693  -1.536 -11.901
  544    HA   ASN  75           HA       ASN  75  -8.347  -2.594 -14.568
  545   1HB   ASN  75          2HB       ASN  75  -7.850  -0.198 -13.592
  546   2HB   ASN  75          1HB       ASN  75  -6.265  -0.886 -13.235
  547   1HD2  ASN  75          1HD2      ASN  75  -4.826  -1.258 -15.005
  548   2HD2  ASN  75          2HD2      ASN  75  -5.213  -0.868 -16.610
  549    H    ILE  76           H        ILE  76  -6.532  -2.964 -11.530
  550    HA   ILE  76           HA       ILE  76  -4.262  -4.335 -12.596
  551    HB   ILE  76           HB       ILE  76  -5.582  -4.548  -9.870
  552   1HG1  ILE  76          2HG1      ILE  76  -4.734  -2.288 -10.540
  553   2HG1  ILE  76          1HG1      ILE  76  -3.866  -2.965  -9.166
  554   1HG2  ILE  76          1HG2      ILE  76  -4.225  -6.499 -10.112
  555   2HG2  ILE  76          2HG2      ILE  76  -3.250  -5.350  -9.197
  556   3HG2  ILE  76          3HG2      ILE  76  -2.943  -5.595 -10.916
  557   1HD1  ILE  76          1HD1      ILE  76  -2.042  -2.353 -10.416
  558   2HD1  ILE  76          2HD1      ILE  76  -2.922  -2.455 -11.940
  559   3HD1  ILE  76          3HD1      ILE  76  -2.326  -3.923 -11.168
  560    H    PHE  77           H        PHE  77  -7.398  -5.549 -11.400
  561    HA   PHE  77           HA       PHE  77  -6.751  -8.342 -11.837
  562   1HB   PHE  77          2HB       PHE  77  -8.574  -7.325 -10.299
  563   2HB   PHE  77          1HB       PHE  77  -9.551  -7.215 -11.762
  564    HD1  PHE  77           HD1      PHE  77 -10.254  -9.242 -12.971
  565    HD2  PHE  77           HD2      PHE  77  -8.001  -9.479  -9.320
  566    HE1  PHE  77           HE1      PHE  77 -10.833 -11.644 -12.768
  567    HE2  PHE  77           HE2      PHE  77  -8.582 -11.882  -9.120
  568    HZ   PHE  77           HZ       PHE  77  -9.998 -12.964 -10.843
  569    H    LEU  78           H        LEU  78  -8.401  -5.835 -13.750
  570    HA   LEU  78           HA       LEU  78  -9.323  -7.573 -15.847
  571   1HB   LEU  78          2HB       LEU  78  -8.784  -4.605 -15.687
  572   2HB   LEU  78          1HB       LEU  78  -9.306  -5.362 -17.193
  573    HG   LEU  78           HG       LEU  78 -10.802  -5.769 -14.598
  574   1HD1  LEU  78          1HD1      LEU  78 -12.287  -4.014 -16.187
  575   2HD1  LEU  78          2HD1      LEU  78 -10.645  -3.376 -16.253
  576   3HD1  LEU  78          3HD1      LEU  78 -11.439  -3.607 -14.697
  577   1HD2  LEU  78          1HD2      LEU  78 -12.119  -7.080 -15.876
  578   2HD2  LEU  78          2HD2      LEU  78 -10.992  -6.856 -17.214
  579   3HD2  LEU  78          3HD2      LEU  78 -12.365  -5.765 -17.024
  580    H    LYS  79           H        LYS  79  -6.284  -5.783 -15.375
  581    HA   LYS  79           HA       LYS  79  -5.262  -6.584 -18.014
  582   1HB   LYS  79          2HB       LYS  79  -4.425  -4.779 -15.833
  583   2HB   LYS  79          1HB       LYS  79  -3.096  -5.600 -16.652
  584   1HG   LYS  79          2HG       LYS  79  -4.211  -4.888 -18.848
  585   2HG   LYS  79          1HG       LYS  79  -5.206  -3.812 -17.866
  586   1HD   LYS  79          2HD       LYS  79  -3.031  -2.904 -16.888
  587   2HD   LYS  79          1HD       LYS  79  -2.198  -3.785 -18.169
  588   1HE   LYS  79          2HE       LYS  79  -3.578  -2.581 -19.855
  589   2HE   LYS  79          1HE       LYS  79  -4.312  -1.648 -18.552
  590   1HZ   LYS  79          1HZ       LYS  79  -2.067  -0.895 -17.935
  591   2HZ   LYS  79          2HZ       LYS  79  -2.515  -0.409 -19.502
  592   3HZ   LYS  79          3HZ       LYS  79  -1.437  -1.704 -19.285
  593    H    HIS  80           H        HIS  80  -4.168  -7.156 -14.637
  594    HA   HIS  80           HA       HIS  80  -2.597  -9.480 -15.599
  595   1HB   HIS  80          2HB       HIS  80  -2.715  -8.407 -12.772
  596   2HB   HIS  80          1HB       HIS  80  -1.452  -9.397 -13.504
  597    HD1  HIS  80           HD1      HIS  80  -0.208  -8.167 -15.647
  598    HD2  HIS  80           HD2      HIS  80  -2.201  -5.695 -12.946
  599    HE1  HIS  80           HE1      HIS  80   0.648  -5.819 -16.058
  600    H    GLY  81           H        GLY  81  -4.872  -8.857 -12.878
  601   1HA   GLY  81          2HA       GLY  81  -6.865 -10.386 -12.733
  602   2HA   GLY  81          1HA       GLY  81  -5.776 -11.699 -13.175
  603    H    SER  82           H        SER  82  -5.499 -12.968 -11.407
  604    HA   SER  82           HA       SER  82  -5.147 -11.644  -8.747
  605   1HB   SER  82          2HB       SER  82  -5.804 -13.881  -7.808
  606   2HB   SER  82          1HB       SER  82  -7.072 -13.110  -8.754
  607    HG   SER  82           HG       SER  82  -5.970 -15.488  -9.117
  608    H    GLU  83           H        GLU  83  -3.851 -14.212 -10.862
  609    HA   GLU  83           HA       GLU  83  -1.779 -15.105  -9.117
  610   1HB   GLU  83          2HB       GLU  83  -2.378 -15.310 -12.015
  611   2HB   GLU  83          1HB       GLU  83  -0.685 -15.522 -11.570
  612   1HG   GLU  83          2HG       GLU  83  -1.622 -17.703 -11.437
  613   2HG   GLU  83          1HG       GLU  83  -1.532 -17.149  -9.766
  614    H    LEU  84           H        LEU  84  -0.462 -13.605  -8.180
  615    HA   LEU  84           HA       LEU  84   1.239 -11.948  -9.979
  616   1HB   LEU  84          2HB       LEU  84  -0.397 -10.978  -7.629
  617   2HB   LEU  84          1HB       LEU  84   1.027 -10.103  -8.188
  618    HG   LEU  84           HG       LEU  84  -0.752 -10.845 -10.390
  619   1HD1  LEU  84          1HD1      LEU  84  -2.219  -8.729  -9.457
  620   2HD1  LEU  84          2HD1      LEU  84  -1.890  -9.605  -7.962
  621   3HD1  LEU  84          3HD1      LEU  84  -2.703 -10.417  -9.299
  622   1HD2  LEU  84          1HD2      LEU  84   1.096  -9.222 -10.559
  623   2HD2  LEU  84          2HD2      LEU  84   0.321  -8.202  -9.350
  624   3HD2  LEU  84          3HD2      LEU  84  -0.444  -8.445 -10.919
  625    H    ARG  85           H        ARG  85   3.128 -11.004  -8.635
  626    HA   ARG  85           HA       ARG  85   3.919 -12.839  -6.416
  627   1HB   ARG  85          2HB       ARG  85   5.253 -12.403  -9.031
  628   2HB   ARG  85          1HB       ARG  85   6.313 -12.399  -7.622
  629   1HG   ARG  85          2HG       ARG  85   6.224 -14.644  -7.573
  630   2HG   ARG  85          1HG       ARG  85   4.489 -14.550  -7.275
  631   1HD   ARG  85          2HD       ARG  85   4.171 -15.495  -9.295
  632   2HD   ARG  85          1HD       ARG  85   4.786 -14.008 -10.018
  633    HE   ARG  85           HE       ARG  85   6.875 -15.892  -9.184
  634   1HH1  ARG  85          1HH2      ARG  85   7.376 -14.022 -11.388
  635   2HH1  ARG  85          2HH2      ARG  85   7.161 -14.997 -12.802
  636   1HH2  ARG  85          2HH1      ARG  85   5.449 -17.519 -11.123
  637   2HH2  ARG  85          1HH1      ARG  85   6.065 -16.986 -12.652
  638    H    LEU  86           H        LEU  86   5.681 -11.904  -5.056
  639    HA   LEU  86           HA       LEU  86   5.500  -8.921  -5.007
  640   1HB   LEU  86          2HB       LEU  86   4.733 -10.361  -2.998
  641   2HB   LEU  86          1HB       LEU  86   6.449 -10.644  -2.719
  642    HG   LEU  86           HG       LEU  86   6.200  -7.868  -3.168
  643   1HD1  LEU  86          1HD1      LEU  86   4.005  -7.502  -2.643
  644   2HD1  LEU  86          2HD1      LEU  86   4.590  -7.658  -0.988
  645   3HD1  LEU  86          3HD1      LEU  86   3.847  -9.039  -1.794
  646   1HD2  LEU  86          1HD2      LEU  86   7.144  -7.708  -1.000
  647   2HD2  LEU  86          2HD2      LEU  86   7.686  -9.279  -1.588
  648   3HD2  LEU  86          3HD2      LEU  86   6.342  -9.179  -0.450
  649    H    ILE  87           H        ILE  87   7.322  -7.751  -5.346
  650    HA   ILE  87           HA       ILE  87   9.957  -9.155  -5.188
  651    HB   ILE  87           HB       ILE  87   9.325  -8.829  -7.548
  652   1HG1  ILE  87          2HG1      ILE  87  11.399  -6.725  -6.965
  653   2HG1  ILE  87          1HG1      ILE  87  11.723  -8.417  -6.583
  654   1HG2  ILE  87          1HG2      ILE  87   8.215  -6.990  -8.220
  655   2HG2  ILE  87          2HG2      ILE  87   9.558  -5.967  -7.715
  656   3HG2  ILE  87          3HG2      ILE  87   8.280  -6.372  -6.572
  657   1HD1  ILE  87          1HD1      ILE  87  12.544  -7.902  -8.832
  658   2HD1  ILE  87          2HD1      ILE  87  10.945  -7.321  -9.302
  659   3HD1  ILE  87          3HD1      ILE  87  11.190  -9.028  -8.931
  660    HA   PRO  88           HA       PRO  88  10.810  -5.772  -2.451
  661   1HB   PRO  88          2HB       PRO  88  13.449  -6.427  -2.013
  662   2HB   PRO  88          1HB       PRO  88  12.088  -7.238  -1.220
  663   1HG   PRO  88          2HG       PRO  88  13.824  -8.220  -3.437
  664   2HG   PRO  88          1HG       PRO  88  12.924  -9.144  -2.223
  665   1HD   PRO  88          2HD       PRO  88  12.140  -8.752  -4.909
  666   2HD   PRO  88          1HD       PRO  88  11.104  -9.360  -3.600
  667    H    ARG  89           H        ARG  89  11.146  -3.729  -3.191
  668    HA   ARG  89           HA       ARG  89  12.731  -3.211  -5.589
  669   1HB   ARG  89          2HB       ARG  89  10.601  -1.936  -4.385
  670   2HB   ARG  89          1HB       ARG  89  11.951  -0.883  -3.964
  671   1HG   ARG  89          2HG       ARG  89  11.930  -0.034  -6.045
  672   2HG   ARG  89          1HG       ARG  89  12.282  -1.635  -6.694
  673   1HD   ARG  89          2HD       ARG  89  10.251  -1.421  -7.703
  674   2HD   ARG  89          1HD       ARG  89   9.620  -1.880  -6.122
  675    HE   ARG  89           HE       ARG  89   9.934   0.978  -6.961
  676   1HH1  ARG  89          1HH2      ARG  89   9.311   0.607  -4.110
  677   2HH1  ARG  89          2HH2      ARG  89   7.579   0.614  -4.077
  678   1HH2  ARG  89          2HH1      ARG  89   7.248   0.031  -7.488
  679   2HH2  ARG  89          1HH1      ARG  89   6.407   0.286  -5.995
  680    H    ASP  90           H        ASP  90  14.837  -2.609  -5.642
  681    HA   ASP  90           HA       ASP  90  16.136  -1.840  -3.058
  682   1HB   ASP  90          2HB       ASP  90  17.218  -3.442  -5.395
  683   2HB   ASP  90          1HB       ASP  90  18.242  -2.790  -4.117
  684    H    ARG  91           H        ARG  91  16.231   0.369  -3.222
  685    HA   ARG  91           HA       ARG  91  17.591   1.477  -5.643
  686   1HB   ARG  91          2HB       ARG  91  15.021   2.286  -4.360
  687   2HB   ARG  91          1HB       ARG  91  16.073   3.577  -4.940
  688   1HG   ARG  91          2HG       ARG  91  15.316   3.197  -7.023
  689   2HG   ARG  91          1HG       ARG  91  16.074   1.606  -6.966
  690   1HD   ARG  91          2HD       ARG  91  13.887   0.965  -7.338
  691   2HD   ARG  91          1HD       ARG  91  13.875   1.012  -5.575
  692    HE   ARG  91           HE       ARG  91  12.524   2.912  -7.362
  693   1HH1  ARG  91          1HH2      ARG  91  11.722   1.597  -4.621
  694   2HH1  ARG  91          2HH2      ARG  91  11.630   3.020  -3.637
  695   1HH2  ARG  91          2HH1      ARG  91  13.303   5.033  -5.922
  696   2HH2  ARG  91          1HH1      ARG  91  12.527   4.968  -4.374
  697    H    VAL  92           H        VAL  92  16.460   2.757  -2.482
  698    HA   VAL  92           HA       VAL  92  19.302   3.485  -1.904
  699    HB   VAL  92           HB       VAL  92  16.890   5.209  -1.248
  700   1HG1  VAL  92          1HG1      VAL  92  18.579   6.861  -0.609
  701   2HG1  VAL  92          2HG1      VAL  92  19.870   5.758  -1.088
  702   3HG1  VAL  92          3HG1      VAL  92  18.844   5.369   0.294
  703   1HG2  VAL  92          1HG2      VAL  92  17.368   6.546  -3.103
  704   2HG2  VAL  92          2HG2      VAL  92  17.704   4.942  -3.753
  705   3HG2  VAL  92          3HG2      VAL  92  19.030   5.971  -3.216
  706    H    GLY  93           H        GLY  93  19.927   2.424  -0.113
  707   1HA   GLY  93          2HA       GLY  93  19.843   1.951   2.242
  708   2HA   GLY  93          1HA       GLY  93  18.111   2.286   2.226
  709    H    HIS  94           HN       HIS  94  16.777   0.677   0.920
  710    HA   HIS  94           HA       HIS  94  17.348  -2.002   1.851
  711   1HB   HIS  94          2HB       HIS  94  15.047  -0.941   1.471
  712   2HB   HIS  94          1HB       HIS  94  15.298  -1.251  -0.246
  713    HD1  HIS  94           HD1      HIS  94  14.108  -3.343  -0.881
  714    HD2  HIS  94           HD2      HIS  94  15.811  -3.650   2.911
  715    HE1  HIS  94           HE1      HIS  94  13.610  -5.686  -0.057
  Start of MODEL   18
    1   1H    MET   1          1H        MET   1 -14.233 -20.752  -3.937
    2   2H    MET   1          2H        MET   1 -13.211 -20.582  -2.588
    3   3H    MET   1          3H        MET   1 -12.683 -20.089  -4.128
    4    HA   MET   1           HA       MET   1 -14.259 -18.317  -4.197
    5   1HB   MET   1          2HB       MET   1 -15.628 -19.945  -2.332
    6   2HB   MET   1          1HB       MET   1 -15.233 -18.454  -1.475
    7   1HG   MET   1          2HG       MET   1 -16.396 -17.109  -3.024
    8   2HG   MET   1          1HG       MET   1 -16.392 -18.371  -4.255
    9   1HE   MET   1          1HE       MET   1 -19.723 -17.875  -4.125
   10   2HE   MET   1          2HE       MET   1 -19.416 -19.586  -4.421
   11   3HE   MET   1          3HE       MET   1 -18.253 -18.381  -4.968
   12    H    SER   2           H        SER   2 -12.568 -16.887  -4.089
   13    HA   SER   2           HA       SER   2 -10.924 -16.697  -1.637
   14   1HB   SER   2          2HB       SER   2 -10.710 -15.683  -4.439
   15   2HB   SER   2          1HB       SER   2  -9.906 -14.755  -3.175
   16    HG   SER   2           HG       SER   2  -8.449 -16.274  -3.764
   17    H    GLY   3           H        GLY   3 -13.250 -14.714  -3.479
   18   1HA   GLY   3          2HA       GLY   3 -14.143 -13.337  -1.129
   19   2HA   GLY   3          1HA       GLY   3 -13.028 -12.304  -2.021
   20    H    GLY   4           H        GLY   4 -13.552 -12.158  -4.461
   21   1HA   GLY   4          2HA       GLY   4 -16.517 -11.901  -4.759
   22   2HA   GLY   4          1HA       GLY   4 -15.351 -10.844  -5.554
   23    H    THR   5           H        THR   5 -16.240 -14.304  -5.365
   24    HA   THR   5           HA       THR   5 -16.319 -14.503  -8.268
   25    HB   THR   5           HB       THR   5 -13.906 -14.674  -7.995
   26    HG1  THR   5           HG1      THR   5 -14.443 -16.049  -9.530
   27   1HG2  THR   5          1HG2      THR   5 -14.612 -16.705  -5.879
   28   2HG2  THR   5          2HG2      THR   5 -13.556 -15.299  -5.747
   29   3HG2  THR   5          3HG2      THR   5 -13.037 -16.710  -6.670
   30    H    ALA   6           H        ALA   6 -18.086 -15.735  -8.561
   31    HA   ALA   6           HA       ALA   6 -18.992 -17.581  -6.462
   32   1HB   ALA   6          1HB       ALA   6 -20.599 -16.140  -7.702
   33   2HB   ALA   6          2HB       ALA   6 -20.983 -17.856  -7.860
   34   3HB   ALA   6          3HB       ALA   6 -20.193 -17.002  -9.187
   35    H    ALA   7           H        ALA   7 -18.292 -17.895  -9.969
   36    HA   ALA   7           HA       ALA   7 -17.314 -20.665  -9.431
   37   1HB   ALA   7          1HB       ALA   7 -18.376 -21.248 -11.711
   38   2HB   ALA   7          2HB       ALA   7 -19.324 -19.776 -11.506
   39   3HB   ALA   7          3HB       ALA   7 -19.467 -21.088 -10.335
   40    H    THR   8           H        THR   8 -17.611 -18.275 -12.105
   41    HA   THR   8           HA       THR   8 -14.768 -18.886 -12.815
   42    HB   THR   8           HB       THR   8 -15.393 -17.831 -15.046
   43    HG1  THR   8           HG1      THR   8 -17.307 -17.025 -15.215
   44   1HG2  THR   8          1HG2      THR   8 -15.231 -20.229 -14.869
   45   2HG2  THR   8          2HG2      THR   8 -16.689 -19.858 -15.788
   46   3HG2  THR   8          3HG2      THR   8 -16.812 -20.329 -14.092
   47    H    THR   9           H        THR   9 -17.111 -16.178 -12.633
   48    HA   THR   9           HA       THR   9 -15.076 -14.445 -11.453
   49    HB   THR   9           HB       THR   9 -14.488 -14.219 -13.829
   50    HG1  THR   9           HG1      THR   9 -14.161 -12.258 -13.198
   51   1HG2  THR   9          1HG2      THR   9 -16.564 -14.832 -14.898
   52   2HG2  THR   9          2HG2      THR   9 -16.181 -13.179 -15.377
   53   3HG2  THR   9          3HG2      THR   9 -17.408 -13.476 -14.146
   54    H    ALA  10           H        ALA  10 -16.009 -12.635 -10.435
   55    HA   ALA  10           HA       ALA  10 -18.977 -12.351 -10.676
   56   1HB   ALA  10          1HB       ALA  10 -17.427 -12.242  -8.071
   57   2HB   ALA  10          2HB       ALA  10 -18.307 -13.665  -8.629
   58   3HB   ALA  10          3HB       ALA  10 -19.179 -12.174  -8.269
   59    H    GLY  11           H        GLY  11 -19.708 -10.217 -10.607
   60   1HA   GLY  11          2HA       GLY  11 -17.627  -8.123 -10.793
   61   2HA   GLY  11          1HA       GLY  11 -19.332  -7.924 -11.195
   62    H    SER  12           H        SER  12 -17.752  -9.096  -8.203
   63    HA   SER  12           HA       SER  12 -19.197  -6.932  -6.725
   64   1HB   SER  12          2HB       SER  12 -19.204  -9.778  -6.347
   65   2HB   SER  12          1HB       SER  12 -18.435  -9.031  -4.950
   66    HG   SER  12           HG       SER  12 -20.557  -8.917  -4.499
   67    H    LYS  13           H        LYS  13 -16.326  -9.082  -6.477
   68    HA   LYS  13           HA       LYS  13 -14.754  -6.724  -5.552
   69   1HB   LYS  13          2HB       LYS  13 -15.041  -9.381  -4.153
   70   2HB   LYS  13          1HB       LYS  13 -13.598  -8.393  -3.939
   71   1HG   LYS  13          2HG       LYS  13 -15.205  -6.464  -3.387
   72   2HG   LYS  13          1HG       LYS  13 -16.450  -7.705  -3.232
   73   1HD   LYS  13          2HD       LYS  13 -14.751  -8.900  -1.668
   74   2HD   LYS  13          1HD       LYS  13 -13.953  -7.329  -1.585
   75   1HE   LYS  13          2HE       LYS  13 -16.056  -6.293  -0.823
   76   2HE   LYS  13          1HE       LYS  13 -16.863  -7.859  -0.911
   77   1HZ   LYS  13          1HZ       LYS  13 -15.142  -6.810   1.120
   78   2HZ   LYS  13          2HZ       LYS  13 -14.638  -8.344   0.588
   79   3HZ   LYS  13          3HZ       LYS  13 -16.213  -8.123   1.184
   80    H    VAL  14           H        VAL  14 -12.365  -7.208  -5.629
   81    HA   VAL  14           HA       VAL  14 -11.736  -9.116  -7.845
   82    HB   VAL  14           HB       VAL  14  -9.807  -7.510  -8.346
   83   1HG1  VAL  14          1HG1      VAL  14 -12.436  -7.565  -9.224
   84   2HG1  VAL  14          2HG1      VAL  14 -11.124  -6.662  -9.981
   85   3HG1  VAL  14          3HG1      VAL  14 -12.188  -5.865  -8.822
   86   1HG2  VAL  14          1HG2      VAL  14 -10.058  -5.202  -7.556
   87   2HG2  VAL  14          2HG2      VAL  14  -9.923  -6.287  -6.173
   88   3HG2  VAL  14          3HG2      VAL  14 -11.498  -5.648  -6.643
   89    H    THR  15           H        THR  15 -10.449 -10.746  -7.179
   90    HA   THR  15           HA       THR  15  -8.983 -10.451  -4.611
   91    HB   THR  15           HB       THR  15  -8.691 -12.974  -4.876
   92    HG1  THR  15           HG1      THR  15  -9.254 -13.727  -6.737
   93   1HG2  THR  15          1HG2      THR  15 -11.265 -11.506  -4.501
   94   2HG2  THR  15          2HG2      THR  15 -10.346 -12.474  -3.347
   95   3HG2  THR  15          3HG2      THR  15 -11.324 -13.269  -4.581
   96    H    PHE  16           H        PHE  16  -6.770 -10.672  -4.455
   97    HA   PHE  16           HA       PHE  16  -5.261 -10.980  -7.023
   98   1HB   PHE  16          2HB       PHE  16  -4.558  -9.178  -4.690
   99   2HB   PHE  16          1HB       PHE  16  -3.660  -9.324  -6.199
  100    HD1  PHE  16           HD1      PHE  16  -6.236  -7.542  -4.501
  101    HD2  PHE  16           HD2      PHE  16  -5.021  -8.877  -8.399
  102    HE1  PHE  16           HE1      PHE  16  -7.692  -5.827  -5.545
  103    HE2  PHE  16           HE2      PHE  16  -6.477  -7.162  -9.439
  104    HZ   PHE  16           HZ       PHE  16  -7.812  -5.638  -8.012
  105    H    LYS  17           H        LYS  17  -3.530 -12.369  -6.951
  106    HA   LYS  17           HA       LYS  17  -2.954 -13.676  -4.324
  107   1HB   LYS  17          2HB       LYS  17  -3.755 -14.865  -6.668
  108   2HB   LYS  17          1HB       LYS  17  -2.001 -15.005  -6.784
  109   1HG   LYS  17          2HG       LYS  17  -1.867 -16.160  -4.687
  110   2HG   LYS  17          1HG       LYS  17  -3.554 -15.803  -4.311
  111   1HD   LYS  17          2HD       LYS  17  -4.046 -17.075  -6.549
  112   2HD   LYS  17          1HD       LYS  17  -2.433 -17.750  -6.309
  113   1HE   LYS  17          2HE       LYS  17  -3.699 -17.912  -3.795
  114   2HE   LYS  17          1HE       LYS  17  -4.909 -18.431  -4.968
  115   1HZ   LYS  17          1HZ       LYS  17  -2.274 -19.493  -5.460
  116   2HZ   LYS  17          2HZ       LYS  17  -3.780 -20.281  -5.425
  117   3HZ   LYS  17          3HZ       LYS  17  -2.939 -19.987  -3.978
  118    H    ILE  18           H        ILE  18  -1.120 -12.801  -3.468
  119    HA   ILE  18           HA       ILE  18   1.118 -12.129  -5.341
  120    HB   ILE  18           HB       ILE  18   0.565 -11.001  -2.575
  121   1HG1  ILE  18          2HG1      ILE  18   0.443  -8.977  -4.523
  122   2HG1  ILE  18          1HG1      ILE  18  -0.474 -10.318  -5.208
  123   1HG2  ILE  18          1HG2      ILE  18   2.256  -9.265  -3.799
  124   2HG2  ILE  18          2HG2      ILE  18   2.794 -10.781  -4.521
  125   3HG2  ILE  18          3HG2      ILE  18   2.805 -10.586  -2.767
  126   1HD1  ILE  18          1HD1      ILE  18  -1.547  -8.529  -3.482
  127   2HD1  ILE  18          2HD1      ILE  18  -0.969  -9.742  -2.337
  128   3HD1  ILE  18          3HD1      ILE  18  -2.106 -10.197  -3.608
  129    H    THR  19           H        THR  19   2.566 -13.782  -5.300
  130    HA   THR  19           HA       THR  19   3.118 -15.162  -2.711
  131    HB   THR  19           HB       THR  19   3.963 -15.995  -5.504
  132    HG1  THR  19           HG1      THR  19   2.049 -16.797  -5.718
  133   1HG2  THR  19          1HG2      THR  19   4.278 -17.091  -2.764
  134   2HG2  THR  19          2HG2      THR  19   5.316 -17.275  -4.177
  135   3HG2  THR  19          3HG2      THR  19   3.856 -18.254  -4.023
  136    H    LEU  20           H        LEU  20   5.077 -14.857  -1.718
  137    HA   LEU  20           HA       LEU  20   6.877 -12.806  -2.614
  138   1HB   LEU  20          2HB       LEU  20   6.498 -14.280  -0.254
  139   2HB   LEU  20          1HB       LEU  20   8.131 -14.683  -0.782
  140    HG   LEU  20           HG       LEU  20   7.140 -11.829  -0.676
  141   1HD1  LEU  20          1HD1      LEU  20   8.959 -12.623   1.464
  142   2HD1  LEU  20          2HD1      LEU  20   7.427 -13.493   1.547
  143   3HD1  LEU  20          3HD1      LEU  20   7.442 -11.728   1.560
  144   1HD2  LEU  20          1HD2      LEU  20   9.979 -12.612  -0.249
  145   2HD2  LEU  20          2HD2      LEU  20   9.311 -11.255  -1.157
  146   3HD2  LEU  20          3HD2      LEU  20   9.340 -12.867  -1.873
  147    H    THR  21           H        THR  21   8.485 -12.926  -4.086
  148    HA   THR  21           HA       THR  21   9.180 -15.515  -5.292
  149    HB   THR  21           HB       THR  21  10.621 -14.094  -6.794
  150    HG1  THR  21           HG1      THR  21  11.049 -12.167  -6.132
  151   1HG2  THR  21          1HG2      THR  21   7.882 -14.414  -6.769
  152   2HG2  THR  21          2HG2      THR  21   8.810 -13.723  -8.100
  153   3HG2  THR  21          3HG2      THR  21   8.058 -12.665  -6.906
  154    H    SER  22           H        SER  22  10.825 -12.989  -3.378
  155    HA   SER  22           HA       SER  22  13.433 -14.159  -3.396
  156   1HB   SER  22          2HB       SER  22  11.993 -12.186  -1.678
  157   2HB   SER  22          1HB       SER  22  13.459 -12.910  -1.024
  158    HG   SER  22           HG       SER  22  14.151 -11.185  -2.169
  159    H    ASP  23           H        ASP  23  10.616 -14.708  -1.308
  160    HA   ASP  23           HA       ASP  23  11.928 -16.362   0.637
  161   1HB   ASP  23          2HB       ASP  23   9.496 -15.260   0.536
  162   2HB   ASP  23          1HB       ASP  23   9.067 -16.852  -0.088
  163    HA   PRO  24           HA       PRO  24  12.454 -20.031  -1.781
  164   1HB   PRO  24          2HB       PRO  24  13.001 -21.731   0.313
  165   2HB   PRO  24          1HB       PRO  24  14.173 -20.579  -0.350
  166   1HG   PRO  24          2HG       PRO  24  12.612 -20.421   2.193
  167   2HG   PRO  24          1HG       PRO  24  14.197 -19.732   1.803
  168   1HD   PRO  24          2HD       PRO  24  11.771 -18.307   1.865
  169   2HD   PRO  24          1HD       PRO  24  13.274 -17.751   1.099
  170    H    LYS  25           H        LYS  25  10.221 -19.902   0.966
  171    HA   LYS  25           HA       LYS  25   8.850 -22.391   0.300
  172   1HB   LYS  25          2HB       LYS  25   8.610 -20.253   2.325
  173   2HB   LYS  25          1HB       LYS  25   7.082 -20.995   1.853
  174   1HG   LYS  25          2HG       LYS  25   7.558 -22.849   3.025
  175   2HG   LYS  25          1HG       LYS  25   9.098 -23.032   2.183
  176   1HD   LYS  25          2HD       LYS  25   9.962 -21.165   3.753
  177   2HD   LYS  25          1HD       LYS  25   8.521 -21.497   4.716
  178   1HE   LYS  25          2HE       LYS  25   9.808 -23.983   3.985
  179   2HE   LYS  25          1HE       LYS  25  10.961 -22.918   4.785
  180   1HZ   LYS  25          1HZ       LYS  25   9.758 -22.885   6.703
  181   2HZ   LYS  25          2HZ       LYS  25   9.370 -24.449   6.157
  182   3HZ   LYS  25          3HZ       LYS  25   8.273 -23.170   5.929
  183    H    LEU  26           H        LEU  26   8.559 -19.020  -0.615
  184    HA   LEU  26           HA       LEU  26   7.169 -17.946  -2.152
  185   1HB   LEU  26          2HB       LEU  26   7.326 -20.729  -3.043
  186   2HB   LEU  26          1HB       LEU  26   5.811 -19.962  -3.517
  187    HG   LEU  26           HG       LEU  26   7.569 -17.968  -4.092
  188   1HD1  LEU  26          1HD1      LEU  26   9.684 -18.688  -4.403
  189   2HD1  LEU  26          2HD1      LEU  26   9.131 -20.054  -5.374
  190   3HD1  LEU  26          3HD1      LEU  26   9.219 -20.198  -3.618
  191   1HD2  LEU  26          1HD2      LEU  26   7.143 -20.189  -6.079
  192   2HD2  LEU  26          2HD2      LEU  26   7.066 -18.444  -6.332
  193   3HD2  LEU  26          3HD2      LEU  26   5.765 -19.270  -5.473
  194    HA   PRO  27           HA       PRO  27   3.607 -18.888   0.691
  195   1HB   PRO  27          2HB       PRO  27   3.792 -16.544   2.123
  196   2HB   PRO  27          1HB       PRO  27   4.620 -18.043   2.578
  197   1HG   PRO  27          2HG       PRO  27   5.751 -15.571   1.349
  198   2HG   PRO  27          1HG       PRO  27   6.543 -16.775   2.378
  199   1HD   PRO  27          2HD       PRO  27   6.794 -16.587  -0.428
  200   2HD   PRO  27          1HD       PRO  27   7.274 -17.973   0.574
  201    H    PHE  28           H        PHE  28   1.869 -18.527  -0.648
  202    HA   PHE  28           HA       PHE  28   1.569 -16.020  -2.148
  203   1HB   PHE  28          2HB       PHE  28  -0.353 -17.066  -3.172
  204   2HB   PHE  28          1HB       PHE  28   0.919 -18.281  -3.069
  205    HD1  PHE  28           HD1      PHE  28   0.757 -20.158  -1.498
  206    HD2  PHE  28           HD2      PHE  28  -2.326 -17.171  -1.715
  207    HE1  PHE  28           HE1      PHE  28  -0.751 -21.615  -0.173
  208    HE2  PHE  28           HE2      PHE  28  -3.831 -18.630  -0.389
  209    HZ   PHE  28           HZ       PHE  28  -3.042 -20.850   0.382
  210    H    LYS  29           H        LYS  29  -0.282 -14.605  -1.933
  211    HA   LYS  29           HA       LYS  29  -1.744 -14.788   0.664
  212   1HB   LYS  29          2HB       LYS  29   0.292 -13.133   0.600
  213   2HB   LYS  29          1HB       LYS  29  -0.790 -12.123  -0.359
  214   1HG   LYS  29          2HG       LYS  29  -2.518 -12.547   1.530
  215   2HG   LYS  29          1HG       LYS  29  -1.129 -13.063   2.487
  216   1HD   LYS  29          2HD       LYS  29  -0.047 -10.906   2.172
  217   2HD   LYS  29          1HD       LYS  29  -1.330 -10.386   1.077
  218   1HE   LYS  29          2HE       LYS  29  -2.418 -11.330   3.607
  219   2HE   LYS  29          1HE       LYS  29  -1.268 -10.019   3.857
  220   1HZ   LYS  29          1HZ       LYS  29  -2.737  -8.571   3.089
  221   2HZ   LYS  29          2HZ       LYS  29  -3.891  -9.815   3.005
  222   3HZ   LYS  29          3HZ       LYS  29  -2.941  -9.441   1.647
  223    H    VAL  30           H        VAL  30  -3.900 -14.331   0.467
  224    HA   VAL  30           HA       VAL  30  -4.870 -13.504  -2.225
  225    HB   VAL  30           HB       VAL  30  -6.368 -14.764   0.096
  226   1HG1  VAL  30          1HG1      VAL  30  -8.051 -15.207  -1.789
  227   2HG1  VAL  30          2HG1      VAL  30  -7.159 -14.006  -2.723
  228   3HG1  VAL  30          3HG1      VAL  30  -7.942 -13.543  -1.211
  229   1HG2  VAL  30          1HG2      VAL  30  -5.113 -15.879  -2.420
  230   2HG2  VAL  30          2HG2      VAL  30  -6.408 -16.727  -1.574
  231   3HG2  VAL  30          3HG2      VAL  30  -4.877 -16.413  -0.755
  232    H    LEU  31           H        LEU  31  -5.453 -11.411  -2.452
  233    HA   LEU  31           HA       LEU  31  -6.385  -9.911  -0.032
  234   1HB   LEU  31          2HB       LEU  31  -4.365  -9.309  -1.988
  235   2HB   LEU  31          1HB       LEU  31  -5.653  -8.113  -2.117
  236    HG   LEU  31           HG       LEU  31  -4.731  -8.848   0.626
  237   1HD1  LEU  31          1HD1      LEU  31  -2.568  -8.529  -0.150
  238   2HD1  LEU  31          2HD1      LEU  31  -3.018  -6.861   0.206
  239   3HD1  LEU  31          3HD1      LEU  31  -3.082  -7.457  -1.454
  240   1HD2  LEU  31          1HD2      LEU  31  -5.384  -6.614   1.117
  241   2HD2  LEU  31          2HD2      LEU  31  -6.590  -7.183  -0.038
  242   3HD2  LEU  31          3HD2      LEU  31  -5.282  -6.127  -0.575
  243    H    SER  32           H        SER  32  -8.585  -9.799  -0.122
  244    HA   SER  32           HA       SER  32  -9.900  -9.470  -2.779
  245   1HB   SER  32          2HB       SER  32 -10.596 -11.295  -1.066
  246   2HB   SER  32          1HB       SER  32 -11.336  -9.971  -0.172
  247    HG   SER  32           HG       SER  32 -12.922 -10.133  -1.531
  248    H    VAL  33           H        VAL  33 -10.496  -7.446  -3.331
  249    HA   VAL  33           HA       VAL  33 -11.427  -5.575  -1.207
  250    HB   VAL  33           HB       VAL  33 -10.166  -3.724  -2.404
  251   1HG1  VAL  33          1HG1      VAL  33  -9.393  -5.344  -0.354
  252   2HG1  VAL  33          2HG1      VAL  33  -8.461  -3.953  -0.911
  253   3HG1  VAL  33          3HG1      VAL  33  -8.051  -5.574  -1.477
  254   1HG2  VAL  33          1HG2      VAL  33  -8.335  -4.314  -3.867
  255   2HG2  VAL  33          2HG2      VAL  33  -9.788  -5.094  -4.496
  256   3HG2  VAL  33          3HG2      VAL  33  -8.603  -6.036  -3.590
  257    HA   PRO  34           HA       PRO  34 -14.559  -4.636  -4.143
  258   1HB   PRO  34          2HB       PRO  34 -15.159  -2.054  -3.404
  259   2HB   PRO  34          1HB       PRO  34 -15.642  -3.481  -2.470
  260   1HG   PRO  34          2HG       PRO  34 -13.486  -1.502  -1.893
  261   2HG   PRO  34          1HG       PRO  34 -14.417  -2.506  -0.770
  262   1HD   PRO  34          2HD       PRO  34 -11.774  -3.013  -1.630
  263   2HD   PRO  34          1HD       PRO  34 -12.839  -4.170  -0.802
  264    H    GLU  35           H        GLU  35 -14.912  -3.538  -6.140
  265    HA   GLU  35           HA       GLU  35 -12.593  -2.552  -7.516
  266   1HB   GLU  35          2HB       GLU  35 -15.525  -2.735  -8.145
  267   2HB   GLU  35          1HB       GLU  35 -14.497  -1.744  -9.178
  268   1HG   GLU  35          2HG       GLU  35 -14.023  -3.674 -10.269
  269   2HG   GLU  35          1HG       GLU  35 -12.995  -4.044  -8.884
  270    H    SER  36           H        SER  36 -11.879  -0.880  -6.089
  271    HA   SER  36           HA       SER  36 -12.586   1.777  -6.842
  272   1HB   SER  36          2HB       SER  36 -13.527   2.506  -4.593
  273   2HB   SER  36          1HB       SER  36 -14.620   1.536  -5.574
  274    HG   SER  36           HG       SER  36 -14.491   0.834  -3.377
  275    H    THR  37           H        THR  37 -11.315  -0.312  -4.249
  276    HA   THR  37           HA       THR  37  -9.479   1.633  -3.170
  277    HB   THR  37           HB       THR  37  -8.316  -0.405  -2.214
  278    HG1  THR  37           HG1      THR  37  -8.673  -2.093  -3.430
  279   1HG2  THR  37          1HG2      THR  37 -11.234   0.186  -1.886
  280   2HG2  THR  37          2HG2      THR  37  -9.907   0.426  -0.748
  281   3HG2  THR  37          3HG2      THR  37 -10.545  -1.194  -1.030
  282    HA   PRO  38           HA       PRO  38  -6.490   1.522  -6.430
  283   1HB   PRO  38          2HB       PRO  38  -4.543   2.949  -5.116
  284   2HB   PRO  38          1HB       PRO  38  -5.980   3.687  -5.845
  285   1HG   PRO  38          2HG       PRO  38  -5.379   3.192  -2.965
  286   2HG   PRO  38          1HG       PRO  38  -6.415   4.428  -3.699
  287   1HD   PRO  38          2HD       PRO  38  -7.302   2.044  -2.462
  288   2HD   PRO  38          1HD       PRO  38  -8.280   3.115  -3.488
  289    H    PHE  39           H        PHE  39  -4.274   0.711  -6.829
  290    HA   PHE  39           HA       PHE  39  -3.691  -1.733  -5.435
  291   1HB   PHE  39          2HB       PHE  39  -3.039  -0.936  -7.867
  292   2HB   PHE  39          1HB       PHE  39  -1.593  -0.329  -7.060
  293    HD1  PHE  39           HD1      PHE  39   0.212  -1.788  -7.256
  294    HD2  PHE  39           HD2      PHE  39  -3.730  -3.410  -6.721
  295    HE1  PHE  39           HE1      PHE  39   1.157  -4.079  -7.233
  296    HE2  PHE  39           HE2      PHE  39  -2.783  -5.702  -6.698
  297    HZ   PHE  39           HZ       PHE  39  -0.340  -6.036  -6.954
  298    H    THR  40           H        THR  40  -2.883   1.555  -4.736
  299    HA   THR  40           HA       THR  40  -0.397   1.200  -3.358
  300    HB   THR  40           HB       THR  40  -1.213   3.253  -2.023
  301    HG1  THR  40           HG1      THR  40  -3.202   3.813  -2.293
  302   1HG2  THR  40          1HG2      THR  40  -1.457   3.819  -4.944
  303   2HG2  THR  40          2HG2      THR  40   0.040   3.087  -4.363
  304   3HG2  THR  40          3HG2      THR  40  -0.493   4.639  -3.715
  305    H    ALA  41           H        ALA  41  -3.787   1.019  -2.265
  306    HA   ALA  41           HA       ALA  41  -3.093   0.307   0.469
  307   1HB   ALA  41          1HB       ALA  41  -5.712  -0.014  -1.031
  308   2HB   ALA  41          2HB       ALA  41  -5.240   1.403  -0.092
  309   3HB   ALA  41          3HB       ALA  41  -5.504  -0.143   0.716
  310    H    VAL  42           H        VAL  42  -4.062  -1.494  -2.458
  311    HA   VAL  42           HA       VAL  42  -4.293  -4.074  -1.229
  312    HB   VAL  42           HB       VAL  42  -3.448  -3.365  -4.061
  313   1HG1  VAL  42          1HG1      VAL  42  -4.642  -5.948  -3.014
  314   2HG1  VAL  42          2HG1      VAL  42  -2.917  -5.717  -3.305
  315   3HG1  VAL  42          3HG1      VAL  42  -4.058  -5.628  -4.648
  316   1HG2  VAL  42          1HG2      VAL  42  -5.588  -2.640  -4.216
  317   2HG2  VAL  42          2HG2      VAL  42  -6.001  -3.298  -2.631
  318   3HG2  VAL  42          3HG2      VAL  42  -6.063  -4.333  -4.059
  319    H    LEU  43           H        LEU  43  -1.537  -2.575  -2.947
  320    HA   LEU  43           HA       LEU  43   0.355  -4.652  -2.484
  321   1HB   LEU  43          2HB       LEU  43   0.506  -2.559  -4.023
  322   2HB   LEU  43          1HB       LEU  43   1.115  -1.735  -2.587
  323    HG   LEU  43           HG       LEU  43   2.370  -4.355  -3.090
  324   1HD1  LEU  43          1HD1      LEU  43   2.251  -2.266  -5.193
  325   2HD1  LEU  43          2HD1      LEU  43   2.578  -3.994  -5.337
  326   3HD1  LEU  43          3HD1      LEU  43   3.860  -2.892  -4.833
  327   1HD2  LEU  43          1HD2      LEU  43   4.417  -2.859  -2.733
  328   2HD2  LEU  43          2HD2      LEU  43   3.280  -2.946  -1.388
  329   3HD2  LEU  43          3HD2      LEU  43   3.280  -1.538  -2.452
  330    H    LYS  44           H        LYS  44  -0.643  -1.905  -0.475
  331    HA   LYS  44           HA       LYS  44   1.455  -2.151   1.483
  332   1HB   LYS  44          2HB       LYS  44  -0.589  -0.355   1.021
  333   2HB   LYS  44          1HB       LYS  44  -1.130  -1.168   2.491
  334   1HG   LYS  44          2HG       LYS  44   1.160  -0.756   3.465
  335   2HG   LYS  44          1HG       LYS  44   1.526   0.224   2.045
  336   1HD   LYS  44          2HD       LYS  44   0.665   1.950   3.236
  337   2HD   LYS  44          1HD       LYS  44  -0.908   1.249   2.854
  338   1HE   LYS  44          2HE       LYS  44  -1.057   0.151   4.937
  339   2HE   LYS  44          1HE       LYS  44   0.674   0.298   5.240
  340   1HZ   LYS  44          1HZ       LYS  44  -0.370   1.911   6.575
  341   2HZ   LYS  44          2HZ       LYS  44  -1.377   2.435   5.309
  342   3HZ   LYS  44          3HZ       LYS  44   0.289   2.771   5.268
  343    H    PHE  45           H        PHE  45  -1.870  -3.450   1.332
  344    HA   PHE  45           HA       PHE  45  -1.857  -4.745   3.874
  345   1HB   PHE  45          2HB       PHE  45  -3.499  -4.785   1.446
  346   2HB   PHE  45          1HB       PHE  45  -3.451  -6.347   2.264
  347    HD1  PHE  45           HD1      PHE  45  -4.608  -2.890   2.427
  348    HD2  PHE  45           HD2      PHE  45  -4.115  -6.524   4.669
  349    HE1  PHE  45           HE1      PHE  45  -6.162  -2.035   4.159
  350    HE2  PHE  45           HE2      PHE  45  -5.670  -5.666   6.397
  351    HZ   PHE  45           HZ       PHE  45  -6.691  -3.423   6.143
  352    H    ALA  46           H        ALA  46  -0.866  -5.923   0.646
  353    HA   ALA  46           HA       ALA  46  -0.218  -8.596   1.534
  354   1HB   ALA  46          1HB       ALA  46  -0.524  -7.546  -0.906
  355   2HB   ALA  46          2HB       ALA  46   0.490  -8.965  -0.638
  356   3HB   ALA  46          3HB       ALA  46   1.228  -7.369  -0.781
  357    H    ALA  47           H        ALA  47   1.733  -5.645   1.022
  358    HA   ALA  47           HA       ALA  47   4.263  -6.785   1.725
  359   1HB   ALA  47          1HB       ALA  47   3.841  -4.532   0.602
  360   2HB   ALA  47          2HB       ALA  47   5.064  -4.536   1.873
  361   3HB   ALA  47          3HB       ALA  47   3.449  -3.909   2.206
  362    H    GLU  48           H        GLU  48   1.661  -5.392   3.688
  363    HA   GLU  48           HA       GLU  48   3.057  -5.140   6.158
  364   1HB   GLU  48          2HB       GLU  48   0.398  -4.843   5.268
  365   2HB   GLU  48          1HB       GLU  48   0.331  -6.042   6.561
  366   1HG   GLU  48          2HG       GLU  48   1.409  -4.559   8.112
  367   2HG   GLU  48          1HG       GLU  48   1.812  -3.413   6.831
  368    H    GLU  49           H        GLU  49   1.153  -7.888   4.876
  369    HA   GLU  49           HA       GLU  49   1.704  -9.652   7.090
  370   1HB   GLU  49          2HB       GLU  49  -0.171 -10.002   5.501
  371   2HB   GLU  49          1HB       GLU  49   0.988 -10.325   4.214
  372   1HG   GLU  49          2HG       GLU  49   1.432 -11.942   6.639
  373   2HG   GLU  49          1HG       GLU  49  -0.118 -12.246   5.856
  374    H    PHE  50           H        PHE  50   3.258  -9.134   3.933
  375    HA   PHE  50           HA       PHE  50   5.189 -11.263   4.236
  376   1HB   PHE  50          2HB       PHE  50   4.912  -8.895   2.397
  377   2HB   PHE  50          1HB       PHE  50   6.367  -9.890   2.369
  378    HD1  PHE  50           HD1      PHE  50   3.486  -9.455   0.633
  379    HD2  PHE  50           HD2      PHE  50   5.531 -12.592   2.739
  380    HE1  PHE  50           HE1      PHE  50   2.284 -11.150  -0.719
  381    HE2  PHE  50           HE2      PHE  50   4.329 -14.284   1.385
  382    HZ   PHE  50           HZ       PHE  50   2.705 -13.563  -0.342
  383    H    LYS  51           H        LYS  51   4.967  -8.250   5.785
  384    HA   LYS  51           HA       LYS  51   6.434  -7.127   7.213
  385   1HB   LYS  51          2HB       LYS  51   7.461  -9.846   7.073
  386   2HB   LYS  51          1HB       LYS  51   8.775  -8.687   7.265
  387   1HG   LYS  51          2HG       LYS  51   8.201  -8.264   9.407
  388   2HG   LYS  51          1HG       LYS  51   6.509  -8.019   8.972
  389   1HD   LYS  51          2HD       LYS  51   7.027 -10.802   8.702
  390   2HD   LYS  51          1HD       LYS  51   7.722 -10.303  10.245
  391   1HE   LYS  51          2HE       LYS  51   5.659 -10.260  11.145
  392   2HE   LYS  51          1HE       LYS  51   5.203  -8.995  10.006
  393   1HZ   LYS  51          1HZ       LYS  51   4.127 -10.444   8.689
  394   2HZ   LYS  51          2HZ       LYS  51   4.059 -11.403  10.092
  395   3HZ   LYS  51          3HZ       LYS  51   5.258 -11.690   8.922
  396    H    VAL  52           H        VAL  52   6.383  -6.428   4.488
  397    HA   VAL  52           HA       VAL  52   9.192  -5.480   4.111
  398    HB   VAL  52           HB       VAL  52   8.850  -5.695   1.636
  399   1HG1  VAL  52          1HG1      VAL  52  10.117  -7.428   2.711
  400   2HG1  VAL  52          2HG1      VAL  52   8.996  -8.225   1.607
  401   3HG1  VAL  52          3HG1      VAL  52   8.655  -8.192   3.338
  402   1HG2  VAL  52          1HG2      VAL  52   6.658  -5.876   1.038
  403   2HG2  VAL  52          2HG2      VAL  52   6.194  -6.591   2.583
  404   3HG2  VAL  52          3HG2      VAL  52   6.911  -7.597   1.325
  405    HA   PRO  53           HA       PRO  53   7.362  -1.515   3.539
  406   1HB   PRO  53          2HB       PRO  53   9.175  -0.379   1.809
  407   2HB   PRO  53          1HB       PRO  53   9.493  -0.643   3.533
  408   1HG   PRO  53          2HG       PRO  53  10.536  -2.152   1.181
  409   2HG   PRO  53          1HG       PRO  53  11.259  -1.932   2.782
  410   1HD   PRO  53          2HD       PRO  53   9.912  -4.246   1.881
  411   2HD   PRO  53          1HD       PRO  53  10.330  -3.873   3.567
  412    H    ALA  54           H        ALA  54   5.690  -0.788   2.262
  413    HA   ALA  54           HA       ALA  54   5.120  -2.073  -0.291
  414   1HB   ALA  54          1HB       ALA  54   3.017  -1.300   0.044
  415   2HB   ALA  54          2HB       ALA  54   3.577   0.348   0.331
  416   3HB   ALA  54          3HB       ALA  54   3.590  -0.829   1.645
  417    H    ALA  55           H        ALA  55   6.329   1.107   0.722
  418    HA   ALA  55           HA       ALA  55   6.183   2.312  -1.906
  419   1HB   ALA  55          1HB       ALA  55   7.499   3.004   0.701
  420   2HB   ALA  55          2HB       ALA  55   6.301   3.915  -0.226
  421   3HB   ALA  55          3HB       ALA  55   7.984   3.871  -0.762
  422    H    THR  56           H        THR  56   8.704   0.526  -0.149
  423    HA   THR  56           HA       THR  56  10.675   1.001  -2.289
  424    HB   THR  56           HB       THR  56  10.947  -0.895   0.053
  425    HG1  THR  56           HG1      THR  56  11.186   0.762   1.307
  426   1HG2  THR  56          1HG2      THR  56  13.301   0.577  -0.700
  427   2HG2  THR  56          2HG2      THR  56  12.609  -0.194  -2.130
  428   3HG2  THR  56          3HG2      THR  56  13.035  -1.167  -0.721
  429    H    SER  57           H        SER  57   8.803  -1.763  -0.998
  430    HA   SER  57           HA       SER  57   9.878  -3.604  -2.994
  431   1HB   SER  57          2HB       SER  57   8.970  -4.187  -0.646
  432   2HB   SER  57          1HB       SER  57   7.374  -4.069  -1.379
  433    HG   SER  57           HG       SER  57   8.732  -6.174  -1.366
  434    H    ALA  58           H        ALA  58   8.601  -4.643  -4.645
  435    HA   ALA  58           HA       ALA  58   6.235  -3.072  -5.591
  436   1HB   ALA  58          1HB       ALA  58   7.197  -3.780  -7.946
  437   2HB   ALA  58          2HB       ALA  58   8.724  -3.883  -7.068
  438   3HB   ALA  58          3HB       ALA  58   7.840  -2.356  -7.127
  439    H    ILE  59           H        ILE  59   4.999  -4.424  -7.319
  440    HA   ILE  59           HA       ILE  59   5.088  -7.317  -6.541
  441    HB   ILE  59           HB       ILE  59   2.762  -5.428  -6.815
  442   1HG1  ILE  59          2HG1      ILE  59   3.365  -7.722  -4.918
  443   2HG1  ILE  59          1HG1      ILE  59   3.736  -6.029  -4.592
  444   1HG2  ILE  59          1HG2      ILE  59   1.904  -7.011  -8.282
  445   2HG2  ILE  59          2HG2      ILE  59   1.410  -7.712  -6.741
  446   3HG2  ILE  59          3HG2      ILE  59   2.838  -8.330  -7.572
  447   1HD1  ILE  59          1HD1      ILE  59   1.438  -7.169  -3.788
  448   2HD1  ILE  59          2HD1      ILE  59   0.937  -6.662  -5.402
  449   3HD1  ILE  59          3HD1      ILE  59   1.532  -5.468  -4.248
  450    H    ILE  60           H        ILE  60   5.610  -8.568  -8.268
  451    HA   ILE  60           HA       ILE  60   5.154  -7.478 -11.000
  452    HB   ILE  60           HB       ILE  60   6.660  -9.317 -11.749
  453   1HG1  ILE  60          2HG1      ILE  60   7.600  -9.899  -9.012
  454   2HG1  ILE  60          1HG1      ILE  60   5.987 -10.520  -9.365
  455   1HG2  ILE  60          1HG2      ILE  60   8.191  -7.693 -11.486
  456   2HG2  ILE  60          2HG2      ILE  60   8.532  -8.350  -9.884
  457   3HG2  ILE  60          3HG2      ILE  60   7.347  -7.056 -10.073
  458   1HD1  ILE  60          1HD1      ILE  60   8.499 -11.028 -10.984
  459   2HD1  ILE  60          2HD1      ILE  60   6.885 -11.571 -11.444
  460   3HD1  ILE  60          3HD1      ILE  60   7.645 -12.201  -9.982
  461    H    THR  61           H        THR  61   4.615  -9.352 -12.657
  462    HA   THR  61           HA       THR  61   2.226 -10.764 -11.567
  463    HB   THR  61           HB       THR  61   1.523 -10.963 -13.938
  464    HG1  THR  61           HG1      THR  61   2.821 -10.398 -15.512
  465   1HG2  THR  61          1HG2      THR  61   0.953  -8.659 -14.257
  466   2HG2  THR  61          2HG2      THR  61   2.348  -8.119 -13.323
  467   3HG2  THR  61          3HG2      THR  61   1.005  -8.929 -12.515
  468    H    ASN  62           H        ASN  62   1.787 -12.933 -12.773
  469    HA   ASN  62           HA       ASN  62   3.957 -14.741 -12.212
  470   1HB   ASN  62          2HB       ASN  62   1.231 -14.975 -13.429
  471   2HB   ASN  62          1HB       ASN  62   2.365 -16.305 -13.669
  472   1HD2  ASN  62          1HD2      ASN  62   2.456 -17.815 -11.988
  473   2HD2  ASN  62          2HD2      ASN  62   1.909 -17.537 -10.406
  474    H    ASP  63           H        ASP  63   2.997 -12.983 -15.085
  475    HA   ASP  63           HA       ASP  63   4.543 -14.641 -16.935
  476   1HB   ASP  63          2HB       ASP  63   2.856 -12.205 -17.092
  477   2HB   ASP  63          1HB       ASP  63   4.166 -12.294 -18.269
  478    H    GLY  64           H        GLY  64   4.898 -11.276 -15.726
  479   1HA   GLY  64          2HA       GLY  64   7.424 -11.133 -14.820
  480   2HA   GLY  64          1HA       GLY  64   7.739 -11.279 -16.549
  481    H    VAL  65           H        VAL  65   5.310  -9.459 -14.640
  482    HA   VAL  65           HA       VAL  65   6.233  -6.971 -16.030
  483    HB   VAL  65           HB       VAL  65   3.385  -7.700 -15.258
  484   1HG1  VAL  65          1HG1      VAL  65   4.400  -5.351 -16.882
  485   2HG1  VAL  65          2HG1      VAL  65   4.022  -5.253 -15.161
  486   3HG1  VAL  65          3HG1      VAL  65   2.750  -5.632 -16.324
  487   1HG2  VAL  65          1HG2      VAL  65   4.556  -8.858 -17.295
  488   2HG2  VAL  65          2HG2      VAL  65   4.404  -7.278 -18.064
  489   3HG2  VAL  65          3HG2      VAL  65   2.962  -8.141 -17.528
  490    H    GLY  66           H        GLY  66   7.062  -5.577 -14.555
  491   1HA   GLY  66          2HA       GLY  66   6.682  -5.940 -11.703
  492   2HA   GLY  66          1HA       GLY  66   7.582  -4.632 -12.464
  493    H    VAL  67           H        VAL  67   4.376  -5.707 -11.505
  494    HA   VAL  67           HA       VAL  67   2.980  -3.296 -12.290
  495    HB   VAL  67           HB       VAL  67   2.167  -5.267 -10.130
  496   1HG1  VAL  67          1HG1      VAL  67  -0.089  -4.527 -10.649
  497   2HG1  VAL  67          2HG1      VAL  67   0.506  -3.517 -11.969
  498   3HG1  VAL  67          3HG1      VAL  67   0.900  -3.109 -10.297
  499   1HG2  VAL  67          1HG2      VAL  67   2.164  -5.450 -13.117
  500   2HG2  VAL  67          2HG2      VAL  67   0.767  -6.094 -12.253
  501   3HG2  VAL  67          3HG2      VAL  67   2.380  -6.724 -11.914
  502    H    ASN  68           H        ASN  68   2.762  -1.400 -11.198
  503    HA   ASN  68           HA       ASN  68   4.066  -1.187  -8.516
  504   1HB   ASN  68          2HB       ASN  68   3.779   0.692 -10.840
  505   2HB   ASN  68          1HB       ASN  68   3.933   1.363  -9.217
  506   1HD2  ASN  68          1HD2      ASN  68   6.041   1.501  -8.375
  507   2HD2  ASN  68          2HD2      ASN  68   7.395   0.732  -9.051
  508    HA   PRO  69           HA       PRO  69   0.226  -0.031  -6.707
  509   1HB   PRO  69          2HB       PRO  69   1.100   1.724  -4.775
  510   2HB   PRO  69          1HB       PRO  69   1.316  -0.030  -4.674
  511   1HG   PRO  69          2HG       PRO  69   3.331   2.075  -5.292
  512   2HG   PRO  69          1HG       PRO  69   3.569   0.468  -4.588
  513   1HD   PRO  69          2HD       PRO  69   4.071   1.199  -7.280
  514   2HD   PRO  69          1HD       PRO  69   4.007  -0.456  -6.638
  515    H    ALA  70           H        ALA  70   0.035   1.207  -8.975
  516    HA   ALA  70           HA       ALA  70  -0.534   4.079  -8.354
  517   1HB   ALA  70          1HB       ALA  70   0.343   3.168 -11.091
  518   2HB   ALA  70          2HB       ALA  70   1.529   3.590  -9.853
  519   3HB   ALA  70          3HB       ALA  70   0.365   4.795 -10.408
  520    H    GLN  71           H        GLN  71  -1.444   1.183 -10.197
  521    HA   GLN  71           HA       GLN  71  -3.813   2.494 -11.352
  522   1HB   GLN  71          2HB       GLN  71  -2.813  -0.369 -11.413
  523   2HB   GLN  71          1HB       GLN  71  -4.268   0.180 -12.244
  524   1HG   GLN  71          2HG       GLN  71  -3.022   0.904 -13.968
  525   2HG   GLN  71          1HG       GLN  71  -2.146   1.988 -12.887
  526   1HE2  GLN  71          1HE2      GLN  71  -0.070   1.275 -12.054
  527   2HE2  GLN  71          2HE2      GLN  71   0.710  -0.108 -12.655
  528    HA   PRO  72           HA       PRO  72  -6.673   1.265  -8.227
  529   1HB   PRO  72          2HB       PRO  72  -8.927   0.885  -9.756
  530   2HB   PRO  72          1HB       PRO  72  -8.269   2.482  -9.358
  531   1HG   PRO  72          2HG       PRO  72  -8.161   0.998 -11.940
  532   2HG   PRO  72          1HG       PRO  72  -8.096   2.743 -11.645
  533   1HD   PRO  72          2HD       PRO  72  -5.883   1.075 -12.229
  534   2HD   PRO  72          1HD       PRO  72  -5.805   2.743 -11.623
  535    H    ALA  73           H        ALA  73  -7.858  -0.587  -7.382
  536    HA   ALA  73           HA       ALA  73  -6.784  -3.140  -7.953
  537   1HB   ALA  73          1HB       ALA  73  -8.672  -4.035  -6.612
  538   2HB   ALA  73          2HB       ALA  73  -9.458  -2.458  -6.694
  539   3HB   ALA  73          3HB       ALA  73  -7.925  -2.635  -5.841
  540    H    GLY  74           H        GLY  74  -9.814  -1.661  -9.140
  541   1HA   GLY  74          2HA       GLY  74 -10.861  -3.910 -10.514
  542   2HA   GLY  74          1HA       GLY  74 -11.172  -2.234 -10.966
  543    H    ASN  75           H        ASN  75  -8.557  -1.418 -11.640
  544    HA   ASN  75           HA       ASN  75  -8.312  -2.504 -14.314
  545   1HB   ASN  75          2HB       ASN  75  -7.496  -0.179 -13.043
  546   2HB   ASN  75          1HB       ASN  75  -5.977  -1.032 -13.318
  547   1HD2  ASN  75          1HD2      ASN  75  -8.929   0.100 -15.033
  548   2HD2  ASN  75          2HD2      ASN  75  -8.180   0.227 -16.551
  549    H    ILE  76           H        ILE  76  -6.470  -2.930 -11.295
  550    HA   ILE  76           HA       ILE  76  -4.300  -4.446 -12.372
  551    HB   ILE  76           HB       ILE  76  -5.588  -4.577  -9.623
  552   1HG1  ILE  76          2HG1      ILE  76  -4.672  -2.347 -10.340
  553   2HG1  ILE  76          1HG1      ILE  76  -3.831  -3.034  -8.953
  554   1HG2  ILE  76          1HG2      ILE  76  -4.256  -6.382  -9.330
  555   2HG2  ILE  76          2HG2      ILE  76  -2.903  -5.251  -9.378
  556   3HG2  ILE  76          3HG2      ILE  76  -3.400  -6.095 -10.845
  557   1HD1  ILE  76          1HD1      ILE  76  -2.902  -3.050 -11.839
  558   2HD1  ILE  76          2HD1      ILE  76  -2.104  -3.947 -10.546
  559   3HD1  ILE  76          3HD1      ILE  76  -2.164  -2.185 -10.489
  560    H    PHE  77           H        PHE  77  -7.495  -5.455 -11.156
  561    HA   PHE  77           HA       PHE  77  -7.003  -8.293 -11.558
  562   1HB   PHE  77          2HB       PHE  77  -8.706  -7.226  -9.966
  563   2HB   PHE  77          1HB       PHE  77  -9.705  -6.945 -11.392
  564    HD1  PHE  77           HD1      PHE  77 -10.736  -8.792 -12.601
  565    HD2  PHE  77           HD2      PHE  77  -8.234  -9.509  -9.183
  566    HE1  PHE  77           HE1      PHE  77 -11.553 -11.130 -12.494
  567    HE2  PHE  77           HE2      PHE  77  -9.051 -11.849  -9.078
  568    HZ   PHE  77           HZ       PHE  77 -10.710 -12.659 -10.733
  569    H    LEU  78           H        LEU  78  -8.466  -5.691 -13.471
  570    HA   LEU  78           HA       LEU  78  -9.598  -7.359 -15.519
  571   1HB   LEU  78          2HB       LEU  78  -9.193  -4.512 -15.045
  572   2HB   LEU  78          1HB       LEU  78  -8.915  -4.929 -16.734
  573    HG   LEU  78           HG       LEU  78 -11.294  -4.346 -16.267
  574   1HD1  LEU  78          1HD1      LEU  78 -10.813  -5.825 -18.133
  575   2HD1  LEU  78          2HD1      LEU  78 -12.266  -6.406 -17.318
  576   3HD1  LEU  78          3HD1      LEU  78 -10.722  -7.219 -17.055
  577   1HD2  LEU  78          1HD2      LEU  78 -12.572  -6.245 -15.038
  578   2HD2  LEU  78          2HD2      LEU  78 -11.683  -5.080 -14.056
  579   3HD2  LEU  78          3HD2      LEU  78 -10.998  -6.675 -14.369
  580    H    LYS  79           H        LYS  79  -6.364  -5.949 -15.096
  581    HA   LYS  79           HA       LYS  79  -5.529  -6.930 -17.760
  582   1HB   LYS  79          2HB       LYS  79  -4.612  -4.902 -15.898
  583   2HB   LYS  79          1HB       LYS  79  -3.281  -5.962 -16.362
  584   1HG   LYS  79          2HG       LYS  79  -3.832  -5.607 -18.744
  585   2HG   LYS  79          1HG       LYS  79  -5.157  -4.538 -18.276
  586   1HD   LYS  79          2HD       LYS  79  -2.540  -3.863 -17.062
  587   2HD   LYS  79          1HD       LYS  79  -2.603  -3.683 -18.819
  588   1HE   LYS  79          2HE       LYS  79  -3.834  -1.805 -18.628
  589   2HE   LYS  79          1HE       LYS  79  -5.031  -2.640 -17.635
  590   1HZ   LYS  79          1HZ       LYS  79  -3.071  -2.347 -15.870
  591   2HZ   LYS  79          2HZ       LYS  79  -4.302  -1.198 -16.092
  592   3HZ   LYS  79          3HZ       LYS  79  -2.789  -0.979 -16.830
  593    H    HIS  80           H        HIS  80  -4.486  -7.380 -14.349
  594    HA   HIS  80           HA       HIS  80  -3.000  -9.814 -15.176
  595   1HB   HIS  80          2HB       HIS  80  -3.129  -8.659 -12.384
  596   2HB   HIS  80          1HB       HIS  80  -1.882  -9.693 -13.081
  597    HD1  HIS  80           HD1      HIS  80  -0.952  -8.393 -15.525
  598    HD2  HIS  80           HD2      HIS  80  -2.145  -6.092 -12.260
  599    HE1  HIS  80           HE1      HIS  80   0.108  -6.114 -15.829
  600    H    GLY  81           H        GLY  81  -5.326  -8.934 -12.582
  601   1HA   GLY  81          2HA       GLY  81  -7.340 -10.225 -12.141
  602   2HA   GLY  81          1HA       GLY  81  -6.580 -11.618 -12.911
  603    H    SER  82           H        SER  82  -5.710 -13.120 -11.560
  604    HA   SER  82           HA       SER  82  -5.038 -12.264  -8.770
  605   1HB   SER  82          2HB       SER  82  -6.968 -14.150  -9.614
  606   2HB   SER  82          1HB       SER  82  -5.629 -15.090  -8.963
  607    HG   SER  82           HG       SER  82  -6.939 -14.533  -7.260
  608    H    GLU  83           H        GLU  83  -3.210 -12.356 -11.056
  609    HA   GLU  83           HA       GLU  83  -1.391 -14.547 -10.131
  610   1HB   GLU  83          2HB       GLU  83  -2.040 -13.544 -12.882
  611   2HB   GLU  83          1HB       GLU  83  -0.410 -14.139 -12.564
  612   1HG   GLU  83          2HG       GLU  83  -1.152 -16.255 -12.747
  613   2HG   GLU  83          1HG       GLU  83  -2.235 -15.985 -11.380
  614    H    LEU  84           H        LEU  84  -0.509 -13.054  -8.561
  615    HA   LEU  84           HA       LEU  84   1.363 -11.067  -9.778
  616   1HB   LEU  84          2HB       LEU  84  -0.401 -10.687  -7.342
  617   2HB   LEU  84          1HB       LEU  84   0.928  -9.610  -7.765
  618    HG   LEU  84           HG       LEU  84  -1.205 -10.256  -9.791
  619   1HD1  LEU  84          1HD1      LEU  84  -1.724  -9.010  -7.308
  620   2HD1  LEU  84          2HD1      LEU  84  -2.773  -9.044  -8.726
  621   3HD1  LEU  84          3HD1      LEU  84  -1.642  -7.709  -8.497
  622   1HD2  LEU  84          1HD2      LEU  84   0.914  -9.105 -10.453
  623   2HD2  LEU  84          2HD2      LEU  84   0.529  -7.810  -9.319
  624   3HD2  LEU  84          3HD2      LEU  84  -0.514  -8.101 -10.712
  625    H    ARG  85           H        ARG  85   3.054 -10.398  -8.043
  626    HA   ARG  85           HA       ARG  85   3.696 -12.512  -6.080
  627   1HB   ARG  85          2HB       ARG  85   5.117 -12.121  -8.662
  628   2HB   ARG  85          1HB       ARG  85   6.136 -12.329  -7.238
  629   1HG   ARG  85          2HG       ARG  85   5.696 -14.534  -7.175
  630   2HG   ARG  85          1HG       ARG  85   3.960 -14.231  -7.176
  631   1HD   ARG  85          2HD       ARG  85   3.847 -14.982  -9.291
  632   2HD   ARG  85          1HD       ARG  85   4.907 -13.668  -9.800
  633    HE   ARG  85           HE       ARG  85   6.671 -15.531  -8.786
  634   1HH1  ARG  85          2HH1      ARG  85   4.377 -17.426  -9.648
  635   2HH1  ARG  85          1HH1      ARG  85   4.924 -17.887 -11.227
  636   1HH2  ARG  85          1HH2      ARG  85   7.279 -15.335 -11.443
  637   2HH2  ARG  85          2HH2      ARG  85   6.574 -16.703 -12.240
  638    H    LEU  86           H        LEU  86   5.412 -11.818  -4.591
  639    HA   LEU  86           HA       LEU  86   5.625  -8.845  -4.480
  640   1HB   LEU  86          2HB       LEU  86   4.692 -10.300  -2.532
  641   2HB   LEU  86          1HB       LEU  86   6.383 -10.701  -2.234
  642    HG   LEU  86           HG       LEU  86   6.401  -7.933  -2.603
  643   1HD1  LEU  86          1HD1      LEU  86   3.768  -8.534  -2.106
  644   2HD1  LEU  86          2HD1      LEU  86   4.533  -6.994  -1.711
  645   3HD1  LEU  86          3HD1      LEU  86   4.380  -8.244  -0.477
  646   1HD2  LEU  86          1HD2      LEU  86   7.221  -9.821  -0.726
  647   2HD2  LEU  86          2HD2      LEU  86   6.152  -8.762   0.191
  648   3HD2  LEU  86          3HD2      LEU  86   7.544  -8.087  -0.657
  649    H    ILE  87           H        ILE  87   7.526  -7.936  -5.000
  650    HA   ILE  87           HA       ILE  87  10.057  -9.433  -4.524
  651    HB   ILE  87           HB       ILE  87   9.567  -9.824  -6.868
  652   1HG1  ILE  87          2HG1      ILE  87  11.544  -7.526  -6.710
  653   2HG1  ILE  87          1HG1      ILE  87  11.918  -9.181  -6.231
  654   1HG2  ILE  87          1HG2      ILE  87   9.601  -7.259  -8.042
  655   2HG2  ILE  87          2HG2      ILE  87   8.468  -7.152  -6.696
  656   3HG2  ILE  87          3HG2      ILE  87   8.235  -8.369  -7.949
  657   1HD1  ILE  87          1HD1      ILE  87  11.508  -9.993  -8.474
  658   2HD1  ILE  87          2HD1      ILE  87  12.613  -8.623  -8.586
  659   3HD1  ILE  87          3HD1      ILE  87  10.907  -8.414  -8.983
  660    HA   PRO  88           HA       PRO  88  11.093  -5.462  -2.845
  661   1HB   PRO  88          2HB       PRO  88  13.754  -6.000  -2.378
  662   2HB   PRO  88          1HB       PRO  88  12.436  -6.575  -1.344
  663   1HG   PRO  88          2HG       PRO  88  14.056  -8.094  -3.343
  664   2HG   PRO  88          1HG       PRO  88  13.262  -8.673  -1.867
  665   1HD   PRO  88          2HD       PRO  88  12.282  -9.022  -4.480
  666   2HD   PRO  88          1HD       PRO  88  11.330  -9.203  -2.991
  667    H    ARG  89           H        ARG  89  11.100  -3.858  -4.403
  668    HA   ARG  89           HA       ARG  89  12.946  -3.943  -6.682
  669   1HB   ARG  89          2HB       ARG  89  10.477  -2.947  -6.496
  670   2HB   ARG  89          1HB       ARG  89  11.362  -1.493  -6.031
  671   1HG   ARG  89          2HG       ARG  89  12.721  -1.655  -8.079
  672   2HG   ARG  89          1HG       ARG  89  11.841  -3.110  -8.550
  673   1HD   ARG  89          2HD       ARG  89   9.721  -1.593  -8.259
  674   2HD   ARG  89          1HD       ARG  89  10.873  -0.268  -8.437
  675    HE   ARG  89           HE       ARG  89  11.511  -1.796 -10.587
  676   1HH1  ARG  89          1HH2      ARG  89   8.913  -3.177 -10.570
  677   2HH1  ARG  89          2HH2      ARG  89   7.901  -2.129 -11.509
  678   1HH2  ARG  89          2HH1      ARG  89  10.039   0.606 -11.229
  679   2HH2  ARG  89          1HH1      ARG  89   8.544   0.026 -11.883
  680    H    ASP  90           H        ASP  90  14.992  -3.818  -5.593
  681    HA   ASP  90           HA       ASP  90  15.645  -1.064  -4.629
  682   1HB   ASP  90          2HB       ASP  90  16.508  -3.704  -3.409
  683   2HB   ASP  90          1HB       ASP  90  17.250  -2.155  -3.011
  684    H    ARG  91           H        ARG  91  17.071  -4.170  -5.722
  685    HA   ARG  91           HA       ARG  91  19.349  -2.675  -6.905
  686   1HB   ARG  91          2HB       ARG  91  19.299  -5.050  -5.566
  687   2HB   ARG  91          1HB       ARG  91  19.196  -5.617  -7.233
  688   1HG   ARG  91          2HG       ARG  91  21.133  -3.727  -7.491
  689   2HG   ARG  91          1HG       ARG  91  21.430  -4.256  -5.835
  690   1HD   ARG  91          2HD       ARG  91  22.096  -6.351  -6.476
  691   2HD   ARG  91          1HD       ARG  91  20.964  -6.413  -7.829
  692    HE   ARG  91           HE       ARG  91  23.619  -5.047  -7.887
  693   1HH1  ARG  91          2HH1      ARG  91  22.431  -7.574  -9.417
  694   2HH1  ARG  91          1HH1      ARG  91  22.349  -6.903 -11.011
  695   1HH2  ARG  91          1HH2      ARG  91  22.825  -3.631  -9.952
  696   2HH2  ARG  91          2HH2      ARG  91  22.572  -4.671 -11.314
  697    H    VAL  92           H        VAL  92  16.965  -5.158  -7.906
  698    HA   VAL  92           HA       VAL  92  17.486  -4.524 -10.747
  699    HB   VAL  92           HB       VAL  92  15.956  -6.410 -11.215
  700   1HG1  VAL  92          1HG1      VAL  92  17.355  -8.179 -10.249
  701   2HG1  VAL  92          2HG1      VAL  92  17.999  -7.043  -9.063
  702   3HG1  VAL  92          3HG1      VAL  92  18.360  -6.829 -10.777
  703   1HG2  VAL  92          1HG2      VAL  92  15.714  -6.560  -8.189
  704   2HG2  VAL  92          2HG2      VAL  92  15.061  -7.738  -9.327
  705   3HG2  VAL  92          3HG2      VAL  92  14.425  -6.093  -9.300
  706    H    GLY  93           H        GLY  93  15.726  -3.957 -12.211
  707   1HA   GLY  93          2HA       GLY  93  13.806  -2.089 -10.956
  708   2HA   GLY  93          1HA       GLY  93  14.148  -2.217 -12.683
  709    H    HIS  94           HN       HIS  94  12.819  -4.258 -10.056
  710    HA   HIS  94           HA       HIS  94  10.480  -4.878 -11.757
  711   1HB   HIS  94          2HB       HIS  94  12.668  -6.638 -11.630
  712   2HB   HIS  94          1HB       HIS  94  11.471  -7.326 -10.535
  713    HD1  HIS  94           HD1      HIS  94  11.353  -9.222 -12.509
  714    HD2  HIS  94           HD2      HIS  94   9.757  -5.484 -13.432
  715    HE1  HIS  94           HE1      HIS  94   9.870  -9.555 -14.535
  Start of MODEL   19
    1   1H    MET   1          1H        MET   1 -19.017  -6.600   1.267
    2   2H    MET   1          2H        MET   1 -19.356  -4.937   1.192
    3   3H    MET   1          3H        MET   1 -20.510  -6.066   0.663
    4    HA   MET   1           HA       MET   1 -21.058  -5.136   2.858
    5   1HB   MET   1          2HB       MET   1 -20.653  -8.009   2.260
    6   2HB   MET   1          1HB       MET   1 -20.834  -7.625   3.970
    7   1HG   MET   1          2HG       MET   1 -22.959  -6.608   3.619
    8   2HG   MET   1          1HG       MET   1 -22.746  -6.583   1.872
    9   1HE   MET   1          1HE       MET   1 -23.051  -8.183   0.358
   10   2HE   MET   1          2HE       MET   1 -24.738  -8.149   0.858
   11   3HE   MET   1          3HE       MET   1 -23.949  -9.693   0.551
   12    H    SER   2           H        SER   2 -20.484  -5.059   5.139
   13    HA   SER   2           HA       SER   2 -17.566  -5.483   5.668
   14   1HB   SER   2          2HB       SER   2 -17.746  -3.488   7.211
   15   2HB   SER   2          1HB       SER   2 -17.906  -3.103   5.501
   16    HG   SER   2           HG       SER   2 -19.976  -2.662   5.786
   17    H    GLY   3           H        GLY   3 -17.210  -6.856   7.337
   18   1HA   GLY   3          2HA       GLY   3 -17.522  -8.022   9.352
   19   2HA   GLY   3          1HA       GLY   3 -18.706  -6.794   9.799
   20    H    GLY   4           H        GLY   4 -20.884  -7.218   9.502
   21   1HA   GLY   4          2HA       GLY   4 -21.575 -10.017   8.828
   22   2HA   GLY   4          1HA       GLY   4 -22.637  -8.856   9.621
   23    H    THR   5           H        THR   5 -23.083  -6.833   8.114
   24    HA   THR   5           HA       THR   5 -23.220  -7.497   5.243
   25    HB   THR   5           HB       THR   5 -25.238  -8.594   6.161
   26    HG1  THR   5           HG1      THR   5 -25.505  -7.741   4.146
   27   1HG2  THR   5          1HG2      THR   5 -25.594  -7.269   8.157
   28   2HG2  THR   5          2HG2      THR   5 -27.029  -7.135   7.140
   29   3HG2  THR   5          3HG2      THR   5 -25.859  -5.815   7.195
   30    H    ALA   6           H        ALA   6 -24.380  -5.570   4.057
   31    HA   ALA   6           HA       ALA   6 -24.599  -3.017   5.362
   32   1HB   ALA   6          1HB       ALA   6 -21.936  -3.822   4.875
   33   2HB   ALA   6          2HB       ALA   6 -22.493  -2.213   5.329
   34   3HB   ALA   6          3HB       ALA   6 -22.313  -2.636   3.627
   35    H    ALA   7           H        ALA   7 -23.430  -4.375   2.253
   36    HA   ALA   7           HA       ALA   7 -25.411  -2.627   0.850
   37   1HB   ALA   7          1HB       ALA   7 -23.996  -2.676  -1.058
   38   2HB   ALA   7          2HB       ALA   7 -23.083  -4.056  -0.445
   39   3HB   ALA   7          3HB       ALA   7 -22.897  -2.471   0.307
   40    H    THR   8           H        THR   8 -25.982  -3.818  -1.421
   41    HA   THR   8           HA       THR   8 -27.575  -6.111  -0.717
   42    HB   THR   8           HB       THR   8 -27.883  -6.286  -3.254
   43    HG1  THR   8           HG1      THR   8 -26.416  -5.265  -4.333
   44   1HG2  THR   8          1HG2      THR   8 -29.337  -4.961  -1.661
   45   2HG2  THR   8          2HG2      THR   8 -29.326  -4.367  -3.322
   46   3HG2  THR   8          3HG2      THR   8 -28.379  -3.540  -2.083
   47    H    THR   9           H        THR   9 -27.332  -8.302  -1.365
   48    HA   THR   9           HA       THR   9 -24.609  -9.304  -1.323
   49    HB   THR   9           HB       THR   9 -25.755 -11.544  -1.659
   50    HG1  THR   9           HG1      THR   9 -27.552 -10.778  -2.814
   51   1HG2  THR   9          1HG2      THR   9 -27.284 -11.060   0.514
   52   2HG2  THR   9          2HG2      THR   9 -26.272  -9.616   0.537
   53   3HG2  THR   9          3HG2      THR   9 -25.530 -11.214   0.591
   54    H    ALA  10           H        ALA  10 -23.764  -8.241  -3.296
   55    HA   ALA  10           HA       ALA  10 -24.711  -9.525  -5.827
   56   1HB   ALA  10          1HB       ALA  10 -24.795  -7.005  -5.687
   57   2HB   ALA  10          2HB       ALA  10 -23.825  -7.628  -7.022
   58   3HB   ALA  10          3HB       ALA  10 -23.035  -7.015  -5.568
   59    H    GLY  11           H        GLY  11 -21.730  -8.566  -4.073
   60   1HA   GLY  11          2HA       GLY  11 -19.690  -9.773  -3.967
   61   2HA   GLY  11          1HA       GLY  11 -20.379 -10.970  -5.063
   62    H    SER  12           H        SER  12 -19.482  -7.491  -5.195
   63    HA   SER  12           HA       SER  12 -18.308  -8.020  -7.901
   64   1HB   SER  12          2HB       SER  12 -20.032  -5.880  -6.865
   65   2HB   SER  12          1HB       SER  12 -18.606  -5.269  -7.696
   66    HG   SER  12           HG       SER  12 -20.192  -5.621  -9.218
   67    H    LYS  13           H        LYS  13 -16.453  -8.741  -6.354
   68    HA   LYS  13           HA       LYS  13 -14.709  -6.366  -5.815
   69   1HB   LYS  13          2HB       LYS  13 -14.804  -8.908  -4.160
   70   2HB   LYS  13          1HB       LYS  13 -13.794  -7.497  -3.856
   71   1HG   LYS  13          2HG       LYS  13 -15.822  -6.117  -3.533
   72   2HG   LYS  13          1HG       LYS  13 -16.828  -7.538  -3.813
   73   1HD   LYS  13          2HD       LYS  13 -16.495  -8.315  -1.713
   74   2HD   LYS  13          1HD       LYS  13 -14.759  -8.015  -1.798
   75   1HE   LYS  13          2HE       LYS  13 -15.329  -5.530  -1.498
   76   2HE   LYS  13          1HE       LYS  13 -16.945  -6.071  -1.040
   77   1HZ   LYS  13          1HZ       LYS  13 -16.220  -6.668   0.953
   78   2HZ   LYS  13          2HZ       LYS  13 -14.750  -5.894   0.597
   79   3HZ   LYS  13          3HZ       LYS  13 -14.927  -7.559   0.313
   80    H    VAL  14           H        VAL  14 -12.399  -6.816  -6.024
   81    HA   VAL  14           HA       VAL  14 -11.845  -9.088  -7.890
   82    HB   VAL  14           HB       VAL  14  -9.755  -7.678  -8.444
   83   1HG1  VAL  14          1HG1      VAL  14 -12.472  -6.524  -9.132
   84   2HG1  VAL  14          2HG1      VAL  14 -11.753  -7.931  -9.915
   85   3HG1  VAL  14          3HG1      VAL  14 -10.990  -6.349 -10.071
   86   1HG2  VAL  14          1HG2      VAL  14 -10.046  -6.175  -6.433
   87   2HG2  VAL  14          2HG2      VAL  14 -11.462  -5.485  -7.227
   88   3HG2  VAL  14          3HG2      VAL  14  -9.868  -5.311  -7.958
   89    H    THR  15           H        THR  15 -10.633 -10.715  -7.078
   90    HA   THR  15           HA       THR  15  -9.160 -10.280  -4.527
   91    HB   THR  15           HB       THR  15  -9.758 -12.890  -5.956
   92    HG1  THR  15           HG1      THR  15 -11.680 -12.698  -5.179
   93   1HG2  THR  15          1HG2      THR  15  -9.370 -13.818  -3.657
   94   2HG2  THR  15          2HG2      THR  15  -8.846 -12.212  -3.147
   95   3HG2  THR  15          3HG2      THR  15  -7.932 -13.089  -4.373
   96    H    PHE  16           H        PHE  16  -6.931 -10.498  -4.409
   97    HA   PHE  16           HA       PHE  16  -5.506 -11.165  -6.958
   98   1HB   PHE  16          2HB       PHE  16  -4.603  -9.192  -4.845
   99   2HB   PHE  16          1HB       PHE  16  -3.822  -9.507  -6.392
  100    HD1  PHE  16           HD1      PHE  16  -6.221  -7.484  -4.684
  101    HD2  PHE  16           HD2      PHE  16  -5.287  -9.160  -8.530
  102    HE1  PHE  16           HE1      PHE  16  -7.681  -5.802  -5.775
  103    HE2  PHE  16           HE2      PHE  16  -6.745  -7.476  -9.617
  104    HZ   PHE  16           HZ       PHE  16  -7.942  -5.799  -8.239
  105    H    LYS  17           H        LYS  17  -3.924 -12.681  -6.809
  106    HA   LYS  17           HA       LYS  17  -3.244 -13.739  -4.095
  107   1HB   LYS  17          2HB       LYS  17  -4.310 -15.160  -6.112
  108   2HB   LYS  17          1HB       LYS  17  -2.613 -15.292  -6.570
  109   1HG   LYS  17          2HG       LYS  17  -2.951 -15.720  -3.715
  110   2HG   LYS  17          1HG       LYS  17  -3.950 -16.837  -4.645
  111   1HD   LYS  17          2HD       LYS  17  -1.832 -17.239  -6.074
  112   2HD   LYS  17          1HD       LYS  17  -0.957 -16.474  -4.748
  113   1HE   LYS  17          2HE       LYS  17  -2.325 -18.162  -3.257
  114   2HE   LYS  17          1HE       LYS  17  -2.482 -19.061  -4.765
  115   1HZ   LYS  17          1HZ       LYS  17  -0.257 -19.473  -4.864
  116   2HZ   LYS  17          2HZ       LYS  17  -0.456 -19.431  -3.178
  117   3HZ   LYS  17          3HZ       LYS  17   0.173 -18.080  -3.994
  118    H    ILE  18           H        ILE  18  -1.408 -12.599  -3.528
  119    HA   ILE  18           HA       ILE  18   0.764 -12.334  -5.557
  120    HB   ILE  18           HB       ILE  18   0.582 -10.971  -2.857
  121   1HG1  ILE  18          2HG1      ILE  18   0.076  -9.103  -4.898
  122   2HG1  ILE  18          1HG1      ILE  18  -0.937 -10.491  -5.293
  123   1HG2  ILE  18          1HG2      ILE  18   2.174 -10.419  -5.379
  124   2HG2  ILE  18          2HG2      ILE  18   2.815 -11.016  -3.847
  125   3HG2  ILE  18          3HG2      ILE  18   2.159  -9.382  -3.954
  126   1HD1  ILE  18          1HD1      ILE  18  -0.841  -9.066  -2.617
  127   2HD1  ILE  18          2HD1      ILE  18  -1.830 -10.481  -2.980
  128   3HD1  ILE  18          3HD1      ILE  18  -2.143  -8.951  -3.802
  129    H    THR  19           H        THR  19   2.575 -13.558  -5.350
  130    HA   THR  19           HA       THR  19   2.971 -15.083  -2.808
  131    HB   THR  19           HB       THR  19   4.090 -15.670  -5.571
  132    HG1  THR  19           HG1      THR  19   2.204 -16.490  -5.906
  133   1HG2  THR  19          1HG2      THR  19   5.510 -16.626  -3.895
  134   2HG2  THR  19          2HG2      THR  19   4.482 -17.935  -4.479
  135   3HG2  THR  19          3HG2      THR  19   4.128 -17.158  -2.937
  136    H    LEU  20           H        LEU  20   4.646 -14.413  -1.556
  137    HA   LEU  20           HA       LEU  20   6.438 -12.306  -2.348
  138   1HB   LEU  20          2HB       LEU  20   5.708 -12.944   0.023
  139   2HB   LEU  20          1HB       LEU  20   6.902 -14.235  -0.063
  140    HG   LEU  20           HG       LEU  20   8.653 -12.527  -0.569
  141   1HD1  LEU  20          1HD1      LEU  20   8.108 -10.397  -1.067
  142   2HD1  LEU  20          2HD1      LEU  20   7.160 -10.242   0.412
  143   3HD1  LEU  20          3HD1      LEU  20   6.415 -10.887  -1.049
  144   1HD2  LEU  20          1HD2      LEU  20   7.544 -11.413   1.907
  145   2HD2  LEU  20          2HD2      LEU  20   9.025 -12.334   1.655
  146   3HD2  LEU  20          3HD2      LEU  20   7.492 -13.176   1.867
  147    H    THR  21           H        THR  21   8.553 -12.386  -3.087
  148    HA   THR  21           HA       THR  21   9.723 -15.098  -3.570
  149    HB   THR  21           HB       THR  21  10.615 -14.247  -5.719
  150    HG1  THR  21           HG1      THR  21   8.981 -11.979  -5.248
  151   1HG2  THR  21          1HG2      THR  21   8.488 -14.189  -6.944
  152   2HG2  THR  21          2HG2      THR  21   7.621 -13.856  -5.445
  153   3HG2  THR  21          3HG2      THR  21   8.430 -15.408  -5.670
  154    H    SER  22           H        SER  22  10.373 -13.622  -1.276
  155    HA   SER  22           HA       SER  22  13.251 -13.253  -1.683
  156   1HB   SER  22          2HB       SER  22  11.500 -10.966  -1.701
  157   2HB   SER  22          1HB       SER  22  12.518 -10.905  -0.265
  158    HG   SER  22           HG       SER  22  13.762 -10.027  -1.814
  159    H    ASP  23           H        ASP  23  10.823 -12.196   0.758
  160    HA   ASP  23           HA       ASP  23  12.511 -13.294   2.902
  161   1HB   ASP  23          2HB       ASP  23  10.120 -11.544   2.730
  162   2HB   ASP  23          1HB       ASP  23  10.216 -12.559   4.167
  163    HA   PRO  24           HA       PRO  24  10.463 -17.194   3.088
  164   1HB   PRO  24          2HB       PRO  24  11.255 -17.897   5.625
  165   2HB   PRO  24          1HB       PRO  24  12.320 -17.956   4.210
  166   1HG   PRO  24          2HG       PRO  24  12.276 -15.980   6.445
  167   2HG   PRO  24          1HG       PRO  24  13.626 -16.475   5.411
  168   1HD   PRO  24          2HD       PRO  24  12.137 -14.087   5.151
  169   2HD   PRO  24          1HD       PRO  24  13.243 -14.764   3.935
  170    H    LYS  25           H        LYS  25   9.856 -14.715   5.519
  171    HA   LYS  25           HA       LYS  25   7.748 -16.068   6.941
  172   1HB   LYS  25          2HB       LYS  25   8.387 -13.122   6.595
  173   2HB   LYS  25          1HB       LYS  25   7.131 -13.730   7.673
  174   1HG   LYS  25          2HG       LYS  25   8.811 -13.781   9.212
  175   2HG   LYS  25          1HG       LYS  25   9.244 -15.294   8.417
  176   1HD   LYS  25          2HD       LYS  25  11.108 -14.404   7.460
  177   2HD   LYS  25          1HD       LYS  25  10.310 -12.872   7.097
  178   1HE   LYS  25          2HE       LYS  25  10.406 -12.724   9.807
  179   2HE   LYS  25          1HE       LYS  25  11.855 -13.678   9.501
  180   1HZ   LYS  25          1HZ       LYS  25  12.405 -11.360   9.457
  181   2HZ   LYS  25          2HZ       LYS  25  11.187 -11.038   8.319
  182   3HZ   LYS  25          3HZ       LYS  25  12.535 -11.973   7.881
  183    H    LEU  26           H        LEU  26   5.819 -16.646   6.095
  184    HA   LEU  26           HA       LEU  26   3.819 -16.572   4.883
  185   1HB   LEU  26          2HB       LEU  26   4.330 -13.903   5.525
  186   2HB   LEU  26          1HB       LEU  26   4.066 -13.877   3.783
  187    HG   LEU  26           HG       LEU  26   2.027 -15.468   4.425
  188   1HD1  LEU  26          1HD1      LEU  26   1.080 -15.012   6.566
  189   2HD1  LEU  26          2HD1      LEU  26   2.211 -13.692   6.866
  190   3HD1  LEU  26          3HD1      LEU  26   2.781 -15.361   6.872
  191   1HD2  LEU  26          1HD2      LEU  26   1.370 -13.555   3.318
  192   2HD2  LEU  26          2HD2      LEU  26   2.327 -12.500   4.357
  193   3HD2  LEU  26          3HD2      LEU  26   0.784 -13.137   4.928
  194    HA   PRO  27           HA       PRO  27   5.909 -17.460   0.990
  195   1HB   PRO  27          2HB       PRO  27   4.136 -19.438   0.265
  196   2HB   PRO  27          1HB       PRO  27   5.514 -19.700   1.347
  197   1HG   PRO  27          2HG       PRO  27   2.614 -19.486   2.017
  198   2HG   PRO  27          1HG       PRO  27   3.901 -20.354   2.869
  199   1HD   PRO  27          2HD       PRO  27   2.816 -17.865   3.637
  200   2HD   PRO  27          1HD       PRO  27   4.335 -18.564   4.238
  201    H    PHE  28           H        PHE  28   2.334 -17.275   1.307
  202    HA   PHE  28           HA       PHE  28   2.299 -15.450  -1.042
  203   1HB   PHE  28          2HB       PHE  28   0.331 -16.623  -1.975
  204   2HB   PHE  28          1HB       PHE  28   1.740 -17.679  -1.921
  205    HD1  PHE  28           HD1      PHE  28   1.896 -19.496  -0.262
  206    HD2  PHE  28           HD2      PHE  28  -1.586 -16.992  -0.523
  207    HE1  PHE  28           HE1      PHE  28   0.624 -21.122   1.110
  208    HE2  PHE  28           HE2      PHE  28  -2.857 -18.618   0.851
  209    HZ   PHE  28           HZ       PHE  28  -1.752 -20.682   1.668
  210    H    LYS  29           H        LYS  29   0.131 -14.312  -1.202
  211    HA   LYS  29           HA       LYS  29  -1.367 -14.156   1.353
  212   1HB   LYS  29          2HB       LYS  29   0.689 -12.375   0.868
  213   2HB   LYS  29          1HB       LYS  29  -0.716 -11.501   0.262
  214   1HG   LYS  29          2HG       LYS  29  -1.304 -12.819   2.789
  215   2HG   LYS  29          1HG       LYS  29   0.074 -11.727   2.937
  216   1HD   LYS  29          2HD       LYS  29  -1.245  -9.906   2.779
  217   2HD   LYS  29          1HD       LYS  29  -2.048 -10.536   1.341
  218   1HE   LYS  29          2HE       LYS  29  -3.471 -11.970   2.787
  219   2HE   LYS  29          1HE       LYS  29  -2.701 -11.271   4.210
  220   1HZ   LYS  29          1HZ       LYS  29  -4.219  -9.677   4.109
  221   2HZ   LYS  29          2HZ       LYS  29  -4.797 -10.222   2.608
  222   3HZ   LYS  29          3HZ       LYS  29  -3.499  -9.130   2.673
  223    H    VAL  30           H        VAL  30  -3.511 -13.981   0.912
  224    HA   VAL  30           HA       VAL  30  -4.320 -13.255  -1.866
  225    HB   VAL  30           HB       VAL  30  -5.948 -14.608   0.312
  226   1HG1  VAL  30          1HG1      VAL  30  -6.405 -14.021  -2.617
  227   2HG1  VAL  30          2HG1      VAL  30  -7.442 -13.621  -1.248
  228   3HG1  VAL  30          3HG1      VAL  30  -7.288 -15.296  -1.778
  229   1HG2  VAL  30          1HG2      VAL  30  -5.567 -16.658  -1.124
  230   2HG2  VAL  30          2HG2      VAL  30  -4.122 -16.072  -0.298
  231   3HG2  VAL  30          3HG2      VAL  30  -4.357 -15.732  -2.014
  232    H    LEU  31           H        LEU  31  -5.151 -11.250  -2.167
  233    HA   LEU  31           HA       LEU  31  -6.301  -9.823   0.200
  234   1HB   LEU  31          2HB       LEU  31  -4.359  -9.035  -1.796
  235   2HB   LEU  31          1HB       LEU  31  -5.752  -7.955  -1.846
  236    HG   LEU  31           HG       LEU  31  -5.006  -8.548   0.897
  237   1HD1  LEU  31          1HD1      LEU  31  -2.804  -7.856   1.005
  238   2HD1  LEU  31          2HD1      LEU  31  -2.917  -6.912  -0.481
  239   3HD1  LEU  31          3HD1      LEU  31  -2.774  -8.667  -0.560
  240   1HD2  LEU  31          1HD2      LEU  31  -5.122  -6.141   1.091
  241   2HD2  LEU  31          2HD2      LEU  31  -6.410  -6.647  -0.003
  242   3HD2  LEU  31          3HD2      LEU  31  -4.928  -5.942  -0.650
  243    H    SER  32           H        SER  32  -8.485  -9.799   0.105
  244    HA   SER  32           HA       SER  32  -9.813  -9.742  -2.568
  245   1HB   SER  32          2HB       SER  32 -10.313 -11.261  -0.240
  246   2HB   SER  32          1HB       SER  32 -11.627 -10.092  -0.336
  247    HG   SER  32           HG       SER  32 -12.290 -11.700  -1.629
  248    H    VAL  33           H        VAL  33 -10.062  -7.613  -3.137
  249    HA   VAL  33           HA       VAL  33 -11.497  -5.846  -1.200
  250    HB   VAL  33           HB       VAL  33 -10.093  -3.927  -2.084
  251   1HG1  VAL  33          1HG1      VAL  33  -9.166  -4.263  -0.061
  252   2HG1  VAL  33          2HG1      VAL  33  -7.934  -5.232  -0.869
  253   3HG1  VAL  33          3HG1      VAL  33  -9.364  -6.010  -0.191
  254   1HG2  VAL  33          1HG2      VAL  33  -8.098  -6.022  -2.921
  255   2HG2  VAL  33          2HG2      VAL  33  -8.161  -4.313  -3.355
  256   3HG2  VAL  33          3HG2      VAL  33  -9.308  -5.447  -4.069
  257    HA   PRO  34           HA       PRO  34 -14.044  -4.848  -4.637
  258   1HB   PRO  34          2HB       PRO  34 -14.727  -2.254  -4.015
  259   2HB   PRO  34          1HB       PRO  34 -15.398  -3.674  -3.192
  260   1HG   PRO  34          2HG       PRO  34 -13.332  -1.741  -2.229
  261   2HG   PRO  34          1HG       PRO  34 -14.494  -2.701  -1.296
  262   1HD   PRO  34          2HD       PRO  34 -11.765  -3.307  -1.606
  263   2HD   PRO  34          1HD       PRO  34 -13.014  -4.441  -1.051
  264    H    GLU  35           H        GLU  35 -14.223  -3.358  -6.533
  265    HA   GLU  35           HA       GLU  35 -11.704  -2.775  -7.729
  266   1HB   GLU  35          2HB       GLU  35 -14.540  -1.993  -8.391
  267   2HB   GLU  35          1HB       GLU  35 -13.188  -1.383  -9.345
  268   1HG   GLU  35          2HG       GLU  35 -13.596  -3.322 -10.524
  269   2HG   GLU  35          1HG       GLU  35 -12.498  -3.974  -9.308
  270    H    SER  36           H        SER  36 -13.849  -0.788  -5.761
  271    HA   SER  36           HA       SER  36 -12.803   1.787  -6.394
  272   1HB   SER  36          2HB       SER  36 -14.531   0.636  -4.383
  273   2HB   SER  36          1HB       SER  36 -13.422   1.780  -3.636
  274    HG   SER  36           HG       SER  36 -15.515   2.537  -4.673
  275    H    THR  37           H        THR  37 -11.683  -0.696  -4.097
  276    HA   THR  37           HA       THR  37  -9.670   0.887  -2.814
  277    HB   THR  37           HB       THR  37  -9.735  -2.111  -3.297
  278    HG1  THR  37           HG1      THR  37 -10.623  -0.496  -1.139
  279   1HG2  THR  37          1HG2      THR  37  -7.597  -1.901  -2.521
  280   2HG2  THR  37          2HG2      THR  37  -8.405  -1.764  -0.960
  281   3HG2  THR  37          3HG2      THR  37  -7.896  -0.311  -1.820
  282    HA   PRO  38           HA       PRO  38  -6.914   1.148  -6.305
  283   1HB   PRO  38          2HB       PRO  38  -5.033   2.688  -5.021
  284   2HB   PRO  38          1HB       PRO  38  -6.543   3.333  -5.687
  285   1HG   PRO  38          2HG       PRO  38  -5.811   2.829  -2.841
  286   2HG   PRO  38          1HG       PRO  38  -6.960   3.996  -3.514
  287   1HD   PRO  38          2HD       PRO  38  -7.623   1.526  -2.303
  288   2HD   PRO  38          1HD       PRO  38  -8.715   2.544  -3.266
  289    H    PHE  39           H        PHE  39  -4.705   0.442  -6.819
  290    HA   PHE  39           HA       PHE  39  -3.892  -1.949  -5.459
  291   1HB   PHE  39          2HB       PHE  39  -3.407  -1.116  -7.913
  292   2HB   PHE  39          1HB       PHE  39  -1.974  -0.403  -7.176
  293    HD1  PHE  39           HD1      PHE  39  -3.855  -3.624  -6.687
  294    HD2  PHE  39           HD2      PHE  39  -0.085  -1.730  -7.498
  295    HE1  PHE  39           HE1      PHE  39  -2.746  -5.839  -6.703
  296    HE2  PHE  39           HE2      PHE  39   1.024  -3.948  -7.514
  297    HZ   PHE  39           HZ       PHE  39  -0.308  -6.001  -7.116
  298    H    THR  40           H        THR  40  -3.198   1.400  -4.851
  299    HA   THR  40           HA       THR  40  -0.655   1.182  -3.569
  300    HB   THR  40           HB       THR  40  -1.436   3.232  -2.275
  301    HG1  THR  40           HG1      THR  40  -3.472   3.677  -2.301
  302   1HG2  THR  40          1HG2      THR  40  -1.729   4.613  -4.416
  303   2HG2  THR  40          2HG2      THR  40  -1.618   3.082  -5.283
  304   3HG2  THR  40          3HG2      THR  40  -0.265   3.637  -4.298
  305    H    ALA  41           H        ALA  41  -3.975   0.861  -2.297
  306    HA   ALA  41           HA       ALA  41  -3.106   0.221   0.403
  307   1HB   ALA  41          1HB       ALA  41  -5.313   1.178   0.075
  308   2HB   ALA  41          2HB       ALA  41  -5.509  -0.458   0.702
  309   3HB   ALA  41          3HB       ALA  41  -5.764  -0.134  -1.012
  310    H    VAL  42           H        VAL  42  -4.057  -1.658  -2.469
  311    HA   VAL  42           HA       VAL  42  -4.142  -4.232  -1.216
  312    HB   VAL  42           HB       VAL  42  -3.395  -3.511  -4.072
  313   1HG1  VAL  42          1HG1      VAL  42  -4.085  -5.843  -4.570
  314   2HG1  VAL  42          2HG1      VAL  42  -4.305  -6.134  -2.845
  315   3HG1  VAL  42          3HG1      VAL  42  -2.696  -5.795  -3.484
  316   1HG2  VAL  42          1HG2      VAL  42  -5.608  -2.689  -3.551
  317   2HG2  VAL  42          2HG2      VAL  42  -6.029  -4.193  -2.731
  318   3HG2  VAL  42          3HG2      VAL  42  -5.805  -4.175  -4.480
  319    H    LEU  43           H        LEU  43  -1.479  -2.586  -2.959
  320    HA   LEU  43           HA       LEU  43   0.500  -4.601  -2.497
  321   1HB   LEU  43          2HB       LEU  43   0.532  -2.530  -4.090
  322   2HB   LEU  43          1HB       LEU  43   1.171  -1.668  -2.691
  323    HG   LEU  43           HG       LEU  43   2.476  -4.264  -3.176
  324   1HD1  LEU  43          1HD1      LEU  43   3.576  -3.752  -5.193
  325   2HD1  LEU  43          2HD1      LEU  43   3.127  -2.048  -5.114
  326   3HD1  LEU  43          3HD1      LEU  43   1.912  -3.263  -5.512
  327   1HD2  LEU  43          1HD2      LEU  43   4.471  -2.538  -3.083
  328   2HD2  LEU  43          2HD2      LEU  43   3.562  -2.902  -1.617
  329   3HD2  LEU  43          3HD2      LEU  43   3.223  -1.426  -2.521
  330    H    LYS  44           H        LYS  44  -0.539  -1.798  -0.571
  331    HA   LYS  44           HA       LYS  44   1.571  -1.902   1.374
  332   1HB   LYS  44          2HB       LYS  44  -1.178  -0.710   1.268
  333   2HB   LYS  44          1HB       LYS  44  -0.380  -0.830   2.836
  334   1HG   LYS  44          2HG       LYS  44   1.642   0.158   1.246
  335   2HG   LYS  44          1HG       LYS  44   0.219   0.943   0.562
  336   1HD   LYS  44          2HD       LYS  44  -0.379   1.915   2.654
  337   2HD   LYS  44          1HD       LYS  44   0.750   0.886   3.537
  338   1HE   LYS  44          2HE       LYS  44   2.502   2.057   1.883
  339   2HE   LYS  44          1HE       LYS  44   1.285   3.331   1.914
  340   1HZ   LYS  44          1HZ       LYS  44   1.621   2.461   4.532
  341   2HZ   LYS  44          2HZ       LYS  44   2.082   3.953   3.865
  342   3HZ   LYS  44          3HZ       LYS  44   3.177   2.654   3.887
  343    H    PHE  45           H        PHE  45  -1.760  -3.247   1.462
  344    HA   PHE  45           HA       PHE  45  -1.516  -4.562   3.978
  345   1HB   PHE  45          2HB       PHE  45  -3.492  -4.313   2.003
  346   2HB   PHE  45          1HB       PHE  45  -3.183  -6.045   2.106
  347    HD1  PHE  45           HD1      PHE  45  -4.285  -7.277   3.753
  348    HD2  PHE  45           HD2      PHE  45  -3.656  -3.068   4.349
  349    HE1  PHE  45           HE1      PHE  45  -5.586  -7.379   5.863
  350    HE2  PHE  45           HE2      PHE  45  -4.955  -3.172   6.457
  351    HZ   PHE  45           HZ       PHE  45  -5.919  -5.328   7.213
  352    H    ALA  46           H        ALA  46  -0.821  -5.746   0.674
  353    HA   ALA  46           HA       ALA  46  -0.164  -8.432   1.449
  354   1HB   ALA  46          1HB       ALA  46   0.378  -6.723  -0.956
  355   2HB   ALA  46          2HB       ALA  46  -0.513  -8.240  -0.842
  356   3HB   ALA  46          3HB       ALA  46   1.248  -8.246  -0.778
  357    H    ALA  47           H        ALA  47   1.898  -5.561   0.885
  358    HA   ALA  47           HA       ALA  47   4.384  -6.851   1.504
  359   1HB   ALA  47          1HB       ALA  47   5.254  -4.544   1.782
  360   2HB   ALA  47          2HB       ALA  47   3.602  -3.929   1.741
  361   3HB   ALA  47          3HB       ALA  47   4.290  -4.705   0.314
  362    H    GLU  48           H        GLU  48   2.023  -5.119   3.535
  363    HA   GLU  48           HA       GLU  48   3.560  -5.009   5.932
  364   1HB   GLU  48          2HB       GLU  48   0.746  -4.687   5.174
  365   2HB   GLU  48          1HB       GLU  48   0.940  -5.378   6.785
  366   1HG   GLU  48          2HG       GLU  48   1.091  -3.147   7.343
  367   2HG   GLU  48          1HG       GLU  48   2.788  -3.447   6.971
  368    H    GLU  49           H        GLU  49   1.291  -7.519   4.761
  369    HA   GLU  49           HA       GLU  49   1.749  -9.267   7.034
  370   1HB   GLU  49          2HB       GLU  49   0.318  -9.461   4.418
  371   2HB   GLU  49          1HB       GLU  49   0.754 -10.968   5.225
  372   1HG   GLU  49          2HG       GLU  49  -1.304 -10.575   6.212
  373   2HG   GLU  49          1HG       GLU  49  -0.256  -9.727   7.349
  374    H    PHE  50           H        PHE  50   3.309  -8.801   3.918
  375    HA   PHE  50           HA       PHE  50   4.780 -11.326   4.000
  376   1HB   PHE  50          2HB       PHE  50   4.758  -8.905   2.236
  377   2HB   PHE  50          1HB       PHE  50   6.153  -9.979   2.175
  378    HD1  PHE  50           HD1      PHE  50   3.640  -9.339   0.202
  379    HD2  PHE  50           HD2      PHE  50   4.839 -12.618   2.702
  380    HE1  PHE  50           HE1      PHE  50   2.363 -10.903  -1.235
  381    HE2  PHE  50           HE2      PHE  50   3.559 -14.182   1.266
  382    HZ   PHE  50           HZ       PHE  50   2.324 -13.323  -0.702
  383    H    LYS  51           H        LYS  51   5.100  -8.473   5.751
  384    HA   LYS  51           HA       LYS  51   6.773  -7.734   7.212
  385   1HB   LYS  51          2HB       LYS  51   7.321 -10.476   6.859
  386   2HB   LYS  51          1HB       LYS  51   8.865  -9.663   6.617
  387   1HG   LYS  51          2HG       LYS  51   9.063  -9.346   8.831
  388   2HG   LYS  51          1HG       LYS  51   7.550  -8.439   8.853
  389   1HD   LYS  51          2HD       LYS  51   6.519 -10.909   8.698
  390   2HD   LYS  51          1HD       LYS  51   8.049 -11.316   9.475
  391   1HE   LYS  51          2HE       LYS  51   7.577  -9.578  11.214
  392   2HE   LYS  51          1HE       LYS  51   6.001  -9.310  10.470
  393   1HZ   LYS  51          1HZ       LYS  51   5.259 -10.965  11.728
  394   2HZ   LYS  51          2HZ       LYS  51   6.824 -11.381  12.239
  395   3HZ   LYS  51          3HZ       LYS  51   6.194 -12.035  10.805
  396    H    VAL  52           H        VAL  52   6.600  -6.750   4.519
  397    HA   VAL  52           HA       VAL  52   9.423  -5.866   4.136
  398    HB   VAL  52           HB       VAL  52   8.994  -5.909   1.632
  399   1HG1  VAL  52          1HG1      VAL  52  10.291  -7.660   2.958
  400   2HG1  VAL  52          2HG1      VAL  52   9.650  -8.192   1.403
  401   3HG1  VAL  52          3HG1      VAL  52   8.834  -8.652   2.897
  402   1HG2  VAL  52          1HG2      VAL  52   6.499  -6.102   1.842
  403   2HG2  VAL  52          2HG2      VAL  52   6.716  -7.750   2.432
  404   3HG2  VAL  52          3HG2      VAL  52   7.206  -7.328   0.792
  405    HA   PRO  53           HA       PRO  53   7.576  -1.877   3.886
  406   1HB   PRO  53          2HB       PRO  53   9.445  -0.578   2.342
  407   2HB   PRO  53          1HB       PRO  53   9.681  -0.983   4.049
  408   1HG   PRO  53          2HG       PRO  53  10.858  -2.277   1.631
  409   2HG   PRO  53          1HG       PRO  53  11.503  -2.184   3.278
  410   1HD   PRO  53          2HD       PRO  53  10.239  -4.435   2.134
  411   2HD   PRO  53          1HD       PRO  53  10.559  -4.192   3.864
  412    H    ALA  54           H        ALA  54   5.850  -1.305   2.678
  413    HA   ALA  54           HA       ALA  54   5.403  -2.242  -0.012
  414   1HB   ALA  54          1HB       ALA  54   3.859   0.102   0.976
  415   2HB   ALA  54          2HB       ALA  54   3.757  -1.373   1.938
  416   3HB   ALA  54          3HB       ALA  54   3.286  -1.394   0.239
  417    H    ALA  55           H        ALA  55   6.612   0.807   1.321
  418    HA   ALA  55           HA       ALA  55   6.415   2.375  -1.070
  419   1HB   ALA  55          1HB       ALA  55   7.321   3.991   0.225
  420   2HB   ALA  55          2HB       ALA  55   8.736   3.006   0.598
  421   3HB   ALA  55          3HB       ALA  55   7.258   2.818   1.540
  422    H    THR  56           H        THR  56   8.918   0.144   0.111
  423    HA   THR  56           HA       THR  56  10.531   0.690  -2.339
  424    HB   THR  56           HB       THR  56  11.360  -1.018   0.017
  425    HG1  THR  56           HG1      THR  56  11.456   0.750   1.115
  426   1HG2  THR  56          1HG2      THR  56  13.588   0.200  -0.939
  427   2HG2  THR  56          2HG2      THR  56  12.631   0.103  -2.416
  428   3HG2  THR  56          3HG2      THR  56  13.016  -1.365  -1.517
  429    H    SER  57           H        SER  57   8.057  -1.333  -1.564
  430    HA   SER  57           HA       SER  57   9.268  -3.735  -2.846
  431   1HB   SER  57          2HB       SER  57   6.932  -3.283  -1.044
  432   2HB   SER  57          1HB       SER  57   6.840  -4.619  -2.186
  433    HG   SER  57           HG       SER  57   8.026  -4.654   0.104
  434    H    ALA  58           H        ALA  58   8.117  -4.789  -4.572
  435    HA   ALA  58           HA       ALA  58   6.127  -3.124  -6.042
  436   1HB   ALA  58          1HB       ALA  58   8.507  -4.478  -7.351
  437   2HB   ALA  58          2HB       ALA  58   8.439  -2.755  -6.980
  438   3HB   ALA  58          3HB       ALA  58   7.307  -3.453  -8.139
  439    H    ILE  59           H        ILE  59   4.666  -4.401  -7.334
  440    HA   ILE  59           HA       ILE  59   4.804  -7.328  -6.721
  441    HB   ILE  59           HB       ILE  59   2.480  -5.437  -7.087
  442   1HG1  ILE  59          2HG1      ILE  59   3.013  -7.616  -5.045
  443   2HG1  ILE  59          1HG1      ILE  59   3.523  -5.943  -4.830
  444   1HG2  ILE  59          1HG2      ILE  59   2.363  -7.677  -8.493
  445   2HG2  ILE  59          2HG2      ILE  59   0.977  -7.164  -7.536
  446   3HG2  ILE  59          3HG2      ILE  59   2.061  -8.409  -6.918
  447   1HD1  ILE  59          1HD1      ILE  59   1.446  -5.999  -3.735
  448   2HD1  ILE  59          2HD1      ILE  59   0.729  -7.058  -4.948
  449   3HD1  ILE  59          3HD1      ILE  59   1.032  -5.363  -5.326
  450    H    ILE  60           H        ILE  60   5.489  -8.481  -8.436
  451    HA   ILE  60           HA       ILE  60   4.985  -7.444 -11.176
  452    HB   ILE  60           HB       ILE  60   6.669  -9.083 -11.903
  453   1HG1  ILE  60          2HG1      ILE  60   7.659  -9.862  -9.293
  454   2HG1  ILE  60          1HG1      ILE  60   5.982 -10.373  -9.480
  455   1HG2  ILE  60          1HG2      ILE  60   8.055  -7.370 -11.433
  456   2HG2  ILE  60          2HG2      ILE  60   8.392  -8.160  -9.892
  457   3HG2  ILE  60          3HG2      ILE  60   7.127  -6.935  -9.998
  458   1HD1  ILE  60          1HD1      ILE  60   8.163 -11.739 -10.464
  459   2HD1  ILE  60          2HD1      ILE  60   7.621 -10.833 -11.877
  460   3HD1  ILE  60          3HD1      ILE  60   6.509 -11.922 -11.049
  461    H    THR  61           H        THR  61   4.441  -9.205 -12.846
  462    HA   THR  61           HA       THR  61   2.222 -10.853 -11.752
  463    HB   THR  61           HB       THR  61   1.526 -11.081 -14.124
  464    HG1  THR  61           HG1      THR  61   2.752 -10.352 -15.702
  465   1HG2  THR  61          1HG2      THR  61   2.085  -8.164 -13.748
  466   2HG2  THR  61          2HG2      THR  61   1.085  -8.997 -12.558
  467   3HG2  THR  61          3HG2      THR  61   0.596  -8.963 -14.252
  468    H    ASN  62           H        ASN  62   1.925 -13.042 -12.895
  469    HA   ASN  62           HA       ASN  62   4.252 -14.677 -12.429
  470   1HB   ASN  62          2HB       ASN  62   1.445 -15.075 -13.128
  471   2HB   ASN  62          1HB       ASN  62   2.499 -16.197 -13.989
  472   1HD2  ASN  62          1HD2      ASN  62   1.942 -14.929 -10.651
  473   2HD2  ASN  62          2HD2      ASN  62   2.374 -16.376  -9.876
  474    H    ASP  63           H        ASP  63   3.023 -13.022 -15.255
  475    HA   ASP  63           HA       ASP  63   4.554 -14.620 -17.172
  476   1HB   ASP  63          2HB       ASP  63   3.092 -11.976 -17.452
  477   2HB   ASP  63          1HB       ASP  63   3.846 -12.843 -18.789
  478    H    GLY  64           H        GLY  64   4.819 -11.306 -15.818
  479   1HA   GLY  64          2HA       GLY  64   7.373 -10.962 -15.204
  480   2HA   GLY  64          1HA       GLY  64   7.561 -11.103 -16.952
  481    H    VAL  65           H        VAL  65   5.287  -9.378 -14.776
  482    HA   VAL  65           HA       VAL  65   5.963  -6.852 -16.225
  483    HB   VAL  65           HB       VAL  65   3.174  -7.722 -15.388
  484   1HG1  VAL  65          1HG1      VAL  65   3.466  -5.303 -15.256
  485   2HG1  VAL  65          2HG1      VAL  65   2.499  -5.691 -16.679
  486   3HG1  VAL  65          3HG1      VAL  65   4.204  -5.276 -16.858
  487   1HG2  VAL  65          1HG2      VAL  65   4.508  -7.540 -18.108
  488   2HG2  VAL  65          2HG2      VAL  65   2.771  -7.747 -17.872
  489   3HG2  VAL  65          3HG2      VAL  65   3.890  -8.998 -17.330
  490    H    GLY  66           H        GLY  66   6.769  -5.450 -14.746
  491   1HA   GLY  66          2HA       GLY  66   6.439  -5.856 -11.889
  492   2HA   GLY  66          1HA       GLY  66   7.304  -4.522 -12.650
  493    H    VAL  67           H        VAL  67   4.161  -5.657 -11.588
  494    HA   VAL  67           HA       VAL  67   2.707  -3.264 -12.372
  495    HB   VAL  67           HB       VAL  67   1.915  -5.261 -10.232
  496   1HG1  VAL  67          1HG1      VAL  67  -0.354  -4.514 -11.516
  497   2HG1  VAL  67          2HG1      VAL  67   0.600  -3.043 -11.700
  498   3HG1  VAL  67          3HG1      VAL  67   0.268  -3.682 -10.091
  499   1HG2  VAL  67          1HG2      VAL  67   0.746  -6.473 -12.052
  500   2HG2  VAL  67          2HG2      VAL  67   2.490  -6.458 -12.312
  501   3HG2  VAL  67          3HG2      VAL  67   1.453  -5.369 -13.232
  502    H    ASN  68           H        ASN  68   2.489  -1.383 -11.261
  503    HA   ASN  68           HA       ASN  68   3.726  -1.215  -8.540
  504   1HB   ASN  68          2HB       ASN  68   3.497   0.787 -10.796
  505   2HB   ASN  68          1HB       ASN  68   3.873   1.285  -9.147
  506   1HD2  ASN  68          1HD2      ASN  68   5.233   0.006 -12.050
  507   2HD2  ASN  68          2HD2      ASN  68   6.773  -0.350 -11.431
  508    HA   PRO  69           HA       PRO  69  -0.141   0.114  -6.909
  509   1HB   PRO  69          2HB       PRO  69   0.715   1.843  -4.946
  510   2HB   PRO  69          1HB       PRO  69   0.851   0.081  -4.829
  511   1HG   PRO  69          2HG       PRO  69   2.982   2.096  -5.360
  512   2HG   PRO  69          1HG       PRO  69   3.115   0.485  -4.635
  513   1HD   PRO  69          2HD       PRO  69   3.781   1.171  -7.302
  514   2HD   PRO  69          1HD       PRO  69   3.609  -0.475  -6.655
  515    H    ALA  70           H        ALA  70  -0.109   1.367  -9.212
  516    HA   ALA  70           HA       ALA  70  -0.551   4.269  -8.619
  517   1HB   ALA  70          1HB       ALA  70   1.461   3.872 -10.033
  518   2HB   ALA  70          2HB       ALA  70   0.215   4.793 -10.876
  519   3HB   ALA  70          3HB       ALA  70   0.432   3.078 -11.227
  520    H    GLN  71           H        GLN  71  -1.927   1.348  -9.835
  521    HA   GLN  71           HA       GLN  71  -4.198   2.884 -11.034
  522   1HB   GLN  71          2HB       GLN  71  -4.654   0.904 -12.403
  523   2HB   GLN  71          1HB       GLN  71  -2.981   1.404 -12.626
  524   1HG   GLN  71          2HG       GLN  71  -2.744  -0.320 -10.508
  525   2HG   GLN  71          1HG       GLN  71  -4.062  -1.062 -11.415
  526   1HE2  GLN  71          1HE2      GLN  71  -0.633  -0.160 -11.573
  527   2HE2  GLN  71          2HE2      GLN  71  -0.288  -1.042 -12.981
  528    HA   PRO  72           HA       PRO  72  -6.907   1.143  -8.036
  529   1HB   PRO  72          2HB       PRO  72  -9.175   0.689  -9.524
  530   2HB   PRO  72          1HB       PRO  72  -8.635   2.298  -9.018
  531   1HG   PRO  72          2HG       PRO  72  -8.481   1.024 -11.712
  532   2HG   PRO  72          1HG       PRO  72  -8.576   2.742 -11.286
  533   1HD   PRO  72          2HD       PRO  72  -6.238   1.364 -12.060
  534   2HD   PRO  72          1HD       PRO  72  -6.294   2.964 -11.291
  535    H    ALA  73           H        ALA  73  -8.059  -0.834  -7.359
  536    HA   ALA  73           HA       ALA  73  -6.774  -3.262  -8.098
  537   1HB   ALA  73          1HB       ALA  73  -7.870  -3.046  -5.940
  538   2HB   ALA  73          2HB       ALA  73  -8.634  -4.365  -6.826
  539   3HB   ALA  73          3HB       ALA  73  -9.434  -2.797  -6.717
  540    H    GLY  74           H        GLY  74  -9.854  -1.842  -9.191
  541   1HA   GLY  74          2HA       GLY  74 -10.862  -4.038 -10.669
  542   2HA   GLY  74          1HA       GLY  74 -11.182  -2.347 -11.059
  543    H    ASN  75           H        ASN  75  -8.574  -1.479 -11.661
  544    HA   ASN  75           HA       ASN  75  -8.267  -2.446 -14.370
  545   1HB   ASN  75          2HB       ASN  75  -7.651  -0.119 -13.323
  546   2HB   ASN  75          1HB       ASN  75  -6.124  -0.906 -12.921
  547   1HD2  ASN  75          1HD2      ASN  75  -4.655  -1.393 -14.658
  548   2HD2  ASN  75          2HD2      ASN  75  -4.940  -0.907 -16.258
  549    H    ILE  76           H        ILE  76  -6.600  -3.105 -11.307
  550    HA   ILE  76           HA       ILE  76  -4.346  -4.516 -12.353
  551    HB   ILE  76           HB       ILE  76  -5.833  -4.850  -9.727
  552   1HG1  ILE  76          2HG1      ILE  76  -4.725  -2.611 -10.330
  553   2HG1  ILE  76          1HG1      ILE  76  -4.225  -3.350  -8.813
  554   1HG2  ILE  76          1HG2      ILE  76  -3.151  -5.933 -10.638
  555   2HG2  ILE  76          2HG2      ILE  76  -4.559  -6.869 -10.137
  556   3HG2  ILE  76          3HG2      ILE  76  -3.680  -5.901  -8.956
  557   1HD1  ILE  76          1HD1      ILE  76  -2.165  -4.094  -9.726
  558   2HD1  ILE  76          2HD1      ILE  76  -2.359  -2.458 -10.353
  559   3HD1  ILE  76          3HD1      ILE  76  -2.715  -3.844 -11.382
  560    H    PHE  77           H        PHE  77  -7.579  -5.681 -11.358
  561    HA   PHE  77           HA       PHE  77  -7.033  -8.448 -12.031
  562   1HB   PHE  77          2HB       PHE  77  -8.903  -7.380 -10.498
  563   2HB   PHE  77          1HB       PHE  77  -9.815  -7.315 -12.005
  564    HD1  PHE  77           HD1      PHE  77  -8.574  -9.440  -9.339
  565    HD2  PHE  77           HD2      PHE  77 -10.167  -9.443 -13.329
  566    HE1  PHE  77           HE1      PHE  77  -9.111 -11.851  -9.125
  567    HE2  PHE  77           HE2      PHE  77 -10.702 -11.853 -13.114
  568    HZ   PHE  77           HZ       PHE  77 -10.175 -13.057 -11.012
  569    H    LEU  78           H        LEU  78  -8.559  -5.723 -13.733
  570    HA   LEU  78           HA       LEU  78  -9.463  -7.193 -16.027
  571   1HB   LEU  78          2HB       LEU  78  -9.186  -4.387 -15.227
  572   2HB   LEU  78          1HB       LEU  78  -8.886  -4.630 -16.945
  573    HG   LEU  78           HG       LEU  78 -11.284  -4.168 -16.431
  574   1HD1  LEU  78          1HD1      LEU  78 -12.107  -5.723 -17.977
  575   2HD1  LEU  78          2HD1      LEU  78 -11.084  -7.022 -17.365
  576   3HD1  LEU  78          3HD1      LEU  78 -10.378  -5.724 -18.329
  577   1HD2  LEU  78          1HD2      LEU  78 -12.615  -5.859 -15.273
  578   2HD2  LEU  78          2HD2      LEU  78 -11.308  -5.325 -14.217
  579   3HD2  LEU  78          3HD2      LEU  78 -11.189  -6.873 -15.055
  580    H    LYS  79           H        LYS  79  -6.349  -5.666 -15.248
  581    HA   LYS  79           HA       LYS  79  -5.290  -6.255 -17.943
  582   1HB   LYS  79          2HB       LYS  79  -4.751  -4.281 -16.069
  583   2HB   LYS  79          1HB       LYS  79  -3.363  -5.358 -15.924
  584   1HG   LYS  79          2HG       LYS  79  -2.693  -5.018 -18.126
  585   2HG   LYS  79          1HG       LYS  79  -4.315  -4.571 -18.659
  586   1HD   LYS  79          2HD       LYS  79  -4.118  -2.392 -17.902
  587   2HD   LYS  79          1HD       LYS  79  -2.965  -2.824 -16.637
  588   1HE   LYS  79          2HE       LYS  79  -1.290  -3.322 -18.473
  589   2HE   LYS  79          1HE       LYS  79  -2.431  -2.608 -19.610
  590   1HZ   LYS  79          1HZ       LYS  79  -1.125  -0.822 -19.049
  591   2HZ   LYS  79          2HZ       LYS  79  -0.921  -1.323 -17.439
  592   3HZ   LYS  79          3HZ       LYS  79  -2.398  -0.649 -17.941
  593    H    HIS  80           H        HIS  80  -4.247  -7.021 -14.586
  594    HA   HIS  80           HA       HIS  80  -2.692  -9.316 -15.632
  595   1HB   HIS  80          2HB       HIS  80  -2.894  -8.499 -12.731
  596   2HB   HIS  80          1HB       HIS  80  -1.579  -9.350 -13.543
  597    HD1  HIS  80           HD1      HIS  80  -0.534  -7.780 -15.662
  598    HD2  HIS  80           HD2      HIS  80  -2.311  -5.824 -12.438
  599    HE1  HIS  80           HE1      HIS  80   0.290  -5.388 -15.733
  600    H    GLY  81           H        GLY  81  -5.042  -8.852 -12.941
  601   1HA   GLY  81          2HA       GLY  81  -7.061 -10.370 -12.987
  602   2HA   GLY  81          1HA       GLY  81  -5.951 -11.664 -13.438
  603    H    SER  82           H        SER  82  -5.216 -12.912 -11.789
  604    HA   SER  82           HA       SER  82  -5.245 -11.755  -9.026
  605   1HB   SER  82          2HB       SER  82  -7.000 -13.596  -9.710
  606   2HB   SER  82          1HB       SER  82  -5.637 -14.693  -9.513
  607    HG   SER  82           HG       SER  82  -6.950 -14.277  -7.588
  608    H    GLU  83           H        GLU  83  -3.727 -14.197 -11.161
  609    HA   GLU  83           HA       GLU  83  -1.661 -15.041  -9.422
  610   1HB   GLU  83          2HB       GLU  83  -1.984 -14.927 -12.397
  611   2HB   GLU  83          1HB       GLU  83  -0.387 -15.286 -11.741
  612   1HG   GLU  83          2HG       GLU  83  -2.614 -16.766 -10.474
  613   2HG   GLU  83          1HG       GLU  83  -2.315 -17.173 -12.163
  614    H    LEU  84           H        LEU  84  -0.447 -13.583  -8.307
  615    HA   LEU  84           HA       LEU  84   1.168 -11.630  -9.873
  616   1HB   LEU  84          2HB       LEU  84  -0.578 -11.037  -7.476
  617   2HB   LEU  84          1HB       LEU  84   0.790 -10.009  -7.900
  618    HG   LEU  84           HG       LEU  84  -1.223 -10.732 -10.012
  619   1HD1  LEU  84          1HD1      LEU  84  -2.783  -9.869  -8.531
  620   2HD1  LEU  84          2HD1      LEU  84  -2.213  -8.379  -9.282
  621   3HD1  LEU  84          3HD1      LEU  84  -1.596  -8.863  -7.702
  622   1HD2  LEU  84          1HD2      LEU  84   0.039  -8.047  -9.684
  623   2HD2  LEU  84          2HD2      LEU  84  -0.294  -8.959 -11.157
  624   3HD2  LEU  84          3HD2      LEU  84   1.094  -9.379 -10.154
  625    H    ARG  85           H        ARG  85   2.960 -10.710  -8.379
  626    HA   ARG  85           HA       ARG  85   3.802 -12.614  -6.258
  627   1HB   ARG  85          2HB       ARG  85   5.105 -12.228  -8.900
  628   2HB   ARG  85          1HB       ARG  85   6.183 -12.260  -7.504
  629   1HG   ARG  85          2HG       ARG  85   5.938 -14.489  -7.276
  630   2HG   ARG  85          1HG       ARG  85   4.180 -14.352  -7.301
  631   1HD   ARG  85          2HD       ARG  85   4.303 -15.423  -9.296
  632   2HD   ARG  85          1HD       ARG  85   4.842 -13.871  -9.937
  633    HE   ARG  85           HE       ARG  85   7.106 -15.263  -8.887
  634   1HH1  ARG  85          2HH1      ARG  85   5.773 -17.543 -10.281
  635   2HH1  ARG  85          1HH1      ARG  85   6.389 -17.402 -11.894
  636   1HH2  ARG  85          1HH2      ARG  85   7.490 -14.128 -11.467
  637   2HH2  ARG  85          2HH2      ARG  85   7.366 -15.458 -12.568
  638    H    LEU  86           H        LEU  86   5.005 -11.599  -4.626
  639    HA   LEU  86           HA       LEU  86   5.343  -8.653  -4.945
  640   1HB   LEU  86          2HB       LEU  86   4.013  -9.864  -2.984
  641   2HB   LEU  86          1HB       LEU  86   5.625  -9.995  -2.289
  642    HG   LEU  86           HG       LEU  86   5.125  -7.341  -3.405
  643   1HD1  LEU  86          1HD1      LEU  86   2.831  -7.667  -2.766
  644   2HD1  LEU  86          2HD1      LEU  86   3.578  -6.694  -1.499
  645   3HD1  LEU  86          3HD1      LEU  86   3.300  -8.416  -1.242
  646   1HD2  LEU  86          1HD2      LEU  86   6.902  -8.275  -1.713
  647   2HD2  LEU  86          2HD2      LEU  86   5.636  -8.007  -0.514
  648   3HD2  LEU  86          3HD2      LEU  86   6.250  -6.655  -1.468
  649    H    ILE  87           H        ILE  87   7.340  -7.801  -5.024
  650    HA   ILE  87           HA       ILE  87   9.649  -9.317  -3.922
  651    HB   ILE  87           HB       ILE  87   9.692  -9.938  -6.252
  652   1HG1  ILE  87          2HG1      ILE  87  11.577  -7.577  -5.972
  653   2HG1  ILE  87          1HG1      ILE  87  11.857  -9.144  -5.212
  654   1HG2  ILE  87          1HG2      ILE  87   9.520  -8.336  -8.068
  655   2HG2  ILE  87          2HG2      ILE  87   9.479  -6.989  -6.930
  656   3HG2  ILE  87          3HG2      ILE  87   8.130  -8.122  -7.004
  657   1HD1  ILE  87          1HD1      ILE  87  12.636  -8.417  -7.784
  658   2HD1  ILE  87          2HD1      ILE  87  11.195  -9.399  -8.047
  659   3HD1  ILE  87          3HD1      ILE  87  12.562 -10.063  -7.152
  660    HA   PRO  88           HA       PRO  88  10.413  -5.196  -2.453
  661   1HB   PRO  88          2HB       PRO  88  12.813  -5.760  -1.220
  662   2HB   PRO  88          1HB       PRO  88  11.230  -6.151  -0.525
  663   1HG   PRO  88          2HG       PRO  88  13.219  -7.971  -1.809
  664   2HG   PRO  88          1HG       PRO  88  12.012  -8.327  -0.561
  665   1HD   PRO  88          2HD       PRO  88  11.769  -8.962  -3.295
  666   2HD   PRO  88          1HD       PRO  88  10.440  -8.942  -2.116
  667    H    ARG  89           H        ARG  89  10.756  -4.217  -4.526
  668    HA   ARG  89           HA       ARG  89  12.017  -2.963  -6.044
  669   1HB   ARG  89          2HB       ARG  89  13.577  -2.799  -3.910
  670   2HB   ARG  89          1HB       ARG  89  14.608  -3.884  -4.844
  671   1HG   ARG  89          2HG       ARG  89  13.528  -1.620  -6.395
  672   2HG   ARG  89          1HG       ARG  89  14.611  -1.145  -5.085
  673   1HD   ARG  89          2HD       ARG  89  16.344  -2.655  -5.925
  674   2HD   ARG  89          1HD       ARG  89  15.261  -3.229  -7.193
  675    HE   ARG  89           HE       ARG  89  15.526  -0.374  -7.373
  676   1HH1  ARG  89          1HH2      ARG  89  15.655  -1.996  -9.797
  677   2HH1  ARG  89          2HH2      ARG  89  17.333  -1.961 -10.223
  678   1HH2  ARG  89          2HH1      ARG  89  18.377  -0.896  -7.080
  679   2HH2  ARG  89          1HH1      ARG  89  18.881  -1.334  -8.677
  680    H    ASP  90           H        ASP  90  12.394  -3.589  -8.105
  681    HA   ASP  90           HA       ASP  90  13.181  -6.407  -8.596
  682   1HB   ASP  90          2HB       ASP  90  11.732  -4.296 -10.129
  683   2HB   ASP  90          1HB       ASP  90  12.658  -5.471 -11.064
  684    H    ARG  91           H        ARG  91  15.351  -6.723  -8.746
  685    HA   ARG  91           HA       ARG  91  17.150  -4.584  -9.657
  686   1HB   ARG  91          2HB       ARG  91  17.447  -7.301  -8.462
  687   2HB   ARG  91          1HB       ARG  91  18.770  -6.737  -9.483
  688   1HG   ARG  91          2HG       ARG  91  19.431  -5.872  -7.433
  689   2HG   ARG  91          1HG       ARG  91  18.493  -4.517  -8.061
  690   1HD   ARG  91          2HD       ARG  91  17.636  -4.789  -5.887
  691   2HD   ARG  91          1HD       ARG  91  16.473  -5.662  -6.883
  692    HE   ARG  91           HE       ARG  91  18.704  -7.120  -5.528
  693   1HH1  ARG  91          2HH1      ARG  91  16.403  -6.693  -3.723
  694   2HH1  ARG  91          1HH1      ARG  91  15.402  -8.072  -4.034
  695   1HH2  ARG  91          1HH2      ARG  91  16.978  -8.864  -7.035
  696   2HH2  ARG  91          2HH2      ARG  91  15.730  -9.307  -5.919
  697    H    VAL  92           H        VAL  92  16.508  -7.945 -10.748
  698    HA   VAL  92           HA       VAL  92  17.721  -7.430 -13.361
  699    HB   VAL  92           HB       VAL  92  17.763  -9.668 -12.174
  700   1HG1  VAL  92          1HG1      VAL  92  15.336  -9.544 -11.474
  701   2HG1  VAL  92          2HG1      VAL  92  15.803 -11.071 -12.224
  702   3HG1  VAL  92          3HG1      VAL  92  14.902  -9.873 -13.152
  703   1HG2  VAL  92          1HG2      VAL  92  18.321  -9.610 -14.517
  704   2HG2  VAL  92          2HG2      VAL  92  16.624  -9.466 -14.975
  705   3HG2  VAL  92          3HG2      VAL  92  17.226 -10.972 -14.282
  706    H    GLY  93           H        GLY  93  14.521  -7.238 -11.982
  707   1HA   GLY  93          2HA       GLY  93  12.810  -5.914 -13.140
  708   2HA   GLY  93          1HA       GLY  93  13.449  -6.511 -14.673
  709    H    HIS  94           HN       HIS  94  11.328  -7.302 -15.250
  710    HA   HIS  94           HA       HIS  94   9.838  -9.086 -15.560
  711   1HB   HIS  94          2HB       HIS  94  12.054 -10.387 -14.887
  712   2HB   HIS  94          1HB       HIS  94  11.158 -10.700 -13.403
  713    HD1  HIS  94           HD1      HIS  94  10.795 -11.129 -17.164
  714    HD2  HIS  94           HD2      HIS  94   9.275 -12.723 -13.624
  715    HE1  HIS  94           HE1      HIS  94   9.392 -13.132 -17.824
  Start of MODEL   20
    1   1H    MET   1          1H        MET   1 -23.157 -19.188   4.754
    2   2H    MET   1          2H        MET   1 -23.266 -20.768   5.368
    3   3H    MET   1          3H        MET   1 -22.272 -19.629   6.132
    4    HA   MET   1           HA       MET   1 -23.951 -19.270   7.515
    5   1HB   MET   1          2HB       MET   1 -24.159 -17.559   5.319
    6   2HB   MET   1          1HB       MET   1 -25.811 -18.137   5.558
    7   1HG   MET   1          2HG       MET   1 -25.173 -17.648   8.126
    8   2HG   MET   1          1HG       MET   1 -24.103 -16.483   7.350
    9   1HE   MET   1          1HE       MET   1 -27.818 -17.700   7.794
   10   2HE   MET   1          2HE       MET   1 -27.399 -17.948   6.095
   11   3HE   MET   1          3HE       MET   1 -28.616 -16.754   6.530
   12    H    SER   2           H        SER   2 -24.745 -21.252   8.130
   13    HA   SER   2           HA       SER   2 -26.356 -22.951   8.386
   14   1HB   SER   2          2HB       SER   2 -27.870 -20.904   7.404
   15   2HB   SER   2          1HB       SER   2 -28.046 -22.080   6.108
   16    HG   SER   2           HG       SER   2 -28.481 -23.612   7.934
   17    H    GLY   3           H        GLY   3 -24.098 -22.833   6.298
   18   1HA   GLY   3          2HA       GLY   3 -23.499 -25.068   5.269
   19   2HA   GLY   3          1HA       GLY   3 -25.084 -25.014   4.500
   20    H    GLY   4           H        GLY   4 -21.976 -23.294   4.696
   21   1HA   GLY   4          2HA       GLY   4 -20.826 -22.740   2.553
   22   2HA   GLY   4          1HA       GLY   4 -22.414 -22.331   1.897
   23    H    THR   5           H        THR   5 -19.908 -21.280   4.181
   24    HA   THR   5           HA       THR   5 -21.284 -18.750   4.794
   25    HB   THR   5           HB       THR   5 -19.044 -18.204   5.902
   26    HG1  THR   5           HG1      THR   5 -17.575 -19.468   5.044
   27   1HG2  THR   5          1HG2      THR   5 -19.379 -19.895   7.739
   28   2HG2  THR   5          2HG2      THR   5 -20.582 -20.687   6.719
   29   3HG2  THR   5          3HG2      THR   5 -20.847 -19.031   7.275
   30    H    ALA   6           H        ALA   6 -20.983 -16.803   3.735
   31    HA   ALA   6           HA       ALA   6 -18.588 -16.451   2.031
   32   1HB   ALA   6          1HB       ALA   6 -20.201 -17.405   0.475
   33   2HB   ALA   6          2HB       ALA   6 -19.975 -15.698   0.096
   34   3HB   ALA   6          3HB       ALA   6 -21.420 -16.227   0.960
   35    H    ALA   7           H        ALA   7 -18.032 -14.880   3.638
   36    HA   ALA   7           HA       ALA   7 -19.771 -12.617   4.217
   37   1HB   ALA   7          1HB       ALA   7 -16.820 -13.080   4.740
   38   2HB   ALA   7          2HB       ALA   7 -18.144 -13.322   5.881
   39   3HB   ALA   7          3HB       ALA   7 -17.731 -11.695   5.341
   40    H    THR   8           H        THR   8 -16.706 -12.958   2.358
   41    HA   THR   8           HA       THR   8 -17.403 -10.404   0.960
   42    HB   THR   8           HB       THR   8 -14.950 -10.393   0.319
   43    HG1  THR   8           HG1      THR   8 -14.192 -12.362   0.633
   44   1HG2  THR   8          1HG2      THR   8 -16.219  -9.738   2.787
   45   2HG2  THR   8          2HG2      THR   8 -14.800  -8.985   2.060
   46   3HG2  THR   8          3HG2      THR   8 -14.607 -10.349   3.160
   47    H    THR   9           H        THR   9 -17.971 -10.545  -1.151
   48    HA   THR   9           HA       THR   9 -17.649 -13.175  -2.499
   49    HB   THR   9           HB       THR   9 -19.923 -12.149  -2.317
   50    HG1  THR   9           HG1      THR   9 -19.917 -13.473  -3.965
   51   1HG2  THR   9          1HG2      THR   9 -19.778 -10.297  -4.470
   52   2HG2  THR   9          2HG2      THR   9 -18.528  -9.845  -3.311
   53   3HG2  THR   9          3HG2      THR   9 -20.208  -9.975  -2.791
   54    H    ALA  10           H        ALA  10 -17.104 -13.207  -4.805
   55    HA   ALA  10           HA       ALA  10 -15.053 -11.144  -5.490
   56   1HB   ALA  10          1HB       ALA  10 -14.341 -13.557  -5.233
   57   2HB   ALA  10          2HB       ALA  10 -13.975 -12.856  -6.810
   58   3HB   ALA  10          3HB       ALA  10 -15.356 -13.937  -6.623
   59    H    GLY  11           H        GLY  11 -18.214 -11.789  -6.191
   60   1HA   GLY  11          2HA       GLY  11 -18.293 -11.764  -9.062
   61   2HA   GLY  11          1HA       GLY  11 -19.626 -11.315  -7.996
   62    H    SER  12           H        SER  12 -18.908  -9.118  -6.716
   63    HA   SER  12           HA       SER  12 -18.425  -7.150  -8.893
   64   1HB   SER  12          2HB       SER  12 -19.411  -5.511  -7.356
   65   2HB   SER  12          1HB       SER  12 -20.477  -6.902  -7.530
   66    HG   SER  12           HG       SER  12 -20.067  -7.479  -5.516
   67    H    LYS  13           H        LYS  13 -16.533  -8.730  -6.691
   68    HA   LYS  13           HA       LYS  13 -14.749  -6.354  -6.311
   69   1HB   LYS  13          2HB       LYS  13 -14.922  -8.794  -4.518
   70   2HB   LYS  13          1HB       LYS  13 -13.960  -7.344  -4.236
   71   1HG   LYS  13          2HG       LYS  13 -16.405  -6.216  -4.531
   72   2HG   LYS  13          1HG       LYS  13 -16.876  -7.783  -3.876
   73   1HD   LYS  13          2HD       LYS  13 -14.604  -6.779  -2.407
   74   2HD   LYS  13          1HD       LYS  13 -15.872  -5.554  -2.437
   75   1HE   LYS  13          2HE       LYS  13 -17.160  -6.740  -1.014
   76   2HE   LYS  13          1HE       LYS  13 -16.972  -8.209  -1.972
   77   1HZ   LYS  13          1HZ       LYS  13 -16.035  -8.335   0.314
   78   2HZ   LYS  13          2HZ       LYS  13 -14.884  -7.171  -0.140
   79   3HZ   LYS  13          3HZ       LYS  13 -14.921  -8.683  -0.917
   80    H    VAL  14           H        VAL  14 -12.425  -6.874  -6.308
   81    HA   VAL  14           HA       VAL  14 -11.815  -9.249  -8.026
   82    HB   VAL  14           HB       VAL  14  -9.789  -7.920  -8.742
   83   1HG1  VAL  14          1HG1      VAL  14 -12.620  -7.088  -9.273
   84   2HG1  VAL  14          2HG1      VAL  14 -11.466  -7.874 -10.351
   85   3HG1  VAL  14          3HG1      VAL  14 -11.307  -6.154  -9.990
   86   1HG2  VAL  14          1HG2      VAL  14  -9.321  -5.888  -7.855
   87   2HG2  VAL  14          2HG2      VAL  14 -10.480  -6.291  -6.592
   88   3HG2  VAL  14          3HG2      VAL  14 -10.994  -5.358  -7.996
   89    H    THR  15           H        THR  15 -10.405 -10.744  -7.229
   90    HA   THR  15           HA       THR  15  -9.134 -10.172  -4.597
   91    HB   THR  15           HB       THR  15 -10.607 -12.176  -4.791
   92    HG1  THR  15           HG1      THR  15  -9.268 -12.701  -3.273
   93   1HG2  THR  15          1HG2      THR  15  -8.985 -12.603  -7.158
   94   2HG2  THR  15          2HG2      THR  15 -10.479 -13.400  -6.673
   95   3HG2  THR  15          3HG2      THR  15  -8.929 -14.011  -6.097
   96    H    PHE  16           H        PHE  16  -6.888 -10.761  -4.255
   97    HA   PHE  16           HA       PHE  16  -5.280 -11.070  -6.755
   98   1HB   PHE  16          2HB       PHE  16  -4.655  -9.162  -4.483
   99   2HB   PHE  16          1HB       PHE  16  -3.653  -9.433  -5.904
  100    HD1  PHE  16           HD1      PHE  16  -6.382  -7.555  -4.528
  101    HD2  PHE  16           HD2      PHE  16  -4.714  -8.988  -8.219
  102    HE1  PHE  16           HE1      PHE  16  -7.683  -5.855  -5.778
  103    HE2  PHE  16           HE2      PHE  16  -6.016  -7.288  -9.467
  104    HZ   PHE  16           HZ       PHE  16  -7.499  -5.722  -8.247
  105    H    LYS  17           H        LYS  17  -3.578 -12.456  -6.567
  106    HA   LYS  17           HA       LYS  17  -3.026 -13.622  -3.865
  107   1HB   LYS  17          2HB       LYS  17  -4.066 -15.054  -5.836
  108   2HB   LYS  17          1HB       LYS  17  -2.402 -15.085  -6.417
  109   1HG   LYS  17          2HG       LYS  17  -2.924 -15.717  -3.533
  110   2HG   LYS  17          1HG       LYS  17  -3.279 -16.947  -4.745
  111   1HD   LYS  17          2HD       LYS  17  -0.617 -15.510  -4.614
  112   2HD   LYS  17          1HD       LYS  17  -0.926 -17.021  -3.760
  113   1HE   LYS  17          2HE       LYS  17  -0.593 -18.202  -5.646
  114   2HE   LYS  17          1HE       LYS  17  -1.837 -17.272  -6.480
  115   1HZ   LYS  17          1HZ       LYS  17   1.020 -17.041  -6.621
  116   2HZ   LYS  17          2HZ       LYS  17   0.257 -15.546  -6.353
  117   3HZ   LYS  17          3HZ       LYS  17  -0.163 -16.491  -7.701
  118    H    ILE  18           H        ILE  18  -1.132 -12.706  -3.177
  119    HA   ILE  18           HA       ILE  18   1.053 -12.333  -5.189
  120    HB   ILE  18           HB       ILE  18   0.652 -10.889  -2.549
  121   1HG1  ILE  18          2HG1      ILE  18   0.484  -9.064  -4.651
  122   2HG1  ILE  18          1HG1      ILE  18  -0.429 -10.454  -5.235
  123   1HG2  ILE  18          1HG2      ILE  18   2.615  -9.777  -2.958
  124   2HG2  ILE  18          2HG2      ILE  18   2.418  -9.855  -4.709
  125   3HG2  ILE  18          3HG2      ILE  18   3.004 -11.263  -3.825
  126   1HD1  ILE  18          1HD1      ILE  18  -0.845  -9.129  -2.538
  127   2HD1  ILE  18          2HD1      ILE  18  -1.801 -10.451  -3.211
  128   3HD1  ILE  18          3HD1      ILE  18  -1.852  -8.854  -3.959
  129    H    THR  19           H        THR  19   2.794 -13.622  -4.948
  130    HA   THR  19           HA       THR  19   3.404 -14.735  -2.241
  131    HB   THR  19           HB       THR  19   3.617 -16.222  -4.881
  132    HG1  THR  19           HG1      THR  19   1.675 -16.854  -4.462
  133   1HG2  THR  19          1HG2      THR  19   4.725 -16.660  -2.208
  134   2HG2  THR  19          2HG2      THR  19   5.125 -17.451  -3.732
  135   3HG2  THR  19          3HG2      THR  19   3.761 -18.025  -2.774
  136    H    LEU  20           H        LEU  20   5.541 -14.516  -1.655
  137    HA   LEU  20           HA       LEU  20   7.289 -12.850  -3.203
  138   1HB   LEU  20          2HB       LEU  20   7.290 -14.019  -0.592
  139   2HB   LEU  20          1HB       LEU  20   8.830 -14.400  -1.359
  140    HG   LEU  20           HG       LEU  20   7.647 -11.612  -1.334
  141   1HD1  LEU  20          1HD1      LEU  20   9.972 -12.247   0.391
  142   2HD1  LEU  20          2HD1      LEU  20   8.426 -12.905   0.931
  143   3HD1  LEU  20          3HD1      LEU  20   8.610 -11.167   0.690
  144   1HD2  LEU  20          1HD2      LEU  20   9.874 -10.933  -1.994
  145   2HD2  LEU  20          2HD2      LEU  20   9.377 -12.236  -3.071
  146   3HD2  LEU  20          3HD2      LEU  20  10.497 -12.564  -1.749
  147    H    THR  21           H        THR  21   8.510 -13.386  -4.916
  148    HA   THR  21           HA       THR  21   9.122 -16.268  -5.398
  149    HB   THR  21           HB       THR  21   7.805 -15.110  -7.159
  150    HG1  THR  21           HG1      THR  21   8.859 -16.525  -8.273
  151   1HG2  THR  21          1HG2      THR  21   8.467 -13.172  -8.193
  152   2HG2  THR  21          2HG2      THR  21  10.183 -13.532  -8.003
  153   3HG2  THR  21          3HG2      THR  21   9.257 -12.908  -6.638
  154    H    SER  22           H        SER  22  10.588 -13.078  -5.025
  155    HA   SER  22           HA       SER  22  13.238 -13.818  -5.912
  156   1HB   SER  22          2HB       SER  22  11.953 -11.464  -4.998
  157   2HB   SER  22          1HB       SER  22  13.295 -11.751  -3.896
  158    HG   SER  22           HG       SER  22  13.924 -10.556  -5.749
  159    H    ASP  23           H        ASP  23  11.627 -13.778  -2.742
  160    HA   ASP  23           HA       ASP  23  14.004 -14.606  -1.279
  161   1HB   ASP  23          2HB       ASP  23  11.112 -14.170  -0.656
  162   2HB   ASP  23          1HB       ASP  23  12.040 -15.186   0.444
  163    HA   PRO  24           HA       PRO  24  13.692 -18.966  -1.660
  164   1HB   PRO  24          2HB       PRO  24  14.307 -19.793   0.896
  165   2HB   PRO  24          1HB       PRO  24  15.500 -19.168  -0.255
  166   1HG   PRO  24          2HG       PRO  24  14.308 -17.828   2.129
  167   2HG   PRO  24          1HG       PRO  24  15.879 -17.556   1.357
  168   1HD   PRO  24          2HD       PRO  24  13.599 -15.920   1.061
  169   2HD   PRO  24          1HD       PRO  24  15.046 -15.882   0.030
  170    H    LYS  25           H        LYS  25  11.800 -17.505   0.953
  171    HA   LYS  25           HA       LYS  25  10.089 -19.869   1.306
  172   1HB   LYS  25          2HB       LYS  25  10.530 -17.333   2.655
  173   2HB   LYS  25          1HB       LYS  25   8.808 -17.637   2.425
  174   1HG   LYS  25          2HG       LYS  25   9.091 -19.890   3.424
  175   2HG   LYS  25          1HG       LYS  25  10.795 -19.537   3.704
  176   1HD   LYS  25          2HD       LYS  25   8.959 -17.465   4.708
  177   2HD   LYS  25          1HD       LYS  25   8.781 -19.026   5.505
  178   1HE   LYS  25          2HE       LYS  25  10.459 -17.890   6.761
  179   2HE   LYS  25          1HE       LYS  25  11.347 -19.016   5.735
  180   1HZ   LYS  25          1HZ       LYS  25  10.833 -16.393   4.592
  181   2HZ   LYS  25          2HZ       LYS  25  12.230 -17.358   4.524
  182   3HZ   LYS  25          3HZ       LYS  25  11.906 -16.421   5.904
  183    H    LEU  26           H        LEU  26   7.654 -19.582   1.039
  184    HA   LEU  26           HA       LEU  26   6.971 -17.788  -1.247
  185   1HB   LEU  26          2HB       LEU  26   6.781 -20.757  -1.090
  186   2HB   LEU  26          1HB       LEU  26   5.425 -19.914  -1.840
  187    HG   LEU  26           HG       LEU  26   7.572 -18.628  -2.975
  188   1HD1  LEU  26          1HD1      LEU  26   9.386 -19.930  -2.471
  189   2HD1  LEU  26          2HD1      LEU  26   8.769 -20.934  -3.783
  190   3HD1  LEU  26          3HD1      LEU  26   8.397 -21.344  -2.108
  191   1HD2  LEU  26          1HD2      LEU  26   7.086 -20.291  -4.917
  192   2HD2  LEU  26          2HD2      LEU  26   5.754 -19.298  -4.324
  193   3HD2  LEU  26          3HD2      LEU  26   5.886 -20.984  -3.823
  194    HA   PRO  27           HA       PRO  27   3.856 -17.538   2.185
  195   1HB   PRO  27          2HB       PRO  27   4.056 -14.809   2.502
  196   2HB   PRO  27          1HB       PRO  27   5.047 -15.975   3.395
  197   1HG   PRO  27          2HG       PRO  27   5.819 -14.208   1.120
  198   2HG   PRO  27          1HG       PRO  27   6.828 -14.882   2.410
  199   1HD   PRO  27          2HD       PRO  27   6.674 -15.848  -0.245
  200   2HD   PRO  27          1HD       PRO  27   7.403 -16.697   1.134
  201    H    PHE  28           H        PHE  28   1.830 -17.619   1.264
  202    HA   PHE  28           HA       PHE  28   1.248 -16.038  -1.156
  203   1HB   PHE  28          2HB       PHE  28  -0.923 -17.270  -1.161
  204   2HB   PHE  28          1HB       PHE  28   0.473 -18.342  -1.157
  205    HD1  PHE  28           HD1      PHE  28   1.011 -19.712   0.788
  206    HD2  PHE  28           HD2      PHE  28  -2.327 -17.005   0.849
  207    HE1  PHE  28           HE1      PHE  28   0.156 -20.810   2.840
  208    HE2  PHE  28           HE2      PHE  28  -3.178 -18.103   2.902
  209    HZ   PHE  28           HZ       PHE  28  -1.936 -20.004   3.897
  210    H    LYS  29           H        LYS  29  -0.298 -14.406  -1.297
  211    HA   LYS  29           HA       LYS  29  -1.535 -13.477   1.263
  212   1HB   LYS  29          2HB       LYS  29   0.423 -12.071   0.839
  213   2HB   LYS  29          1HB       LYS  29  -0.111 -11.775  -0.813
  214   1HG   LYS  29          2HG       LYS  29  -0.856  -9.854   0.295
  215   2HG   LYS  29          1HG       LYS  29  -2.291 -10.876   0.332
  216   1HD   LYS  29          2HD       LYS  29  -0.987 -11.695   2.598
  217   2HD   LYS  29          1HD       LYS  29  -0.560  -9.985   2.550
  218   1HE   LYS  29          2HE       LYS  29  -3.093  -9.606   2.085
  219   2HE   LYS  29          1HE       LYS  29  -3.292 -11.242   2.711
  220   1HZ   LYS  29          1HZ       LYS  29  -2.045 -10.513   4.708
  221   2HZ   LYS  29          2HZ       LYS  29  -3.531  -9.715   4.504
  222   3HZ   LYS  29          3HZ       LYS  29  -2.079  -8.925   4.112
  223    H    VAL  30           H        VAL  30  -3.691 -13.707   0.915
  224    HA   VAL  30           HA       VAL  30  -4.777 -13.199  -1.812
  225    HB   VAL  30           HB       VAL  30  -6.157 -14.419   0.602
  226   1HG1  VAL  30          1HG1      VAL  30  -7.513 -15.339  -1.522
  227   2HG1  VAL  30          2HG1      VAL  30  -6.945 -13.819  -2.215
  228   3HG1  VAL  30          3HG1      VAL  30  -7.924 -13.809  -0.747
  229   1HG2  VAL  30          1HG2      VAL  30  -4.627 -16.082   0.108
  230   2HG2  VAL  30          2HG2      VAL  30  -4.451 -15.568  -1.570
  231   3HG2  VAL  30          3HG2      VAL  30  -5.872 -16.488  -1.074
  232    H    LEU  31           H        LEU  31  -5.562 -11.186  -2.162
  233    HA   LEU  31           HA       LEU  31  -6.736  -9.691   0.153
  234   1HB   LEU  31          2HB       LEU  31  -4.886  -8.874  -2.034
  235   2HB   LEU  31          1HB       LEU  31  -6.130  -7.710  -1.579
  236    HG   LEU  31           HG       LEU  31  -4.804  -8.974   0.723
  237   1HD1  LEU  31          1HD1      LEU  31  -2.702  -7.743   0.483
  238   2HD1  LEU  31          2HD1      LEU  31  -3.220  -7.121  -1.084
  239   3HD1  LEU  31          3HD1      LEU  31  -2.903  -8.844  -0.880
  240   1HD2  LEU  31          1HD2      LEU  31  -5.198  -6.911   1.670
  241   2HD2  LEU  31          2HD2      LEU  31  -6.363  -6.807   0.347
  242   3HD2  LEU  31          3HD2      LEU  31  -4.781  -6.039   0.192
  243    H    SER  32           H        SER  32  -8.926  -9.771  -0.069
  244    HA   SER  32           HA       SER  32 -10.100  -9.658  -2.809
  245   1HB   SER  32          2HB       SER  32 -12.222 -10.357  -1.608
  246   2HB   SER  32          1HB       SER  32 -10.920 -11.541  -1.557
  247    HG   SER  32           HG       SER  32 -11.851 -11.222   0.502
  248    H    VAL  33           H        VAL  33 -10.277  -7.515  -3.345
  249    HA   VAL  33           HA       VAL  33 -11.923  -5.794  -1.545
  250    HB   VAL  33           HB       VAL  33 -10.434  -3.850  -2.223
  251   1HG1  VAL  33          1HG1      VAL  33  -9.727  -6.072  -0.388
  252   2HG1  VAL  33          2HG1      VAL  33  -9.958  -4.357  -0.048
  253   3HG1  VAL  33          3HG1      VAL  33  -8.437  -4.922  -0.738
  254   1HG2  VAL  33          1HG2      VAL  33  -9.392  -5.125  -4.156
  255   2HG2  VAL  33          2HG2      VAL  33  -8.474  -6.044  -2.962
  256   3HG2  VAL  33          3HG2      VAL  33  -8.239  -4.302  -3.107
  257    HA   PRO  34           HA       PRO  34 -14.039  -4.725  -5.252
  258   1HB   PRO  34          2HB       PRO  34 -14.830  -2.158  -4.653
  259   2HB   PRO  34          1HB       PRO  34 -15.574  -3.605  -3.952
  260   1HG   PRO  34          2HG       PRO  34 -13.674  -1.674  -2.696
  261   2HG   PRO  34          1HG       PRO  34 -14.920  -2.676  -1.936
  262   1HD   PRO  34          2HD       PRO  34 -12.159  -3.231  -1.939
  263   2HD   PRO  34          1HD       PRO  34 -13.445  -4.392  -1.549
  264    H    GLU  35           H        GLU  35 -14.012  -3.158  -7.112
  265    HA   GLU  35           HA       GLU  35 -11.380  -2.528  -7.985
  266   1HB   GLU  35          2HB       GLU  35 -12.475  -1.304  -9.831
  267   2HB   GLU  35          1HB       GLU  35 -13.240  -2.867  -9.554
  268   1HG   GLU  35          2HG       GLU  35 -15.206  -1.783  -9.356
  269   2HG   GLU  35          1HG       GLU  35 -14.598  -1.077  -7.859
  270    H    SER  36           H        SER  36 -13.629  -0.657  -6.057
  271    HA   SER  36           HA       SER  36 -12.614   1.965  -6.524
  272   1HB   SER  36          2HB       SER  36 -14.398   0.693  -4.654
  273   2HB   SER  36          1HB       SER  36 -13.315   1.771  -3.781
  274    HG   SER  36           HG       SER  36 -15.153   2.872  -4.566
  275    H    THR  37           H        THR  37 -11.543  -0.587  -4.270
  276    HA   THR  37           HA       THR  37  -9.545   1.010  -2.945
  277    HB   THR  37           HB       THR  37  -9.750  -1.997  -3.323
  278    HG1  THR  37           HG1      THR  37 -11.379  -1.435  -2.048
  279   1HG2  THR  37          1HG2      THR  37  -7.481  -1.613  -2.775
  280   2HG2  THR  37          2HG2      THR  37  -8.250  -1.939  -1.221
  281   3HG2  THR  37          3HG2      THR  37  -7.881  -0.280  -1.692
  282    HA   PRO  38           HA       PRO  38  -6.723   1.099  -6.393
  283   1HB   PRO  38          2HB       PRO  38  -4.836   2.646  -5.125
  284   2HB   PRO  38          1HB       PRO  38  -6.319   3.296  -5.843
  285   1HG   PRO  38          2HG       PRO  38  -5.655   2.879  -2.967
  286   2HG   PRO  38          1HG       PRO  38  -6.766   4.044  -3.705
  287   1HD   PRO  38          2HD       PRO  38  -7.504   1.632  -2.421
  288   2HD   PRO  38          1HD       PRO  38  -8.555   2.636  -3.444
  289    H    PHE  39           H        PHE  39  -4.422   0.456  -6.782
  290    HA   PHE  39           HA       PHE  39  -3.720  -1.962  -5.388
  291   1HB   PHE  39          2HB       PHE  39  -3.105  -1.112  -7.820
  292   2HB   PHE  39          1HB       PHE  39  -1.687  -0.459  -7.000
  293    HD1  PHE  39           HD1      PHE  39   0.184  -1.842  -7.005
  294    HD2  PHE  39           HD2      PHE  39  -3.722  -3.626  -6.891
  295    HE1  PHE  39           HE1      PHE  39   1.214  -4.096  -6.998
  296    HE2  PHE  39           HE2      PHE  39  -2.690  -5.881  -6.881
  297    HZ   PHE  39           HZ       PHE  39  -0.223  -6.116  -6.935
  298    H    THR  40           H        THR  40  -3.096   1.365  -4.693
  299    HA   THR  40           HA       THR  40  -0.598   1.162  -3.314
  300    HB   THR  40           HB       THR  40  -1.465   3.177  -2.014
  301    HG1  THR  40           HG1      THR  40  -3.488   3.692  -2.197
  302   1HG2  THR  40          1HG2      THR  40  -1.514   4.645  -4.019
  303   2HG2  THR  40          2HG2      THR  40  -1.666   3.213  -5.037
  304   3HG2  THR  40          3HG2      THR  40  -0.204   3.466  -4.082
  305    H    ALA  41           H        ALA  41  -3.965   0.742  -2.219
  306    HA   ALA  41           HA       ALA  41  -3.199   0.062   0.510
  307   1HB   ALA  41          1HB       ALA  41  -5.407   1.056  -0.012
  308   2HB   ALA  41          2HB       ALA  41  -5.580  -0.507   0.787
  309   3HB   ALA  41          3HB       ALA  41  -5.820  -0.376  -0.956
  310    H    VAL  42           H        VAL  42  -4.105  -1.746  -2.429
  311    HA   VAL  42           HA       VAL  42  -4.218  -4.354  -1.263
  312    HB   VAL  42           HB       VAL  42  -3.354  -3.539  -4.060
  313   1HG1  VAL  42          1HG1      VAL  42  -3.357  -6.091  -2.742
  314   2HG1  VAL  42          2HG1      VAL  42  -2.947  -5.723  -4.417
  315   3HG1  VAL  42          3HG1      VAL  42  -4.614  -6.092  -3.979
  316   1HG2  VAL  42          1HG2      VAL  42  -5.640  -3.831  -4.693
  317   2HG2  VAL  42          2HG2      VAL  42  -5.681  -2.855  -3.225
  318   3HG2  VAL  42          3HG2      VAL  42  -6.048  -4.578  -3.148
  319    H    LEU  43           H        LEU  43  -1.492  -2.686  -2.885
  320    HA   LEU  43           HA       LEU  43   0.475  -4.698  -2.352
  321   1HB   LEU  43          2HB       LEU  43   0.597  -2.666  -3.959
  322   2HB   LEU  43          1HB       LEU  43   1.091  -1.746  -2.537
  323    HG   LEU  43           HG       LEU  43   2.532  -4.284  -2.799
  324   1HD1  LEU  43          1HD1      LEU  43   3.006  -2.156  -4.905
  325   2HD1  LEU  43          2HD1      LEU  43   2.162  -3.672  -5.216
  326   3HD1  LEU  43          3HD1      LEU  43   3.859  -3.691  -4.735
  327   1HD2  LEU  43          1HD2      LEU  43   3.600  -1.451  -2.775
  328   2HD2  LEU  43          2HD2      LEU  43   4.395  -2.916  -2.197
  329   3HD2  LEU  43          3HD2      LEU  43   3.023  -2.250  -1.313
  330    H    LYS  44           H        LYS  44  -0.740  -1.974  -0.457
  331    HA   LYS  44           HA       LYS  44   1.285  -1.908   1.555
  332   1HB   LYS  44          2HB       LYS  44  -1.248  -0.672   1.084
  333   2HB   LYS  44          1HB       LYS  44  -1.274  -1.332   2.717
  334   1HG   LYS  44          2HG       LYS  44   1.282  -0.144   2.351
  335   2HG   LYS  44          1HG       LYS  44   0.087   1.010   1.756
  336   1HD   LYS  44          2HD       LYS  44  -0.891   1.282   3.826
  337   2HD   LYS  44          1HD       LYS  44  -0.513  -0.364   4.334
  338   1HE   LYS  44          2HE       LYS  44   1.904   0.299   4.468
  339   2HE   LYS  44          1HE       LYS  44   1.417   1.961   4.142
  340   1HZ   LYS  44          1HZ       LYS  44   1.653   1.495   6.522
  341   2HZ   LYS  44          2HZ       LYS  44   0.431   0.319   6.414
  342   3HZ   LYS  44          3HZ       LYS  44   0.073   1.954   6.118
  343    H    PHE  45           H        PHE  45  -1.900  -3.561   1.564
  344    HA   PHE  45           HA       PHE  45  -1.535  -4.930   4.042
  345   1HB   PHE  45          2HB       PHE  45  -3.320  -5.246   1.668
  346   2HB   PHE  45          1HB       PHE  45  -3.209  -6.601   2.791
  347    HD1  PHE  45           HD1      PHE  45  -3.868  -6.336   5.158
  348    HD2  PHE  45           HD2      PHE  45  -4.331  -3.142   2.323
  349    HE1  PHE  45           HE1      PHE  45  -5.379  -5.158   6.730
  350    HE2  PHE  45           HE2      PHE  45  -5.842  -1.964   3.896
  351    HZ   PHE  45           HZ       PHE  45  -6.365  -2.972   6.099
  352    H    ALA  46           H        ALA  46  -0.777  -5.911   0.690
  353    HA   ALA  46           HA       ALA  46   0.069  -8.577   1.306
  354   1HB   ALA  46          1HB       ALA  46   0.531  -8.702  -0.917
  355   2HB   ALA  46          2HB       ALA  46   1.528  -7.246  -0.883
  356   3HB   ALA  46          3HB       ALA  46  -0.226  -7.112  -1.004
  357    H    ALA  47           H        ALA  47   1.852  -5.495   1.161
  358    HA   ALA  47           HA       ALA  47   4.439  -6.652   1.729
  359   1HB   ALA  47          1HB       ALA  47   3.490  -3.815   2.230
  360   2HB   ALA  47          2HB       ALA  47   4.100  -4.405   0.684
  361   3HB   ALA  47          3HB       ALA  47   5.163  -4.354   2.088
  362    H    GLU  48           H        GLU  48   1.795  -5.429   3.744
  363    HA   GLU  48           HA       GLU  48   3.201  -5.259   6.227
  364   1HB   GLU  48          2HB       GLU  48   0.408  -5.288   5.338
  365   2HB   GLU  48          1HB       GLU  48   0.628  -6.063   6.906
  366   1HG   GLU  48          2HG       GLU  48   1.067  -4.097   7.935
  367   2HG   GLU  48          1HG       GLU  48   2.161  -3.580   6.652
  368    H    GLU  49           H        GLU  49   1.294  -7.951   4.829
  369    HA   GLU  49           HA       GLU  49   1.915  -9.809   6.955
  370   1HB   GLU  49          2HB       GLU  49  -0.029 -10.034   5.382
  371   2HB   GLU  49          1HB       GLU  49   1.109 -10.423   4.093
  372   1HG   GLU  49          2HG       GLU  49   1.667 -12.057   6.411
  373   2HG   GLU  49          1HG       GLU  49  -0.033 -12.210   5.967
  374    H    PHE  50           H        PHE  50   3.495  -8.913   3.933
  375    HA   PHE  50           HA       PHE  50   5.369 -11.150   3.951
  376   1HB   PHE  50          2HB       PHE  50   5.007  -8.655   2.326
  377   2HB   PHE  50          1HB       PHE  50   6.541  -9.519   2.240
  378    HD1  PHE  50           HD1      PHE  50   3.071 -10.881   2.689
  379    HD2  PHE  50           HD2      PHE  50   6.524 -10.583   0.151
  380    HE1  PHE  50           HE1      PHE  50   2.075 -12.531   1.133
  381    HE2  PHE  50           HE2      PHE  50   5.524 -12.229  -1.402
  382    HZ   PHE  50           HZ       PHE  50   3.300 -13.202  -0.912
  383    H    LYS  51           H        LYS  51   5.185  -8.281   5.770
  384    HA   LYS  51           HA       LYS  51   6.677  -7.308   7.275
  385   1HB   LYS  51          2HB       LYS  51   7.477  -9.993   7.099
  386   2HB   LYS  51          1HB       LYS  51   8.962  -9.066   6.887
  387   1HG   LYS  51          2HG       LYS  51   8.946  -9.031   9.170
  388   2HG   LYS  51          1HG       LYS  51   7.840  -7.680   8.929
  389   1HD   LYS  51          2HD       LYS  51   6.359  -8.864  10.175
  390   2HD   LYS  51          1HD       LYS  51   6.171  -9.894   8.756
  391   1HE   LYS  51          2HE       LYS  51   8.399 -11.001   9.781
  392   2HE   LYS  51          1HE       LYS  51   7.683 -10.394  11.274
  393   1HZ   LYS  51          1HZ       LYS  51   6.416 -12.205   9.293
  394   2HZ   LYS  51          2HZ       LYS  51   5.594 -11.507  10.609
  395   3HZ   LYS  51          3HZ       LYS  51   6.876 -12.589  10.881
  396    H    VAL  52           H        VAL  52   6.604  -6.441   4.547
  397    HA   VAL  52           HA       VAL  52   9.374  -5.346   4.289
  398    HB   VAL  52           HB       VAL  52   9.034  -5.405   1.780
  399   1HG1  VAL  52          1HG1      VAL  52   8.884  -8.210   2.851
  400   2HG1  VAL  52          2HG1      VAL  52  10.258  -7.183   3.262
  401   3HG1  VAL  52          3HG1      VAL  52   9.913  -7.562   1.574
  402   1HG2  VAL  52          1HG2      VAL  52   6.812  -7.350   2.467
  403   2HG2  VAL  52          2HG2      VAL  52   7.321  -6.844   0.856
  404   3HG2  VAL  52          3HG2      VAL  52   6.533  -5.693   1.935
  405    HA   PRO  53           HA       PRO  53   7.278  -1.485   3.944
  406   1HB   PRO  53          2HB       PRO  53   9.099  -0.080   2.438
  407   2HB   PRO  53          1HB       PRO  53   9.321  -0.460   4.154
  408   1HG   PRO  53          2HG       PRO  53  10.643  -1.680   1.776
  409   2HG   PRO  53          1HG       PRO  53  11.229  -1.555   3.443
  410   1HD   PRO  53          2HD       PRO  53  10.122  -3.869   2.241
  411   2HD   PRO  53          1HD       PRO  53  10.412  -3.629   3.978
  412    H    ALA  54           H        ALA  54   5.568  -0.977   2.664
  413    HA   ALA  54           HA       ALA  54   5.215  -2.018   0.003
  414   1HB   ALA  54          1HB       ALA  54   3.243  -0.348   0.002
  415   2HB   ALA  54          2HB       ALA  54   3.724   0.017   1.659
  416   3HB   ALA  54          3HB       ALA  54   3.227  -1.619   1.225
  417    H    ALA  55           H        ALA  55   6.349   1.100   1.232
  418    HA   ALA  55           HA       ALA  55   6.201   2.525  -1.271
  419   1HB   ALA  55          1HB       ALA  55   6.373   3.670   0.909
  420   2HB   ALA  55          2HB       ALA  55   7.678   4.161  -0.170
  421   3HB   ALA  55          3HB       ALA  55   7.992   3.009   1.128
  422    H    THR  56           H        THR  56   8.661   0.436   0.183
  423    HA   THR  56           HA       THR  56  10.506   1.023  -2.085
  424    HB   THR  56           HB       THR  56  11.146  -0.695   0.315
  425    HG1  THR  56           HG1      THR  56  11.204   1.020   1.497
  426   1HG2  THR  56          1HG2      THR  56  12.979  -0.905  -1.027
  427   2HG2  THR  56          2HG2      THR  56  13.395   0.671  -0.358
  428   3HG2  THR  56          3HG2      THR  56  12.610   0.562  -1.932
  429    H    SER  57           H        SER  57   8.123  -1.237  -1.268
  430    HA   SER  57           HA       SER  57   9.497  -3.435  -2.748
  431   1HB   SER  57          2HB       SER  57   7.203  -3.376  -0.802
  432   2HB   SER  57          1HB       SER  57   7.412  -4.741  -1.893
  433    HG   SER  57           HG       SER  57   8.700  -5.357  -0.322
  434    H    ALA  58           H        ALA  58   8.328  -4.547  -4.423
  435    HA   ALA  58           HA       ALA  58   6.043  -3.030  -5.615
  436   1HB   ALA  58          1HB       ALA  58   7.847  -2.350  -6.985
  437   2HB   ALA  58          2HB       ALA  58   7.137  -3.700  -7.871
  438   3HB   ALA  58          3HB       ALA  58   8.605  -3.942  -6.924
  439    H    ILE  59           H        ILE  59   4.845  -4.431  -7.256
  440    HA   ILE  59           HA       ILE  59   5.048  -7.327  -6.515
  441    HB   ILE  59           HB       ILE  59   2.641  -5.528  -6.700
  442   1HG1  ILE  59          2HG1      ILE  59   3.309  -7.820  -4.831
  443   2HG1  ILE  59          1HG1      ILE  59   3.792  -6.152  -4.524
  444   1HG2  ILE  59          1HG2      ILE  59   2.771  -8.483  -7.313
  445   2HG2  ILE  59          2HG2      ILE  59   1.940  -7.212  -8.211
  446   3HG2  ILE  59          3HG2      ILE  59   1.309  -7.751  -6.655
  447   1HD1  ILE  59          1HD1      ILE  59   1.001  -6.201  -5.214
  448   2HD1  ILE  59          2HD1      ILE  59   1.751  -5.685  -3.705
  449   3HD1  ILE  59          3HD1      ILE  59   1.295  -7.372  -3.930
  450    H    ILE  60           H        ILE  60   5.618  -8.487  -8.275
  451    HA   ILE  60           HA       ILE  60   5.020  -7.388 -10.975
  452    HB   ILE  60           HB       ILE  60   6.619  -9.131 -11.779
  453   1HG1  ILE  60          2HG1      ILE  60   7.744  -9.681  -9.137
  454   2HG1  ILE  60          1HG1      ILE  60   6.104 -10.309  -9.301
  455   1HG2  ILE  60          1HG2      ILE  60   7.586  -7.283  -9.580
  456   2HG2  ILE  60          2HG2      ILE  60   7.478  -6.916 -11.300
  457   3HG2  ILE  60          3HG2      ILE  60   8.649  -8.101 -10.726
  458   1HD1  ILE  60          1HD1      ILE  60   7.496 -12.050 -10.113
  459   2HD1  ILE  60          2HD1      ILE  60   8.515 -10.926 -11.010
  460   3HD1  ILE  60          3HD1      ILE  60   6.874 -11.261 -11.562
  461    H    THR  61           H        THR  61   4.428  -9.140 -12.652
  462    HA   THR  61           HA       THR  61   2.226 -10.785 -11.512
  463    HB   THR  61           HB       THR  61   2.775 -10.281 -14.447
  464    HG1  THR  61           HG1      THR  61   1.159  -8.750 -12.685
  465   1HG2  THR  61          1HG2      THR  61   0.472 -11.273 -12.794
  466   2HG2  THR  61          2HG2      THR  61   1.146 -11.944 -14.279
  467   3HG2  THR  61          3HG2      THR  61   0.160 -10.483 -14.339
  468    H    ASN  62           H        ASN  62   1.954 -13.013 -12.304
  469    HA   ASN  62           HA       ASN  62   4.320 -14.591 -12.144
  470   1HB   ASN  62          2HB       ASN  62   1.463 -15.076 -12.806
  471   2HB   ASN  62          1HB       ASN  62   2.607 -16.289 -13.377
  472   1HD2  ASN  62          1HD2      ASN  62   1.604 -14.552 -10.388
  473   2HD2  ASN  62          2HD2      ASN  62   2.087 -15.787  -9.329
  474    H    ASP  63           H        ASP  63   2.800 -13.024 -14.881
  475    HA   ASP  63           HA       ASP  63   4.171 -14.628 -16.906
  476   1HB   ASP  63          2HB       ASP  63   2.238 -12.413 -16.845
  477   2HB   ASP  63          1HB       ASP  63   3.427 -12.259 -18.137
  478    H    GLY  64           H        GLY  64   4.542 -11.318 -15.590
  479   1HA   GLY  64          2HA       GLY  64   7.116 -10.938 -15.160
  480   2HA   GLY  64          1HA       GLY  64   7.201 -11.116 -16.911
  481    H    VAL  65           H        VAL  65   5.108  -9.353 -14.595
  482    HA   VAL  65           HA       VAL  65   5.632  -6.854 -16.145
  483    HB   VAL  65           HB       VAL  65   2.903  -7.668 -15.090
  484   1HG1  VAL  65          1HG1      VAL  65   2.499  -5.744 -16.965
  485   2HG1  VAL  65          2HG1      VAL  65   4.072  -5.245 -16.342
  486   3HG1  VAL  65          3HG1      VAL  65   2.698  -5.396 -15.248
  487   1HG2  VAL  65          1HG2      VAL  65   2.355  -7.859 -17.565
  488   2HG2  VAL  65          2HG2      VAL  65   3.404  -9.131 -16.941
  489   3HG2  VAL  65          3HG2      VAL  65   4.090  -7.804 -17.877
  490    H    GLY  66           H        GLY  66   6.469  -5.386 -14.752
  491   1HA   GLY  66          2HA       GLY  66   6.364  -5.761 -11.877
  492   2HA   GLY  66          1HA       GLY  66   7.112  -4.405 -12.713
  493    H    VAL  67           H        VAL  67   4.115  -5.660 -11.413
  494    HA   VAL  67           HA       VAL  67   2.493  -3.350 -12.091
  495    HB   VAL  67           HB       VAL  67   1.970  -5.311  -9.840
  496   1HG1  VAL  67          1HG1      VAL  67  -0.400  -4.810 -10.471
  497   2HG1  VAL  67          2HG1      VAL  67   0.198  -3.611 -11.618
  498   3HG1  VAL  67          3HG1      VAL  67   0.475  -3.394  -9.891
  499   1HG2  VAL  67          1HG2      VAL  67   2.296  -6.780 -11.640
  500   2HG2  VAL  67          2HG2      VAL  67   1.704  -5.614 -12.824
  501   3HG2  VAL  67          3HG2      VAL  67   0.571  -6.436 -11.752
  502    H    ASN  68           H        ASN  68   2.323  -1.451 -11.011
  503    HA   ASN  68           HA       ASN  68   3.783  -1.181  -8.414
  504   1HB   ASN  68          2HB       ASN  68   3.282   0.714 -10.704
  505   2HB   ASN  68          1HB       ASN  68   3.649   1.338  -9.096
  506   1HD2  ASN  68          1HD2      ASN  68   5.019  -0.197 -11.922
  507   2HD2  ASN  68          2HD2      ASN  68   6.613  -0.284 -11.346
  508    HA   PRO  69           HA       PRO  69   0.017  -0.032  -6.435
  509   1HB   PRO  69          2HB       PRO  69   0.989   1.715  -4.541
  510   2HB   PRO  69          1HB       PRO  69   1.198  -0.042  -4.450
  511   1HG   PRO  69          2HG       PRO  69   3.199   2.050  -5.158
  512   2HG   PRO  69          1HG       PRO  69   3.455   0.442  -4.461
  513   1HD   PRO  69          2HD       PRO  69   3.846   1.163  -7.173
  514   2HD   PRO  69          1HD       PRO  69   3.793  -0.491  -6.527
  515    H    ALA  70           H        ALA  70  -0.269   1.195  -8.685
  516    HA   ALA  70           HA       ALA  70  -0.806   4.067  -8.057
  517   1HB   ALA  70          1HB       ALA  70   0.347   2.986 -10.648
  518   2HB   ALA  70          2HB       ALA  70   1.225   3.935  -9.448
  519   3HB   ALA  70          3HB       ALA  70  -0.103   4.666 -10.349
  520    H    GLN  71           H        GLN  71  -1.555   1.299 -10.191
  521    HA   GLN  71           HA       GLN  71  -3.995   2.552 -11.209
  522   1HB   GLN  71          2HB       GLN  71  -2.991  -0.307 -11.413
  523   2HB   GLN  71          1HB       GLN  71  -4.362   0.352 -12.303
  524   1HG   GLN  71          2HG       GLN  71  -2.878   0.924 -13.908
  525   2HG   GLN  71          1HG       GLN  71  -2.324   2.183 -12.802
  526   1HE2  GLN  71          1HE2      GLN  71  -1.684  -1.198 -13.809
  527   2HE2  GLN  71          2HE2      GLN  71  -0.076  -1.221 -13.265
  528    HA   PRO  72           HA       PRO  72  -6.798   1.086  -8.148
  529   1HB   PRO  72          2HB       PRO  72  -9.047   0.716  -9.686
  530   2HB   PRO  72          1HB       PRO  72  -8.435   2.310  -9.210
  531   1HG   PRO  72          2HG       PRO  72  -8.281   0.954 -11.864
  532   2HG   PRO  72          1HG       PRO  72  -8.292   2.685 -11.486
  533   1HD   PRO  72          2HD       PRO  72  -6.012   1.158 -12.158
  534   2HD   PRO  72          1HD       PRO  72  -6.002   2.783 -11.440
  535    H    ALA  73           H        ALA  73  -7.989  -0.833  -7.429
  536    HA   ALA  73           HA       ALA  73  -6.825  -3.325  -8.080
  537   1HB   ALA  73          1HB       ALA  73  -7.925  -3.367  -6.037
  538   2HB   ALA  73          2HB       ALA  73  -9.107  -4.196  -7.050
  539   3HB   ALA  73          3HB       ALA  73  -9.325  -2.492  -6.656
  540    H    GLY  74           H        GLY  74  -9.785  -1.810  -9.365
  541   1HA   GLY  74          2HA       GLY  74 -10.758  -4.023 -10.864
  542   2HA   GLY  74          1HA       GLY  74 -11.071  -2.333 -11.255
  543    H    ASN  75           H        ASN  75  -8.513  -1.404 -11.835
  544    HA   ASN  75           HA       ASN  75  -8.104  -2.415 -14.511
  545   1HB   ASN  75          2HB       ASN  75  -7.604  -0.049 -13.540
  546   2HB   ASN  75          1HB       ASN  75  -6.075  -0.758 -13.022
  547   1HD2  ASN  75          1HD2      ASN  75  -4.491  -1.248 -14.651
  548   2HD2  ASN  75          2HD2      ASN  75  -4.701  -0.836 -16.285
  549    H    ILE  76           H        ILE  76  -6.386  -2.874 -11.428
  550    HA   ILE  76           HA       ILE  76  -4.126  -4.289 -12.460
  551    HB   ILE  76           HB       ILE  76  -5.501  -4.503  -9.762
  552   1HG1  ILE  76          2HG1      ILE  76  -4.628  -2.242 -10.393
  553   2HG1  ILE  76          1HG1      ILE  76  -3.786  -2.938  -9.013
  554   1HG2  ILE  76          1HG2      ILE  76  -3.381  -5.471  -8.970
  555   2HG2  ILE  76          2HG2      ILE  76  -2.727  -5.404 -10.607
  556   3HG2  ILE  76          3HG2      ILE  76  -4.080  -6.474 -10.241
  557   1HD1  ILE  76          1HD1      ILE  76  -2.154  -1.975 -10.553
  558   2HD1  ILE  76          2HD1      ILE  76  -2.816  -2.919 -11.887
  559   3HD1  ILE  76          3HD1      ILE  76  -1.991  -3.730 -10.556
  560    H    PHE  77           H        PHE  77  -7.299  -5.455 -11.296
  561    HA   PHE  77           HA       PHE  77  -6.701  -8.251 -11.747
  562   1HB   PHE  77          2HB       PHE  77  -8.537  -7.227 -10.242
  563   2HB   PHE  77          1HB       PHE  77  -9.476  -7.059 -11.725
  564    HD1  PHE  77           HD1      PHE  77 -10.339  -8.995 -12.903
  565    HD2  PHE  77           HD2      PHE  77  -7.912  -9.458  -9.389
  566    HE1  PHE  77           HE1      PHE  77 -10.989 -11.383 -12.769
  567    HE2  PHE  77           HE2      PHE  77  -8.563 -11.849  -9.256
  568    HZ   PHE  77           HZ       PHE  77 -10.102 -12.810 -10.946
  569    H    LEU  78           H        LEU  78  -8.200  -5.694 -13.700
  570    HA   LEU  78           HA       LEU  78  -9.134  -7.380 -15.830
  571   1HB   LEU  78          2HB       LEU  78  -8.822  -4.509 -15.328
  572   2HB   LEU  78          1HB       LEU  78  -8.520  -4.938 -17.009
  573    HG   LEU  78           HG       LEU  78 -10.924  -4.395 -16.521
  574   1HD1  LEU  78          1HD1      LEU  78 -10.022  -6.078 -18.305
  575   2HD1  LEU  78          2HD1      LEU  78 -11.749  -6.061 -17.950
  576   3HD1  LEU  78          3HD1      LEU  78 -10.718  -7.308 -17.250
  577   1HD2  LEU  78          1HD2      LEU  78 -11.118  -7.062 -15.149
  578   2HD2  LEU  78          2HD2      LEU  78 -12.221  -5.688 -15.070
  579   3HD2  LEU  78          3HD2      LEU  78 -10.683  -5.635 -14.208
  580    H    LYS  79           H        LYS  79  -5.997  -5.847 -15.182
  581    HA   LYS  79           HA       LYS  79  -4.949  -6.716 -17.806
  582   1HB   LYS  79          2HB       LYS  79  -4.314  -4.647 -15.956
  583   2HB   LYS  79          1HB       LYS  79  -2.901  -5.695 -16.081
  584   1HG   LYS  79          2HG       LYS  79  -2.439  -4.962 -18.156
  585   2HG   LYS  79          1HG       LYS  79  -4.097  -5.239 -18.687
  586   1HD   LYS  79          2HD       LYS  79  -4.701  -3.088 -17.432
  587   2HD   LYS  79          1HD       LYS  79  -2.966  -2.780 -17.339
  588   1HE   LYS  79          2HE       LYS  79  -3.034  -1.943 -19.426
  589   2HE   LYS  79          1HE       LYS  79  -3.509  -3.535 -20.014
  590   1HZ   LYS  79          1HZ       LYS  79  -5.085  -1.732 -20.588
  591   2HZ   LYS  79          2HZ       LYS  79  -5.418  -1.530 -18.934
  592   3HZ   LYS  79          3HZ       LYS  79  -5.794  -2.996 -19.709
  593    H    HIS  80           H        HIS  80  -3.891  -7.155 -14.394
  594    HA   HIS  80           HA       HIS  80  -2.358  -9.545 -15.228
  595   1HB   HIS  80          2HB       HIS  80  -2.564  -8.518 -12.399
  596   2HB   HIS  80          1HB       HIS  80  -1.241  -9.402 -13.155
  597    HD1  HIS  80           HD1      HIS  80  -0.082  -7.975 -15.264
  598    HD2  HIS  80           HD2      HIS  80  -2.126  -5.797 -12.356
  599    HE1  HIS  80           HE1      HIS  80   0.705  -5.577 -15.477
  600    H    GLY  81           H        GLY  81  -4.883  -8.754 -12.800
  601   1HA   GLY  81          2HA       GLY  81  -6.853 -10.195 -12.548
  602   2HA   GLY  81          1HA       GLY  81  -5.869 -11.561 -13.071
  603    H    SER  82           H        SER  82  -5.513 -12.920 -11.400
  604    HA   SER  82           HA       SER  82  -5.154 -11.761  -8.667
  605   1HB   SER  82          2HB       SER  82  -7.020 -13.524  -9.293
  606   2HB   SER  82          1HB       SER  82  -5.694 -14.675  -9.140
  607    HG   SER  82           HG       SER  82  -6.653 -14.421  -7.138
  608    H    GLU  83           H        GLU  83  -3.798 -14.104 -10.989
  609    HA   GLU  83           HA       GLU  83  -1.701 -15.112  -9.345
  610   1HB   GLU  83          2HB       GLU  83  -2.238 -14.960 -12.273
  611   2HB   GLU  83          1HB       GLU  83  -0.568 -15.257 -11.788
  612   1HG   GLU  83          2HG       GLU  83  -2.698 -16.836 -10.413
  613   2HG   GLU  83          1HG       GLU  83  -2.322 -17.260 -12.082
  614    H    LEU  84           H        LEU  84  -0.500 -13.617  -8.213
  615    HA   LEU  84           HA       LEU  84   1.177 -11.740  -9.813
  616   1HB   LEU  84          2HB       LEU  84  -0.578 -11.065  -7.452
  617   2HB   LEU  84          1HB       LEU  84   0.850 -10.101  -7.827
  618    HG   LEU  84           HG       LEU  84  -0.945 -10.698 -10.116
  619   1HD1  LEU  84          1HD1      LEU  84  -2.043  -9.708  -7.684
  620   2HD1  LEU  84          2HD1      LEU  84  -2.825  -9.808  -9.261
  621   3HD1  LEU  84          3HD1      LEU  84  -1.945  -8.349  -8.803
  622   1HD2  LEU  84          1HD2      LEU  84  -0.252  -8.525 -10.814
  623   2HD2  LEU  84          2HD2      LEU  84   1.176  -9.246 -10.071
  624   3HD2  LEU  84          3HD2      LEU  84   0.217  -8.068  -9.176
  625    H    ARG  85           H        ARG  85   3.087 -10.965  -8.509
  626    HA   ARG  85           HA       ARG  85   3.846 -12.836  -6.309
  627   1HB   ARG  85          2HB       ARG  85   5.720 -12.058  -8.558
  628   2HB   ARG  85          1HB       ARG  85   6.006 -13.245  -7.286
  629   1HG   ARG  85          2HG       ARG  85   3.625 -14.095  -8.467
  630   2HG   ARG  85          1HG       ARG  85   4.608 -13.566  -9.832
  631   1HD   ARG  85          2HD       ARG  85   5.677 -15.544  -9.696
  632   2HD   ARG  85          1HD       ARG  85   6.386 -14.968  -8.190
  633    HE   ARG  85           HE       ARG  85   3.724 -16.133  -7.850
  634   1HH1  ARG  85          1HH2      ARG  85   5.730 -16.281  -5.697
  635   2HH1  ARG  85          2HH2      ARG  85   6.314 -17.908  -5.808
  636   1HH2  ARG  85          2HH1      ARG  85   5.075 -18.410  -9.023
  637   2HH2  ARG  85          1HH1      ARG  85   5.941 -19.122  -7.702
  638    H    LEU  86           H        LEU  86   5.370 -11.949  -4.812
  639    HA   LEU  86           HA       LEU  86   5.506  -8.976  -4.878
  640   1HB   LEU  86          2HB       LEU  86   4.733 -10.552  -2.846
  641   2HB   LEU  86          1HB       LEU  86   6.464 -10.518  -2.513
  642    HG   LEU  86           HG       LEU  86   5.373  -7.878  -3.194
  643   1HD1  LEU  86          1HD1      LEU  86   4.020  -9.558  -1.185
  644   2HD1  LEU  86          2HD1      LEU  86   3.471  -8.077  -1.969
  645   3HD1  LEU  86          3HD1      LEU  86   4.548  -7.990  -0.574
  646   1HD2  LEU  86          1HD2      LEU  86   7.517  -9.022  -1.752
  647   2HD2  LEU  86          2HD2      LEU  86   6.538  -8.173  -0.557
  648   3HD2  LEU  86          3HD2      LEU  86   7.170  -7.304  -1.955
  649    H    ILE  87           H        ILE  87   7.461  -7.884  -4.817
  650    HA   ILE  87           HA       ILE  87  10.002  -9.332  -4.532
  651    HB   ILE  87           HB       ILE  87   9.422  -9.722  -6.908
  652   1HG1  ILE  87          2HG1      ILE  87  11.631  -7.663  -6.592
  653   2HG1  ILE  87          1HG1      ILE  87  11.800  -9.389  -6.266
  654   1HG2  ILE  87          1HG2      ILE  87   8.822  -8.055  -8.392
  655   2HG2  ILE  87          2HG2      ILE  87   9.674  -6.798  -7.496
  656   3HG2  ILE  87          3HG2      ILE  87   8.126  -7.405  -6.908
  657   1HD1  ILE  87          1HD1      ILE  87  12.541  -9.362  -8.450
  658   2HD1  ILE  87          2HD1      ILE  87  11.548  -7.969  -8.880
  659   3HD1  ILE  87          3HD1      ILE  87  10.815  -9.567  -8.747
  660    HA   PRO  88           HA       PRO  88  10.970  -5.321  -2.925
  661   1HB   PRO  88          2HB       PRO  88  13.694  -5.660  -2.708
  662   2HB   PRO  88          1HB       PRO  88  12.526  -6.358  -1.571
  663   1HG   PRO  88          2HG       PRO  88  14.059  -7.704  -3.757
  664   2HG   PRO  88          1HG       PRO  88  13.471  -8.370  -2.224
  665   1HD   PRO  88          2HD       PRO  88  12.261  -8.770  -4.723
  666   2HD   PRO  88          1HD       PRO  88  11.472  -9.029  -3.152
  667    H    ARG  89           H        ARG  89  11.045  -3.495  -4.155
  668    HA   ARG  89           HA       ARG  89  11.735  -1.923  -5.750
  669   1HB   ARG  89          2HB       ARG  89  14.089  -3.553  -5.317
  670   2HB   ARG  89          1HB       ARG  89  13.974  -3.084  -7.013
  671   1HG   ARG  89          2HG       ARG  89  14.123  -0.825  -6.546
  672   2HG   ARG  89          1HG       ARG  89  13.465  -1.004  -4.918
  673   1HD   ARG  89          2HD       ARG  89  15.961  -2.477  -5.263
  674   2HD   ARG  89          1HD       ARG  89  16.159  -0.757  -5.589
  675    HE   ARG  89           HE       ARG  89  15.434  -0.285  -3.308
  676   1HH1  ARG  89          1HH2      ARG  89  17.605  -2.326  -2.923
  677   2HH1  ARG  89          2HH2      ARG  89  16.860  -3.426  -1.812
  678   1HH2  ARG  89          2HH1      ARG  89  13.647  -2.268  -2.414
  679   2HH2  ARG  89          1HH1      ARG  89  14.606  -3.412  -1.547
  680    H    ASP  90           H        ASP  90  11.228  -1.600  -7.929
  681    HA   ASP  90           HA       ASP  90   9.793  -3.721  -9.266
  682   1HB   ASP  90          2HB       ASP  90   9.931  -0.936  -9.491
  683   2HB   ASP  90          1HB       ASP  90  10.589  -1.525 -11.016
  684    H    ARG  91           H        ARG  91  10.830  -5.420 -10.201
  685    HA   ARG  91           HA       ARG  91  13.326  -4.846 -11.752
  686   1HB   ARG  91          2HB       ARG  91  12.763  -6.855  -9.664
  687   2HB   ARG  91          1HB       ARG  91  13.570  -7.489 -11.097
  688   1HG   ARG  91          2HG       ARG  91  15.129  -5.417 -10.844
  689   2HG   ARG  91          1HG       ARG  91  14.509  -5.359  -9.193
  690   1HD   ARG  91          2HD       ARG  91  15.096  -8.050  -9.584
  691   2HD   ARG  91          1HD       ARG  91  16.424  -7.211 -10.386
  692    HE   ARG  91           HE       ARG  91  16.186  -5.918  -7.942
  693   1HH1  ARG  91          1HH2      ARG  91  15.204  -8.883  -7.439
  694   2HH1  ARG  91          2HH2      ARG  91  16.640  -9.536  -6.731
  695   1HH2  ARG  91          2HH1      ARG  91  18.659  -6.883  -7.725
  696   2HH2  ARG  91          1HH1      ARG  91  18.604  -8.405  -6.899
  697    H    VAL  92           H        VAL  92  10.640  -7.203 -11.409
  698    HA   VAL  92           HA       VAL  92   9.384  -8.319 -13.045
  699    HB   VAL  92           HB       VAL  92  10.818  -6.677 -15.150
  700   1HG1  VAL  92          1HG1      VAL  92   8.698  -7.005 -16.368
  701   2HG1  VAL  92          2HG1      VAL  92   8.049  -7.908 -14.998
  702   3HG1  VAL  92          3HG1      VAL  92   9.412  -8.553 -15.914
  703   1HG2  VAL  92          1HG2      VAL  92  10.032  -4.951 -13.773
  704   2HG2  VAL  92          2HG2      VAL  92   8.640  -5.885 -13.226
  705   3HG2  VAL  92          3HG2      VAL  92   8.661  -5.206 -14.854
  706    H    GLY  93           H        GLY  93  10.809 -10.142 -12.387
  707   1HA   GLY  93          2HA       GLY  93  12.638 -10.943 -14.621
  708   2HA   GLY  93          1HA       GLY  93  13.026 -11.287 -12.935
  709    H    HIS  94           HN       HIS  94  10.405 -11.837 -15.312
  710    HA   HIS  94           HA       HIS  94  10.229 -14.638 -14.329
  711   1HB   HIS  94          2HB       HIS  94   8.302 -12.635 -13.733
  712   2HB   HIS  94          1HB       HIS  94   7.578 -13.699 -14.937
  713    HD1  HIS  94           HD1      HIS  94   8.048 -13.455 -11.396
  714    HD2  HIS  94           HD2      HIS  94   8.063 -16.605 -14.111
  715    HE1  HIS  94           HE1      HIS  94   7.712 -15.567 -10.042
  Start of MODEL   21
    1   1H    MET   1          1H        MET   1  -9.920 -13.965   3.420
    2   2H    MET   1          2H        MET   1 -11.536 -14.416   3.144
    3   3H    MET   1          3H        MET   1 -10.719 -14.973   4.526
    4    HA   MET   1           HA       MET   1 -10.490 -12.600   5.249
    5   1HB   MET   1          2HB       MET   1 -11.033 -11.822   2.834
    6   2HB   MET   1          1HB       MET   1 -12.718 -12.104   3.275
    7   1HG   MET   1          2HG       MET   1 -12.592 -10.517   5.090
    8   2HG   MET   1          1HG       MET   1 -10.845 -10.365   4.909
    9   1HE   MET   1          1HE       MET   1 -10.381  -8.963   1.461
   10   2HE   MET   1          2HE       MET   1  -9.900 -10.152   2.666
   11   3HE   MET   1          3HE       MET   1  -9.748  -8.434   3.027
   12    H    SER   2           H        SER   2 -11.675 -12.444   7.102
   13    HA   SER   2           HA       SER   2 -13.315 -12.918   8.702
   14   1HB   SER   2          2HB       SER   2 -14.634 -11.942   6.399
   15   2HB   SER   2          1HB       SER   2 -15.569 -13.338   6.920
   16    HG   SER   2           HG       SER   2 -15.162 -10.892   8.140
   17    H    GLY   3           H        GLY   3 -12.313 -14.984   9.120
   18   1HA   GLY   3          2HA       GLY   3 -12.801 -17.381   7.697
   19   2HA   GLY   3          1HA       GLY   3 -12.351 -17.310   9.400
   20    H    GLY   4           H        GLY   4 -14.810 -18.116   7.232
   21   1HA   GLY   4          2HA       GLY   4 -16.666 -19.480   8.167
   22   2HA   GLY   4          1HA       GLY   4 -16.782 -18.301   9.474
   23    H    THR   5           H        THR   5 -17.224 -15.966   8.648
   24    HA   THR   5           HA       THR   5 -19.565 -16.113   6.862
   25    HB   THR   5           HB       THR   5 -19.613 -14.802   8.997
   26    HG1  THR   5           HG1      THR   5 -21.101 -13.900   7.834
   27   1HG2  THR   5          1HG2      THR   5 -17.333 -13.460   7.641
   28   2HG2  THR   5          2HG2      THR   5 -17.624 -13.723   9.358
   29   3HG2  THR   5          3HG2      THR   5 -18.453 -12.415   8.515
   30    H    ALA   6           H        ALA   6 -19.833 -14.519   5.085
   31    HA   ALA   6           HA       ALA   6 -17.420 -14.374   3.425
   32   1HB   ALA   6          1HB       ALA   6 -19.584 -14.870   2.369
   33   2HB   ALA   6          2HB       ALA   6 -18.948 -13.345   1.749
   34   3HB   ALA   6          3HB       ALA   6 -20.237 -13.339   2.953
   35    H    ALA   7           H        ALA   7 -19.504 -12.149   5.238
   36    HA   ALA   7           HA       ALA   7 -19.295  -9.867   5.729
   37   1HB   ALA   7          1HB       ALA   7 -16.929  -9.235   6.387
   38   2HB   ALA   7          2HB       ALA   7 -16.426 -10.834   5.840
   39   3HB   ALA   7          3HB       ALA   7 -17.558 -10.677   7.182
   40    H    THR   8           H        THR   8 -19.645 -10.214   3.012
   41    HA   THR   8           HA       THR   8 -17.564  -8.835   1.500
   42    HB   THR   8           HB       THR   8 -19.349  -8.829  -0.321
   43    HG1  THR   8           HG1      THR   8 -21.285  -9.206   0.355
   44   1HG2  THR   8          1HG2      THR   8 -17.599 -10.665   0.190
   45   2HG2  THR   8          2HG2      THR   8 -18.962 -11.092  -0.846
   46   3HG2  THR   8          3HG2      THR   8 -18.957 -11.577   0.849
   47    H    THR   9           H        THR   9 -17.243  -6.699   1.823
   48    HA   THR   9           HA       THR   9 -19.361  -4.940   2.803
   49    HB   THR   9           HB       THR   9 -17.603  -3.143   2.457
   50    HG1  THR   9           HG1      THR   9 -15.663  -3.711   1.692
   51   1HG2  THR   9          1HG2      THR   9 -17.729  -5.246   4.352
   52   2HG2  THR   9          2HG2      THR   9 -17.011  -3.650   4.564
   53   3HG2  THR   9          3HG2      THR   9 -16.021  -4.993   3.992
   54    H    ALA  10           H        ALA  10 -17.657  -5.452  -0.279
   55    HA   ALA  10           HA       ALA  10 -19.644  -3.659  -1.618
   56   1HB   ALA  10          1HB       ALA  10 -17.734  -4.070  -3.511
   57   2HB   ALA  10          2HB       ALA  10 -16.759  -4.202  -2.048
   58   3HB   ALA  10          3HB       ALA  10 -17.686  -2.735  -2.360
   59    H    GLY  11           H        GLY  11 -20.619  -4.431  -3.584
   60   1HA   GLY  11          2HA       GLY  11 -21.239  -7.254  -3.592
   61   2HA   GLY  11          1HA       GLY  11 -21.741  -6.088  -4.817
   62    H    SER  12           H        SER  12 -19.651  -5.240  -6.110
   63    HA   SER  12           HA       SER  12 -18.390  -7.688  -7.214
   64   1HB   SER  12          2HB       SER  12 -17.714  -6.177  -9.087
   65   2HB   SER  12          1HB       SER  12 -19.454  -6.211  -8.833
   66    HG   SER  12           HG       SER  12 -18.748  -4.080  -9.035
   67    H    LYS  13           H        LYS  13 -16.380  -8.226  -6.568
   68    HA   LYS  13           HA       LYS  13 -14.407  -6.075  -6.019
   69   1HB   LYS  13          2HB       LYS  13 -13.722  -7.863  -4.065
   70   2HB   LYS  13          1HB       LYS  13 -14.678  -6.412  -3.784
   71   1HG   LYS  13          2HG       LYS  13 -16.721  -7.614  -3.808
   72   2HG   LYS  13          1HG       LYS  13 -15.981  -9.020  -4.573
   73   1HD   LYS  13          2HD       LYS  13 -16.064  -9.761  -2.380
   74   2HD   LYS  13          1HD       LYS  13 -14.475  -8.995  -2.383
   75   1HE   LYS  13          2HE       LYS  13 -16.263  -6.907  -1.831
   76   2HE   LYS  13          1HE       LYS  13 -16.863  -8.268  -0.885
   77   1HZ   LYS  13          1HZ       LYS  13 -14.304  -8.500  -0.353
   78   2HZ   LYS  13          2HZ       LYS  13 -15.315  -7.472   0.544
   79   3HZ   LYS  13          3HZ       LYS  13 -14.325  -6.835  -0.681
   80    H    VAL  14           H        VAL  14 -12.208  -6.800  -6.189
   81    HA   VAL  14           HA       VAL  14 -11.925  -9.299  -7.803
   82    HB   VAL  14           HB       VAL  14  -9.819  -8.249  -8.663
   83   1HG1  VAL  14          1HG1      VAL  14 -12.556  -7.195  -9.075
   84   2HG1  VAL  14          2HG1      VAL  14 -11.410  -7.847 -10.245
   85   3HG1  VAL  14          3HG1      VAL  14 -11.254  -6.180  -9.692
   86   1HG2  VAL  14          1HG2      VAL  14  -9.902  -5.623  -8.258
   87   2HG2  VAL  14          2HG2      VAL  14  -9.076  -6.683  -7.119
   88   3HG2  VAL  14          3HG2      VAL  14 -10.698  -6.103  -6.761
   89    H    THR  15           H        THR  15 -10.391 -10.828  -7.202
   90    HA   THR  15           HA       THR  15  -9.250 -10.505  -4.471
   91    HB   THR  15           HB       THR  15  -8.835 -12.999  -4.685
   92    HG1  THR  15           HG1      THR  15  -9.057 -13.775  -6.606
   93   1HG2  THR  15          1HG2      THR  15 -10.951 -13.456  -3.907
   94   2HG2  THR  15          2HG2      THR  15 -11.738 -12.570  -5.213
   95   3HG2  THR  15          3HG2      THR  15 -11.025 -11.695  -3.858
   96    H    PHE  16           H        PHE  16  -7.017 -10.830  -4.076
   97    HA   PHE  16           HA       PHE  16  -5.274 -10.918  -6.507
   98   1HB   PHE  16          2HB       PHE  16  -5.000  -9.155  -4.058
   99   2HB   PHE  16          1HB       PHE  16  -3.725  -9.367  -5.258
  100    HD1  PHE  16           HD1      PHE  16  -6.405  -7.318  -4.335
  101    HD2  PHE  16           HD2      PHE  16  -4.622  -9.124  -7.802
  102    HE1  PHE  16           HE1      PHE  16  -7.472  -5.606  -5.777
  103    HE2  PHE  16           HE2      PHE  16  -5.690  -7.412  -9.243
  104    HZ   PHE  16           HZ       PHE  16  -7.113  -5.653  -8.230
  105    H    LYS  17           H        LYS  17  -3.314 -12.024  -6.271
  106    HA   LYS  17           HA       LYS  17  -2.913 -13.509  -3.705
  107   1HB   LYS  17          2HB       LYS  17  -3.949 -14.836  -5.679
  108   2HB   LYS  17          1HB       LYS  17  -2.353 -14.711  -6.418
  109   1HG   LYS  17          2HG       LYS  17  -1.850 -15.498  -3.776
  110   2HG   LYS  17          1HG       LYS  17  -3.250 -16.451  -4.272
  111   1HD   LYS  17          2HD       LYS  17  -1.378 -16.367  -6.447
  112   2HD   LYS  17          1HD       LYS  17  -0.527 -16.866  -4.984
  113   1HE   LYS  17          2HE       LYS  17  -1.349 -18.928  -5.501
  114   2HE   LYS  17          1HE       LYS  17  -2.825 -18.317  -4.753
  115   1HZ   LYS  17          1HZ       LYS  17  -3.604 -19.001  -6.773
  116   2HZ   LYS  17          2HZ       LYS  17  -2.169 -18.624  -7.597
  117   3HZ   LYS  17          3HZ       LYS  17  -3.239 -17.384  -7.136
  118    H    ILE  18           H        ILE  18  -0.932 -12.937  -2.903
  119    HA   ILE  18           HA       ILE  18   1.227 -12.280  -4.873
  120    HB   ILE  18           HB       ILE  18   0.776 -11.085  -2.119
  121   1HG1  ILE  18          2HG1      ILE  18   0.745  -9.026  -3.920
  122   2HG1  ILE  18          1HG1      ILE  18  -0.006 -10.308  -4.870
  123   1HG2  ILE  18          1HG2      ILE  18   2.959 -10.539  -2.211
  124   2HG2  ILE  18          2HG2      ILE  18   2.604  -9.564  -3.637
  125   3HG2  ILE  18          3HG2      ILE  18   3.115 -11.241  -3.821
  126   1HD1  ILE  18          1HD1      ILE  18  -1.840  -9.349  -3.762
  127   2HD1  ILE  18          2HD1      ILE  18  -0.929  -9.094  -2.273
  128   3HD1  ILE  18          3HD1      ILE  18  -1.441 -10.720  -2.726
  129    H    THR  19           H        THR  19   3.040 -13.464  -4.729
  130    HA   THR  19           HA       THR  19   3.602 -14.992  -2.215
  131    HB   THR  19           HB       THR  19   4.377 -16.027  -4.939
  132    HG1  THR  19           HG1      THR  19   1.907 -16.399  -3.598
  133   1HG2  THR  19          1HG2      THR  19   5.410 -17.116  -3.052
  134   2HG2  THR  19          2HG2      THR  19   4.177 -18.204  -3.690
  135   3HG2  THR  19          3HG2      THR  19   3.858 -17.270  -2.228
  136    H    LEU  20           H        LEU  20   5.851 -15.122  -1.662
  137    HA   LEU  20           HA       LEU  20   7.485 -12.926  -2.583
  138   1HB   LEU  20          2HB       LEU  20   7.574 -14.799  -0.452
  139   2HB   LEU  20          1HB       LEU  20   9.088 -14.971  -1.338
  140    HG   LEU  20           HG       LEU  20   8.008 -12.255  -0.579
  141   1HD1  LEU  20          1HD1      LEU  20   9.967 -12.641   1.235
  142   2HD1  LEU  20          2HD1      LEU  20   9.367 -14.294   1.109
  143   3HD1  LEU  20          3HD1      LEU  20   8.274 -12.994   1.576
  144   1HD2  LEU  20          1HD2      LEU  20   9.741 -11.853  -2.039
  145   2HD2  LEU  20          2HD2      LEU  20  10.518 -13.400  -1.706
  146   3HD2  LEU  20          3HD2      LEU  20  10.699 -12.061  -0.572
  147    H    THR  21           H        THR  21   9.158 -12.897  -4.067
  148    HA   THR  21           HA       THR  21   9.251 -15.119  -5.990
  149    HB   THR  21           HB       THR  21  10.876 -13.569  -7.189
  150    HG1  THR  21           HG1      THR  21  11.462 -11.799  -6.233
  151   1HG2  THR  21          1HG2      THR  21   8.040 -13.364  -6.786
  152   2HG2  THR  21          2HG2      THR  21   8.974 -12.998  -8.235
  153   3HG2  THR  21          3HG2      THR  21   8.706 -11.749  -7.021
  154    H    SER  22           H        SER  22  11.571 -13.468  -3.816
  155    HA   SER  22           HA       SER  22  13.724 -15.326  -4.457
  156   1HB   SER  22          2HB       SER  22  13.392 -12.903  -2.878
  157   2HB   SER  22          1HB       SER  22  14.329 -14.111  -2.003
  158    HG   SER  22           HG       SER  22  15.481 -12.651  -3.519
  159    H    ASP  23           H        ASP  23  11.778 -14.774  -1.493
  160    HA   ASP  23           HA       ASP  23  12.715 -17.259  -0.285
  161   1HB   ASP  23          2HB       ASP  23  11.854 -15.013   0.836
  162   2HB   ASP  23          1HB       ASP  23  10.287 -15.809   0.707
  163    HA   PRO  24           HA       PRO  24   9.583 -19.779  -2.181
  164   1HB   PRO  24          2HB       PRO  24  10.231 -22.081  -0.819
  165   2HB   PRO  24          1HB       PRO  24  11.163 -21.471  -2.198
  166   1HG   PRO  24          2HG       PRO  24  11.843 -21.397   0.706
  167   2HG   PRO  24          1HG       PRO  24  12.922 -21.416  -0.698
  168   1HD   PRO  24          2HD       PRO  24  12.254 -19.142   0.845
  169   2HD   PRO  24          1HD       PRO  24  13.045 -19.127  -0.746
  170    H    LYS  25           H        LYS  25   7.704 -18.824  -1.230
  171    HA   LYS  25           HA       LYS  25   7.007 -19.663   1.538
  172   1HB   LYS  25          2HB       LYS  25   6.725 -17.240   0.120
  173   2HB   LYS  25          1HB       LYS  25   5.091 -17.873   0.326
  174   1HG   LYS  25          2HG       LYS  25   6.349 -18.341   2.786
  175   2HG   LYS  25          1HG       LYS  25   6.882 -16.730   2.310
  176   1HD   LYS  25          2HD       LYS  25   4.222 -16.626   1.667
  177   2HD   LYS  25          1HD       LYS  25   4.197 -17.666   3.091
  178   1HE   LYS  25          2HE       LYS  25   4.692 -15.947   4.472
  179   2HE   LYS  25          1HE       LYS  25   5.995 -15.387   3.424
  180   1HZ   LYS  25          1HZ       LYS  25   4.464 -13.677   3.338
  181   2HZ   LYS  25          2HZ       LYS  25   3.126 -14.723   3.323
  182   3HZ   LYS  25          3HZ       LYS  25   4.097 -14.562   1.939
  183    H    LEU  26           H        LEU  26   5.582 -21.275   1.827
  184    HA   LEU  26           HA       LEU  26   4.286 -22.622  -0.359
  185   1HB   LEU  26          2HB       LEU  26   4.517 -22.959   2.529
  186   2HB   LEU  26          1HB       LEU  26   2.890 -23.334   1.963
  187    HG   LEU  26           HG       LEU  26   4.950 -24.414   0.192
  188   1HD1  LEU  26          1HD1      LEU  26   5.768 -26.143   1.721
  189   2HD1  LEU  26          2HD1      LEU  26   4.833 -25.445   3.043
  190   3HD1  LEU  26          3HD1      LEU  26   6.183 -24.549   2.351
  191   1HD2  LEU  26          1HD2      LEU  26   2.562 -25.050   0.153
  192   2HD2  LEU  26          2HD2      LEU  26   2.696 -25.666   1.800
  193   3HD2  LEU  26          3HD2      LEU  26   3.577 -26.453   0.491
  194    HA   PRO  27           HA       PRO  27   0.290 -20.434   1.112
  195   1HB   PRO  27          2HB       PRO  27   0.489 -18.614   3.163
  196   2HB   PRO  27          1HB       PRO  27   0.173 -20.340   3.413
  197   1HG   PRO  27          2HG       PRO  27   2.682 -18.805   3.887
  198   2HG   PRO  27          1HG       PRO  27   2.116 -20.295   4.658
  199   1HD   PRO  27          2HD       PRO  27   4.072 -20.117   2.620
  200   2HD   PRO  27          1HD       PRO  27   3.269 -21.601   3.176
  201    H    PHE  28           H        PHE  28  -0.644 -18.215   0.691
  202    HA   PHE  28           HA       PHE  28   1.373 -16.218  -0.225
  203   1HB   PHE  28          2HB       PHE  28  -0.212 -15.849  -2.244
  204   2HB   PHE  28          1HB       PHE  28   0.863 -17.244  -2.284
  205    HD1  PHE  28           HD1      PHE  28  -2.627 -16.161  -1.575
  206    HD2  PHE  28           HD2      PHE  28   0.011 -19.475  -2.295
  207    HE1  PHE  28           HE1      PHE  28  -4.581 -17.670  -1.800
  208    HE2  PHE  28           HE2      PHE  28  -1.944 -20.982  -2.519
  209    HZ   PHE  28           HZ       PHE  28  -4.241 -20.079  -2.271
  210    H    LYS  29           H        LYS  29   0.413 -14.044  -0.550
  211    HA   LYS  29           HA       LYS  29  -1.487 -13.428   1.588
  212   1HB   LYS  29          2HB       LYS  29   0.592 -12.052   0.435
  213   2HB   LYS  29          1HB       LYS  29  -0.803 -11.272  -0.303
  214   1HG   LYS  29          2HG       LYS  29  -0.838 -11.785   2.649
  215   2HG   LYS  29          1HG       LYS  29   0.121 -10.439   2.034
  216   1HD   LYS  29          2HD       LYS  29  -1.775  -9.375   1.082
  217   2HD   LYS  29          1HD       LYS  29  -2.758 -10.833   1.213
  218   1HE   LYS  29          2HE       LYS  29  -2.190 -10.542   3.805
  219   2HE   LYS  29          1HE       LYS  29  -2.010  -8.855   3.324
  220   1HZ   LYS  29          1HZ       LYS  29  -4.392 -10.536   2.756
  221   2HZ   LYS  29          2HZ       LYS  29  -4.215  -8.884   2.399
  222   3HZ   LYS  29          3HZ       LYS  29  -4.282  -9.405   4.014
  223    H    VAL  30           H        VAL  30  -3.646 -13.488   1.292
  224    HA   VAL  30           HA       VAL  30  -4.744 -13.248  -1.469
  225    HB   VAL  30           HB       VAL  30  -6.124 -14.150   1.084
  226   1HG1  VAL  30          1HG1      VAL  30  -7.696 -13.308  -0.578
  227   2HG1  VAL  30          2HG1      VAL  30  -7.796 -15.068  -0.539
  228   3HG1  VAL  30          3HG1      VAL  30  -6.922 -14.262  -1.843
  229   1HG2  VAL  30          1HG2      VAL  30  -5.316 -16.235   0.730
  230   2HG2  VAL  30          2HG2      VAL  30  -4.156 -15.496  -0.372
  231   3HG2  VAL  30          3HG2      VAL  30  -5.668 -16.154  -0.996
  232    H    LEU  31           H        LEU  31  -5.542 -11.281  -2.031
  233    HA   LEU  31           HA       LEU  31  -6.507  -9.476   0.154
  234   1HB   LEU  31          2HB       LEU  31  -4.664  -9.050  -2.078
  235   2HB   LEU  31          1HB       LEU  31  -5.964  -7.858  -2.043
  236    HG   LEU  31           HG       LEU  31  -4.858  -8.424   0.613
  237   1HD1  LEU  31          1HD1      LEU  31  -3.087  -7.340  -1.589
  238   2HD1  LEU  31          2HD1      LEU  31  -2.752  -8.684  -0.499
  239   3HD1  LEU  31          3HD1      LEU  31  -2.780  -7.033   0.121
  240   1HD2  LEU  31          1HD2      LEU  31  -6.415  -6.544  -0.125
  241   2HD2  LEU  31          2HD2      LEU  31  -5.023  -5.826  -0.934
  242   3HD2  LEU  31          3HD2      LEU  31  -5.012  -6.037   0.817
  243    H    SER  32           H        SER  32  -8.698  -9.481   0.115
  244    HA   SER  32           HA       SER  32 -10.085  -9.572  -2.531
  245   1HB   SER  32          2HB       SER  32 -10.898 -10.378   0.255
  246   2HB   SER  32          1HB       SER  32 -12.125 -10.008  -0.951
  247    HG   SER  32           HG       SER  32 -10.767 -12.248  -0.647
  248    H    VAL  33           H        VAL  33 -10.169  -7.435  -3.156
  249    HA   VAL  33           HA       VAL  33 -11.645  -5.573  -1.342
  250    HB   VAL  33           HB       VAL  33 -10.163  -3.719  -2.228
  251   1HG1  VAL  33          1HG1      VAL  33  -9.773  -5.495  -0.115
  252   2HG1  VAL  33          2HG1      VAL  33  -8.984  -3.932  -0.320
  253   3HG1  VAL  33          3HG1      VAL  33  -8.192  -5.400  -0.890
  254   1HG2  VAL  33          1HG2      VAL  33  -7.836  -5.209  -2.810
  255   2HG2  VAL  33          2HG2      VAL  33  -8.773  -4.220  -3.930
  256   3HG2  VAL  33          3HG2      VAL  33  -9.122  -5.940  -3.770
  257    HA   PRO  34           HA       PRO  34 -14.055  -4.646  -4.889
  258   1HB   PRO  34          2HB       PRO  34 -14.681  -2.010  -4.401
  259   2HB   PRO  34          1HB       PRO  34 -15.418  -3.373  -3.543
  260   1HG   PRO  34          2HG       PRO  34 -13.329  -1.462  -2.592
  261   2HG   PRO  34          1HG       PRO  34 -14.547  -2.348  -1.660
  262   1HD   PRO  34          2HD       PRO  34 -11.830  -3.046  -1.851
  263   2HD   PRO  34          1HD       PRO  34 -13.131  -4.120  -1.297
  264    H    GLU  35           H        GLU  35 -14.139  -3.259  -6.855
  265    HA   GLU  35           HA       GLU  35 -11.584  -2.794  -8.019
  266   1HB   GLU  35          2HB       GLU  35 -14.383  -1.961  -8.768
  267   2HB   GLU  35          1HB       GLU  35 -12.998  -1.427  -9.720
  268   1HG   GLU  35          2HG       GLU  35 -13.448  -3.400 -10.828
  269   2HG   GLU  35          1HG       GLU  35 -12.379  -4.028  -9.574
  270    H    SER  36           H        SER  36 -13.696  -0.660  -6.174
  271    HA   SER  36           HA       SER  36 -12.545   1.848  -6.912
  272   1HB   SER  36          2HB       SER  36 -14.409   0.874  -4.942
  273   2HB   SER  36          1HB       SER  36 -13.274   1.977  -4.171
  274    HG   SER  36           HG       SER  36 -14.964   3.160  -5.049
  275    H    THR  37           H        THR  37 -11.591  -0.554  -4.460
  276    HA   THR  37           HA       THR  37  -9.585   1.021  -3.163
  277    HB   THR  37           HB       THR  37  -9.698  -1.990  -3.553
  278    HG1  THR  37           HG1      THR  37 -10.606  -0.300  -1.459
  279   1HG2  THR  37          1HG2      THR  37  -8.168  -2.149  -1.709
  280   2HG2  THR  37          2HG2      THR  37  -8.266  -0.415  -1.399
  281   3HG2  THR  37          3HG2      THR  37  -7.464  -1.008  -2.854
  282    HA   PRO  38           HA       PRO  38  -6.702   1.122  -6.558
  283   1HB   PRO  38          2HB       PRO  38  -4.843   2.668  -5.253
  284   2HB   PRO  38          1HB       PRO  38  -6.315   3.318  -5.995
  285   1HG   PRO  38          2HG       PRO  38  -5.697   2.892  -3.108
  286   2HG   PRO  38          1HG       PRO  38  -6.801   4.056  -3.861
  287   1HD   PRO  38          2HD       PRO  38  -7.549   1.636  -2.597
  288   2HD   PRO  38          1HD       PRO  38  -8.588   2.641  -3.630
  289    H    PHE  39           H        PHE  39  -4.409   0.470  -6.920
  290    HA   PHE  39           HA       PHE  39  -3.715  -1.940  -5.510
  291   1HB   PHE  39          2HB       PHE  39  -3.080  -1.117  -7.939
  292   2HB   PHE  39          1HB       PHE  39  -1.676  -0.434  -7.117
  293    HD1  PHE  39           HD1      PHE  39  -3.674  -3.624  -7.052
  294    HD2  PHE  39           HD2      PHE  39   0.213  -1.793  -7.011
  295    HE1  PHE  39           HE1      PHE  39  -2.617  -5.866  -6.995
  296    HE2  PHE  39           HE2      PHE  39   1.267  -4.035  -6.955
  297    HZ   PHE  39           HZ       PHE  39  -0.147  -6.072  -6.947
  298    H    THR  40           H        THR  40  -3.087   1.394  -4.827
  299    HA   THR  40           HA       THR  40  -0.601   1.200  -3.430
  300    HB   THR  40           HB       THR  40  -1.638   3.159  -2.046
  301    HG1  THR  40           HG1      THR  40  -3.619   3.643  -2.486
  302   1HG2  THR  40          1HG2      THR  40  -1.548   3.550  -5.038
  303   2HG2  THR  40          2HG2      THR  40  -0.094   3.287  -4.075
  304   3HG2  THR  40          3HG2      THR  40  -1.104   4.701  -3.777
  305    H    ALA  41           H        ALA  41  -3.971   0.817  -2.318
  306    HA   ALA  41           HA       ALA  41  -3.210   0.088   0.394
  307   1HB   ALA  41          1HB       ALA  41  -5.534  -0.268   0.769
  308   2HB   ALA  41          2HB       ALA  41  -5.847  -0.548  -0.944
  309   3HB   ALA  41          3HB       ALA  41  -5.458   1.074  -0.371
  310    H    VAL  42           H        VAL  42  -4.054  -1.686  -2.578
  311    HA   VAL  42           HA       VAL  42  -4.203  -4.304  -1.439
  312    HB   VAL  42           HB       VAL  42  -3.285  -3.459  -4.209
  313   1HG1  VAL  42          1HG1      VAL  42  -3.453  -6.061  -2.897
  314   2HG1  VAL  42          2HG1      VAL  42  -2.749  -5.640  -4.457
  315   3HG1  VAL  42          3HG1      VAL  42  -4.473  -5.982  -4.332
  316   1HG2  VAL  42          1HG2      VAL  42  -5.882  -4.671  -4.120
  317   2HG2  VAL  42          2HG2      VAL  42  -5.463  -3.027  -4.603
  318   3HG2  VAL  42          3HG2      VAL  42  -5.834  -3.382  -2.916
  319    H    LEU  43           H        LEU  43  -1.434  -2.623  -2.968
  320    HA   LEU  43           HA       LEU  43   0.516  -4.647  -2.397
  321   1HB   LEU  43          2HB       LEU  43   0.681  -2.590  -3.979
  322   2HB   LEU  43          1HB       LEU  43   1.146  -1.695  -2.534
  323    HG   LEU  43           HG       LEU  43   2.588  -4.230  -2.781
  324   1HD1  LEU  43          1HD1      LEU  43   2.369  -3.797  -5.180
  325   2HD1  LEU  43          2HD1      LEU  43   4.024  -3.465  -4.669
  326   3HD1  LEU  43          3HD1      LEU  43   2.905  -2.133  -4.953
  327   1HD2  LEU  43          1HD2      LEU  43   3.123  -1.338  -2.224
  328   2HD2  LEU  43          2HD2      LEU  43   4.483  -2.344  -2.721
  329   3HD2  LEU  43          3HD2      LEU  43   3.559  -2.760  -1.277
  330    H    LYS  44           H        LYS  44  -0.756  -1.929  -0.539
  331    HA   LYS  44           HA       LYS  44   1.166  -1.825   1.554
  332   1HB   LYS  44          2HB       LYS  44  -0.910  -0.304   1.020
  333   2HB   LYS  44          1HB       LYS  44  -1.768  -1.420   2.080
  334   1HG   LYS  44          2HG       LYS  44  -0.942  -0.344   3.868
  335   2HG   LYS  44          1HG       LYS  44   0.694  -0.755   3.351
  336   1HD   LYS  44          2HD       LYS  44   0.205   1.271   1.643
  337   2HD   LYS  44          1HD       LYS  44  -0.832   1.773   2.979
  338   1HE   LYS  44          2HE       LYS  44   1.274   2.762   3.450
  339   2HE   LYS  44          1HE       LYS  44   1.203   1.344   4.495
  340   1HZ   LYS  44          1HZ       LYS  44   3.290   1.239   3.495
  341   2HZ   LYS  44          2HZ       LYS  44   2.698   1.694   1.969
  342   3HZ   LYS  44          3HZ       LYS  44   2.359   0.150   2.589
  343    H    PHE  45           H        PHE  45  -1.934  -3.621   1.409
  344    HA   PHE  45           HA       PHE  45  -1.576  -4.987   3.907
  345   1HB   PHE  45          2HB       PHE  45  -3.353  -5.311   1.525
  346   2HB   PHE  45          1HB       PHE  45  -3.236  -6.657   2.659
  347    HD1  PHE  45           HD1      PHE  45  -3.544  -6.118   5.176
  348    HD2  PHE  45           HD2      PHE  45  -4.741  -3.470   2.012
  349    HE1  PHE  45           HE1      PHE  45  -5.061  -4.934   6.740
  350    HE2  PHE  45           HE2      PHE  45  -6.258  -2.287   3.577
  351    HZ   PHE  45           HZ       PHE  45  -6.418  -3.018   5.941
  352    H    ALA  46           H        ALA  46  -0.768  -5.888   0.552
  353    HA   ALA  46           HA       ALA  46   0.068  -8.565   1.080
  354   1HB   ALA  46          1HB       ALA  46   1.092  -6.618  -1.011
  355   2HB   ALA  46          2HB       ALA  46  -0.277  -7.713  -1.204
  356   3HB   ALA  46          3HB       ALA  46   1.354  -8.362  -1.028
  357    H    ALA  47           H        ALA  47   1.955  -5.523   0.989
  358    HA   ALA  47           HA       ALA  47   4.458  -6.729   1.728
  359   1HB   ALA  47          1HB       ALA  47   5.297  -4.566   1.788
  360   2HB   ALA  47          2HB       ALA  47   3.821  -3.901   2.486
  361   3HB   ALA  47          3HB       ALA  47   3.874  -4.324   0.776
  362    H    GLU  48           H        GLU  48   1.747  -5.452   3.621
  363    HA   GLU  48           HA       GLU  48   3.004  -5.328   6.178
  364   1HB   GLU  48          2HB       GLU  48   0.205  -5.567   5.179
  365   2HB   GLU  48          1HB       GLU  48   0.486  -6.020   6.860
  366   1HG   GLU  48          2HG       GLU  48   1.299  -3.871   7.425
  367   2HG   GLU  48          1HG       GLU  48   1.543  -3.425   5.737
  368    H    GLU  49           H        GLU  49   1.160  -7.988   4.657
  369    HA   GLU  49           HA       GLU  49   1.635  -9.873   6.789
  370   1HB   GLU  49          2HB       GLU  49  -0.217 -10.011   5.081
  371   2HB   GLU  49          1HB       GLU  49   0.994 -10.470   3.886
  372   1HG   GLU  49          2HG       GLU  49   1.268 -12.075   6.290
  373   2HG   GLU  49          1HG       GLU  49  -0.370 -12.187   5.647
  374    H    PHE  50           H        PHE  50   3.416  -9.006   3.859
  375    HA   PHE  50           HA       PHE  50   5.233 -11.296   4.045
  376   1HB   PHE  50          2HB       PHE  50   4.904  -8.933   2.258
  377   2HB   PHE  50          1HB       PHE  50   6.507  -9.662   2.343
  378    HD1  PHE  50           HD1      PHE  50   2.918 -10.382   1.644
  379    HD2  PHE  50           HD2      PHE  50   6.969 -11.761   1.323
  380    HE1  PHE  50           HE1      PHE  50   2.179 -12.209   0.148
  381    HE2  PHE  50           HE2      PHE  50   6.222 -13.591  -0.170
  382    HZ   PHE  50           HZ       PHE  50   3.828 -13.815  -0.759
  383    H    LYS  51           H        LYS  51   4.999  -8.445   5.827
  384    HA   LYS  51           HA       LYS  51   6.450  -7.419   7.347
  385   1HB   LYS  51          2HB       LYS  51   7.420 -10.119   7.056
  386   2HB   LYS  51          1HB       LYS  51   8.789  -9.024   7.245
  387   1HG   LYS  51          2HG       LYS  51   8.344  -8.796   9.436
  388   2HG   LYS  51          1HG       LYS  51   6.713  -8.230   9.075
  389   1HD   LYS  51          2HD       LYS  51   6.945 -11.103   8.664
  390   2HD   LYS  51          1HD       LYS  51   7.409 -10.653  10.306
  391   1HE   LYS  51          2HE       LYS  51   5.182 -10.662  10.736
  392   2HE   LYS  51          1HE       LYS  51   5.176  -9.107   9.907
  393   1HZ   LYS  51          1HZ       LYS  51   5.009 -10.681   7.812
  394   2HZ   LYS  51          2HZ       LYS  51   3.625 -10.203   8.683
  395   3HZ   LYS  51          3HZ       LYS  51   4.308 -11.733   8.943
  396    H    VAL  52           H        VAL  52   6.483  -6.626   4.572
  397    HA   VAL  52           HA       VAL  52   9.277  -5.576   4.403
  398    HB   VAL  52           HB       VAL  52   9.055  -5.669   1.900
  399   1HG1  VAL  52          1HG1      VAL  52  10.327  -7.488   2.275
  400   2HG1  VAL  52          2HG1      VAL  52   8.852  -8.449   2.188
  401   3HG1  VAL  52          3HG1      VAL  52   9.442  -7.879   3.749
  402   1HG2  VAL  52          1HG2      VAL  52   7.171  -7.714   1.566
  403   2HG2  VAL  52          2HG2      VAL  52   6.983  -6.029   1.079
  404   3HG2  VAL  52          3HG2      VAL  52   6.383  -6.565   2.647
  405    HA   PRO  53           HA       PRO  53   7.332  -1.657   3.998
  406   1HB   PRO  53          2HB       PRO  53   9.281  -0.317   2.596
  407   2HB   PRO  53          1HB       PRO  53   9.405  -0.717   4.317
  408   1HG   PRO  53          2HG       PRO  53  10.783  -1.981   1.992
  409   2HG   PRO  53          1HG       PRO  53  11.302  -1.878   3.682
  410   1HD   PRO  53          2HD       PRO  53  10.166  -4.149   2.437
  411   2HD   PRO  53          1HD       PRO  53  10.372  -3.912   4.186
  412    H    ALA  54           H        ALA  54   5.730  -1.021   2.630
  413    HA   ALA  54           HA       ALA  54   5.467  -2.057  -0.049
  414   1HB   ALA  54          1HB       ALA  54   3.531  -1.424   1.385
  415   2HB   ALA  54          2HB       ALA  54   3.482  -0.633  -0.191
  416   3HB   ALA  54          3HB       ALA  54   4.002   0.268   1.232
  417    H    ALA  55           H        ALA  55   6.609   1.033   1.266
  418    HA   ALA  55           HA       ALA  55   6.721   2.480  -1.201
  419   1HB   ALA  55          1HB       ALA  55   8.296   3.965  -0.024
  420   2HB   ALA  55          2HB       ALA  55   8.478   2.767   1.257
  421   3HB   ALA  55          3HB       ALA  55   6.925   3.565   1.012
  422    H    THR  56           H        THR  56   8.968   0.193   0.315
  423    HA   THR  56           HA       THR  56  10.831   0.560  -1.994
  424    HB   THR  56           HB       THR  56  11.492  -0.985   0.513
  425    HG1  THR  56           HG1      THR  56  11.821   0.808   1.577
  426   1HG2  THR  56          1HG2      THR  56  12.941  -1.031  -1.573
  427   2HG2  THR  56          2HG2      THR  56  13.756  -0.496  -0.104
  428   3HG2  THR  56          3HG2      THR  56  13.239   0.687  -1.306
  429    H    SER  57           H        SER  57   8.332  -0.976  -2.182
  430    HA   SER  57           HA       SER  57   9.513  -3.534  -3.085
  431   1HB   SER  57          2HB       SER  57   7.353  -3.310  -0.989
  432   2HB   SER  57          1HB       SER  57   7.500  -4.740  -2.003
  433    HG   SER  57           HG       SER  57   8.785  -4.310   0.177
  434    H    ALA  58           H        ALA  58   8.251  -4.571  -4.692
  435    HA   ALA  58           HA       ALA  58   5.852  -3.082  -5.668
  436   1HB   ALA  58          1HB       ALA  58   8.213  -4.042  -7.314
  437   2HB   ALA  58          2HB       ALA  58   7.699  -2.372  -7.078
  438   3HB   ALA  58          3HB       ALA  58   6.691  -3.482  -8.006
  439    H    ILE  59           H        ILE  59   4.647  -4.496  -7.342
  440    HA   ILE  59           HA       ILE  59   4.876  -7.377  -6.568
  441    HB   ILE  59           HB       ILE  59   2.468  -5.587  -6.781
  442   1HG1  ILE  59          2HG1      ILE  59   3.042  -7.886  -4.898
  443   2HG1  ILE  59          1HG1      ILE  59   3.666  -6.262  -4.609
  444   1HG2  ILE  59          1HG2      ILE  59   1.125  -7.795  -6.732
  445   2HG2  ILE  59          2HG2      ILE  59   2.588  -8.550  -7.363
  446   3HG2  ILE  59          3HG2      ILE  59   1.781  -7.284  -8.287
  447   1HD1  ILE  59          1HD1      ILE  59   1.637  -6.269  -3.417
  448   2HD1  ILE  59          2HD1      ILE  59   0.801  -7.192  -4.667
  449   3HD1  ILE  59          3HD1      ILE  59   1.202  -5.496  -4.941
  450    H    ILE  60           H        ILE  60   5.339  -8.643  -8.298
  451    HA   ILE  60           HA       ILE  60   4.835  -7.559 -11.024
  452    HB   ILE  60           HB       ILE  60   6.410  -9.252 -11.813
  453   1HG1  ILE  60          2HG1      ILE  60   7.333 -10.217  -9.229
  454   2HG1  ILE  60          1HG1      ILE  60   5.638 -10.632  -9.484
  455   1HG2  ILE  60          1HG2      ILE  60   7.259  -7.102 -10.825
  456   2HG2  ILE  60          2HG2      ILE  60   8.414  -8.429 -10.730
  457   3HG2  ILE  60          3HG2      ILE  60   7.499  -7.953  -9.301
  458   1HD1  ILE  60          1HD1      ILE  60   6.811 -12.429 -10.471
  459   2HD1  ILE  60          2HD1      ILE  60   8.022 -11.362 -11.182
  460   3HD1  ILE  60          3HD1      ILE  60   6.386 -11.402 -11.841
  461    H    THR  61           H        THR  61   4.252  -9.405 -12.682
  462    HA   THR  61           HA       THR  61   2.085 -11.077 -11.463
  463    HB   THR  61           HB       THR  61   1.219  -9.225 -12.869
  464    HG1  THR  61           HG1      THR  61  -0.033 -11.027 -12.886
  465   1HG2  THR  61          1HG2      THR  61   2.972 -10.531 -14.953
  466   2HG2  THR  61          2HG2      THR  61   2.967  -8.847 -14.435
  467   3HG2  THR  61          3HG2      THR  61   1.623  -9.481 -15.384
  468    H    ASN  62           H        ASN  62   1.475 -12.941 -13.076
  469    HA   ASN  62           HA       ASN  62   3.747 -14.681 -13.319
  470   1HB   ASN  62          2HB       ASN  62   1.268 -15.308 -13.032
  471   2HB   ASN  62          1HB       ASN  62   1.120 -15.052 -14.770
  472   1HD2  ASN  62          1HD2      ASN  62   2.582 -17.134 -12.300
  473   2HD2  ASN  62          2HD2      ASN  62   3.068 -18.358 -13.369
  474    H    ASP  63           H        ASP  63   2.364 -12.343 -15.511
  475    HA   ASP  63           HA       ASP  63   3.483 -13.525 -17.936
  476   1HB   ASP  63          2HB       ASP  63   2.495 -10.693 -17.476
  477   2HB   ASP  63          1HB       ASP  63   2.726 -11.486 -19.034
  478    H    GLY  64           H        GLY  64   4.658 -11.384 -15.439
  479   1HA   GLY  64          2HA       GLY  64   7.068 -11.033 -15.206
  480   2HA   GLY  64          1HA       GLY  64   7.207 -11.092 -16.963
  481    H    VAL  65           H        VAL  65   4.951  -9.256 -14.894
  482    HA   VAL  65           HA       VAL  65   6.075  -6.732 -16.045
  483    HB   VAL  65           HB       VAL  65   3.149  -7.280 -15.440
  484   1HG1  VAL  65          1HG1      VAL  65   4.473  -4.870 -15.550
  485   2HG1  VAL  65          2HG1      VAL  65   2.758  -5.090 -15.894
  486   3HG1  VAL  65          3HG1      VAL  65   3.925  -5.061 -17.215
  487   1HG2  VAL  65          1HG2      VAL  65   4.744  -7.352 -18.007
  488   2HG2  VAL  65          2HG2      VAL  65   3.005  -7.060 -18.008
  489   3HG2  VAL  65          3HG2      VAL  65   3.643  -8.574 -17.371
  490    H    GLY  66           H        GLY  66   6.695  -5.303 -14.494
  491   1HA   GLY  66          2HA       GLY  66   6.283  -5.940 -11.677
  492   2HA   GLY  66          1HA       GLY  66   7.210  -4.580 -12.306
  493    H    VAL  67           H        VAL  67   4.001  -5.704 -11.453
  494    HA   VAL  67           HA       VAL  67   2.558  -3.313 -12.164
  495    HB   VAL  67           HB       VAL  67   1.862  -5.287  -9.967
  496   1HG1  VAL  67          1HG1      VAL  67  -0.436  -4.591 -10.440
  497   2HG1  VAL  67          2HG1      VAL  67   0.131  -3.520 -11.721
  498   3HG1  VAL  67          3HG1      VAL  67   0.543  -3.181 -10.039
  499   1HG2  VAL  67          1HG2      VAL  67   1.538  -5.418 -12.965
  500   2HG2  VAL  67          2HG2      VAL  67   0.441  -6.285 -11.892
  501   3HG2  VAL  67          3HG2      VAL  67   2.164  -6.654 -11.874
  502    H    ASN  68           H        ASN  68   2.433  -1.389 -11.105
  503    HA   ASN  68           HA       ASN  68   3.767  -1.187  -8.440
  504   1HB   ASN  68          2HB       ASN  68   4.180   1.153  -8.965
  505   2HB   ASN  68          1HB       ASN  68   4.740   0.164 -10.311
  506   1HD2  ASN  68          1HD2      ASN  68   3.507   0.248 -12.328
  507   2HD2  ASN  68          2HD2      ASN  68   2.343   1.451 -12.600
  508    HA   PRO  69           HA       PRO  69   0.002   0.027  -6.542
  509   1HB   PRO  69          2HB       PRO  69   0.921   1.827  -4.673
  510   2HB   PRO  69          1HB       PRO  69   1.152   0.075  -4.550
  511   1HG   PRO  69          2HG       PRO  69   3.133   2.182  -5.260
  512   2HG   PRO  69          1HG       PRO  69   3.402   0.582  -4.548
  513   1HD   PRO  69          2HD       PRO  69   3.800   1.295  -7.266
  514   2HD   PRO  69          1HD       PRO  69   3.790  -0.352  -6.602
  515    H    ALA  70           H        ALA  70  -0.372   1.213  -8.780
  516    HA   ALA  70           HA       ALA  70  -1.028   4.058  -8.154
  517   1HB   ALA  70          1HB       ALA  70   0.108   3.136 -10.808
  518   2HB   ALA  70          2HB       ALA  70   1.044   3.960  -9.561
  519   3HB   ALA  70          3HB       ALA  70  -0.297   4.790 -10.350
  520    H    GLN  71           H        GLN  71  -1.593   1.298 -10.360
  521    HA   GLN  71           HA       GLN  71  -4.067   2.398 -11.420
  522   1HB   GLN  71          2HB       GLN  71  -2.889  -0.396 -11.487
  523   2HB   GLN  71          1HB       GLN  71  -4.361   0.069 -12.339
  524   1HG   GLN  71          2HG       GLN  71  -3.204   1.103 -13.984
  525   2HG   GLN  71          1HG       GLN  71  -2.150   1.923 -12.832
  526   1HE2  GLN  71          1HE2      GLN  71  -0.162   0.815 -12.170
  527   2HE2  GLN  71          2HE2      GLN  71   0.426  -0.524 -13.032
  528    HA   PRO  72           HA       PRO  72  -6.893   0.999  -8.344
  529   1HB   PRO  72          2HB       PRO  72  -9.109   0.548  -9.910
  530   2HB   PRO  72          1HB       PRO  72  -8.529   2.164  -9.472
  531   1HG   PRO  72          2HG       PRO  72  -8.308   0.732 -12.080
  532   2HG   PRO  72          1HG       PRO  72  -8.351   2.473 -11.756
  533   1HD   PRO  72          2HD       PRO  72  -6.036   0.962 -12.340
  534   2HD   PRO  72          1HD       PRO  72  -6.063   2.608 -11.671
  535    H    ALA  73           H        ALA  73  -8.029  -0.917  -7.567
  536    HA   ALA  73           HA       ALA  73  -6.827  -3.408  -8.146
  537   1HB   ALA  73          1HB       ALA  73  -8.976  -4.344  -7.030
  538   2HB   ALA  73          2HB       ALA  73  -9.427  -2.653  -6.819
  539   3HB   ALA  73          3HB       ALA  73  -7.951  -3.270  -6.080
  540    H    GLY  74           H        GLY  74  -9.800  -1.976  -9.492
  541   1HA   GLY  74          2HA       GLY  74 -10.731  -4.264 -10.913
  542   2HA   GLY  74          1HA       GLY  74 -11.085  -2.594 -11.354
  543    H    ASN  75           H        ASN  75  -8.561  -1.617 -11.965
  544    HA   ASN  75           HA       ASN  75  -8.129  -2.671 -14.615
  545   1HB   ASN  75          2HB       ASN  75  -7.691  -0.293 -13.876
  546   2HB   ASN  75          1HB       ASN  75  -6.263  -0.884 -13.026
  547   1HD2  ASN  75          1HD2      ASN  75  -7.717  -0.634 -16.297
  548   2HD2  ASN  75          2HD2      ASN  75  -6.242  -0.740 -17.129
  549    H    ILE  76           H        ILE  76  -6.391  -3.054 -11.529
  550    HA   ILE  76           HA       ILE  76  -4.108  -4.445 -12.535
  551    HB   ILE  76           HB       ILE  76  -5.494  -4.671  -9.842
  552   1HG1  ILE  76          2HG1      ILE  76  -4.684  -2.393 -10.450
  553   2HG1  ILE  76          1HG1      ILE  76  -3.790  -3.075  -9.096
  554   1HG2  ILE  76          1HG2      ILE  76  -3.252  -5.499  -9.073
  555   2HG2  ILE  76          2HG2      ILE  76  -2.753  -5.590 -10.761
  556   3HG2  ILE  76          3HG2      ILE  76  -4.068  -6.607 -10.174
  557   1HD1  ILE  76          1HD1      ILE  76  -2.102  -3.899 -10.870
  558   2HD1  ILE  76          2HD1      ILE  76  -2.115  -2.175 -10.508
  559   3HD1  ILE  76          3HD1      ILE  76  -2.904  -2.775 -11.967
  560    H    PHE  77           H        PHE  77  -7.246  -5.672 -11.339
  561    HA   PHE  77           HA       PHE  77  -6.599  -8.457 -11.801
  562   1HB   PHE  77          2HB       PHE  77  -8.432  -7.426 -10.270
  563   2HB   PHE  77          1HB       PHE  77  -9.403  -7.346 -11.739
  564    HD1  PHE  77           HD1      PHE  77  -7.788  -9.574  -9.293
  565    HD2  PHE  77           HD2      PHE  77 -10.136  -9.382 -12.886
  566    HE1  PHE  77           HE1      PHE  77  -8.349 -11.978  -9.057
  567    HE2  PHE  77           HE2      PHE  77 -10.695 -11.786 -12.648
  568    HZ   PHE  77           HZ       PHE  77  -9.803 -13.083 -10.734
  569    H    LEU  78           H        LEU  78  -8.228  -5.938 -13.700
  570    HA   LEU  78           HA       LEU  78  -9.186  -7.622 -15.812
  571   1HB   LEU  78          2HB       LEU  78  -8.954  -4.768 -15.275
  572   2HB   LEU  78          1HB       LEU  78  -8.606  -5.134 -16.962
  573    HG   LEU  78           HG       LEU  78 -11.025  -4.692 -16.553
  574   1HD1  LEU  78          1HD1      LEU  78 -10.148  -6.265 -18.355
  575   2HD1  LEU  78          2HD1      LEU  78 -11.825  -6.523 -17.876
  576   3HD1  LEU  78          3HD1      LEU  78 -10.562  -7.596 -17.275
  577   1HD2  LEU  78          1HD2      LEU  78 -11.385  -5.514 -14.347
  578   2HD2  LEU  78          2HD2      LEU  78 -10.694  -7.090 -14.736
  579   3HD2  LEU  78          3HD2      LEU  78 -12.263  -6.628 -15.394
  580    H    LYS  79           H        LYS  79  -6.108  -5.874 -15.382
  581    HA   LYS  79           HA       LYS  79  -5.128  -6.752 -18.004
  582   1HB   LYS  79          2HB       LYS  79  -4.553  -4.582 -16.530
  583   2HB   LYS  79          1HB       LYS  79  -3.258  -5.643 -15.972
  584   1HG   LYS  79          2HG       LYS  79  -3.227  -6.070 -18.695
  585   2HG   LYS  79          1HG       LYS  79  -3.625  -4.355 -18.591
  586   1HD   LYS  79          2HD       LYS  79  -1.483  -5.259 -16.761
  587   2HD   LYS  79          1HD       LYS  79  -1.080  -5.329 -18.476
  588   1HE   LYS  79          2HE       LYS  79  -1.495  -3.004 -18.776
  589   2HE   LYS  79          1HE       LYS  79  -2.318  -2.874 -17.223
  590   1HZ   LYS  79          1HZ       LYS  79  -0.243  -2.045 -16.747
  591   2HZ   LYS  79          2HZ       LYS  79   0.559  -3.123 -17.786
  592   3HZ   LYS  79          3HZ       LYS  79  -0.052  -3.670 -16.298
  593    H    HIS  80           H        HIS  80  -4.051  -7.323 -14.621
  594    HA   HIS  80           HA       HIS  80  -2.541  -9.694 -15.581
  595   1HB   HIS  80          2HB       HIS  80  -2.574  -8.434 -12.822
  596   2HB   HIS  80          1HB       HIS  80  -1.439  -9.646 -13.412
  597    HD1  HIS  80           HD1      HIS  80  -0.176  -8.782 -15.784
  598    HD2  HIS  80           HD2      HIS  80  -1.572  -5.884 -13.132
  599    HE1  HIS  80           HE1      HIS  80   1.047  -6.639 -16.355
  600    H    GLY  81           H        GLY  81  -4.644  -8.983 -12.749
  601   1HA   GLY  81          2HA       GLY  81  -6.722 -10.426 -12.566
  602   2HA   GLY  81          1HA       GLY  81  -5.681 -11.783 -12.990
  603    H    SER  82           H        SER  82  -5.472 -13.006 -11.180
  604    HA   SER  82           HA       SER  82  -5.090 -11.636  -8.556
  605   1HB   SER  82          2HB       SER  82  -6.889 -13.500  -9.051
  606   2HB   SER  82          1HB       SER  82  -5.525 -14.594  -8.836
  607    HG   SER  82           HG       SER  82  -6.529 -14.228  -6.854
  608    H    GLU  83           H        GLU  83  -3.627 -14.038 -10.733
  609    HA   GLU  83           HA       GLU  83  -1.538 -14.931  -9.029
  610   1HB   GLU  83          2HB       GLU  83  -2.278 -15.281 -11.741
  611   2HB   GLU  83          1HB       GLU  83  -0.601 -14.735 -11.751
  612   1HG   GLU  83          2HG       GLU  83  -1.679 -17.037 -10.092
  613   2HG   GLU  83          1HG       GLU  83  -0.751 -17.204 -11.582
  614    H    LEU  84           H        LEU  84  -0.289 -13.489  -7.935
  615    HA   LEU  84           HA       LEU  84   1.317 -11.552  -9.527
  616   1HB   LEU  84          2HB       LEU  84  -0.277 -10.889  -7.031
  617   2HB   LEU  84          1HB       LEU  84   0.971  -9.843  -7.707
  618    HG   LEU  84           HG       LEU  84  -1.264 -10.817  -9.465
  619   1HD1  LEU  84          1HD1      LEU  84  -2.657  -8.958  -8.825
  620   2HD1  LEU  84          2HD1      LEU  84  -1.410  -8.325  -7.749
  621   3HD1  LEU  84          3HD1      LEU  84  -2.239  -9.830  -7.352
  622   1HD2  LEU  84          1HD2      LEU  84   0.984  -9.285  -9.899
  623   2HD2  LEU  84          2HD2      LEU  84  -0.248  -8.053  -9.628
  624   3HD2  LEU  84          3HD2      LEU  84  -0.462  -9.248 -10.907
  625    H    ARG  85           H        ARG  85   3.176 -10.690  -8.149
  626    HA   ARG  85           HA       ARG  85   3.989 -12.568  -5.984
  627   1HB   ARG  85          2HB       ARG  85   5.142 -12.409  -8.640
  628   2HB   ARG  85          1HB       ARG  85   6.341 -11.995  -7.415
  629   1HG   ARG  85          2HG       ARG  85   6.281 -14.085  -6.444
  630   2HG   ARG  85          1HG       ARG  85   4.595 -14.358  -6.884
  631   1HD   ARG  85          2HD       ARG  85   5.529 -14.360  -9.341
  632   2HD   ARG  85          1HD       ARG  85   7.067 -14.711  -8.554
  633    HE   ARG  85           HE       ARG  85   6.188 -16.832  -7.853
  634   1HH1  ARG  85          2HH1      ARG  85   4.958 -16.388 -10.691
  635   2HH1  ARG  85          1HH1      ARG  85   3.352 -16.972 -10.412
  636   1HH2  ARG  85          1HH2      ARG  85   3.643 -16.922  -6.953
  637   2HH2  ARG  85          2HH2      ARG  85   2.606 -17.277  -8.294
  638    H    LEU  86           H        LEU  86   5.734 -11.670  -4.623
  639    HA   LEU  86           HA       LEU  86   5.677  -8.683  -4.636
  640   1HB   LEU  86          2HB       LEU  86   4.924 -10.258  -2.607
  641   2HB   LEU  86          1HB       LEU  86   6.652 -10.206  -2.259
  642    HG   LEU  86           HG       LEU  86   5.455  -7.593  -2.945
  643   1HD1  LEU  86          1HD1      LEU  86   4.154  -9.295  -1.013
  644   2HD1  LEU  86          2HD1      LEU  86   3.734  -7.654  -1.499
  645   3HD1  LEU  86          3HD1      LEU  86   4.886  -7.918  -0.190
  646   1HD2  LEU  86          1HD2      LEU  86   7.780  -7.854  -2.182
  647   2HD2  LEU  86          2HD2      LEU  86   7.218  -8.604  -0.688
  648   3HD2  LEU  86          3HD2      LEU  86   6.857  -6.908  -1.012
  649    H    ILE  87           H        ILE  87   7.527  -7.617  -5.053
  650    HA   ILE  87           HA       ILE  87  10.129  -9.067  -4.762
  651    HB   ILE  87           HB       ILE  87  10.910  -7.745  -6.773
  652   1HG1  ILE  87          2HG1      ILE  87   8.026  -7.375  -7.513
  653   2HG1  ILE  87          1HG1      ILE  87   8.781  -6.184  -6.453
  654   1HG2  ILE  87          1HG2      ILE  87  10.421  -9.553  -8.040
  655   2HG2  ILE  87          2HG2      ILE  87   8.684  -9.280  -7.906
  656   3HG2  ILE  87          3HG2      ILE  87   9.541 -10.148  -6.633
  657   1HD1  ILE  87          1HD1      ILE  87  10.098  -5.354  -8.113
  658   2HD1  ILE  87          2HD1      ILE  87   8.905  -6.092  -9.180
  659   3HD1  ILE  87          3HD1      ILE  87  10.400  -6.947  -8.804
  660    HA   PRO  88           HA       PRO  88  11.388  -5.488  -2.518
  661   1HB   PRO  88          2HB       PRO  88  14.111  -5.700  -2.859
  662   2HB   PRO  88          1HB       PRO  88  13.173  -6.750  -1.783
  663   1HG   PRO  88          2HG       PRO  88  14.364  -7.376  -4.442
  664   2HG   PRO  88          1HG       PRO  88  13.979  -8.465  -3.099
  665   1HD   PRO  88          2HD       PRO  88  12.443  -8.111  -5.460
  666   2HD   PRO  88          1HD       PRO  88  11.932  -8.969  -3.991
  667    H    ARG  89           H        ARG  89  10.389  -4.547  -4.871
  668    HA   ARG  89           HA       ARG  89  10.493  -2.722  -6.329
  669   1HB   ARG  89          2HB       ARG  89  11.948  -1.931  -4.152
  670   2HB   ARG  89          1HB       ARG  89  13.149  -1.786  -5.435
  671   1HG   ARG  89          2HG       ARG  89  12.157   0.282  -5.650
  672   2HG   ARG  89          1HG       ARG  89  11.086  -0.641  -6.703
  673   1HD   ARG  89          2HD       ARG  89   9.674  -1.081  -4.597
  674   2HD   ARG  89          1HD       ARG  89  10.615   0.207  -3.845
  675    HE   ARG  89           HE       ARG  89   9.786   1.647  -5.817
  676   1HH1  ARG  89          2HH1      ARG  89   8.198  -0.337  -7.271
  677   2HH1  ARG  89          1HH1      ARG  89   6.606  -0.141  -6.616
  678   1HH2  ARG  89          1HH2      ARG  89   7.693   1.584  -3.801
  679   2HH2  ARG  89          2HH2      ARG  89   6.320   0.951  -4.645
  680    H    ASP  90           H        ASP  90  11.875  -1.804  -8.151
  681    HA   ASP  90           HA       ASP  90  13.265  -2.087 -10.014
  682   1HB   ASP  90          2HB       ASP  90  14.934  -2.679  -8.048
  683   2HB   ASP  90          1HB       ASP  90  14.758  -4.318  -8.675
  684    H    ARG  91           H        ARG  91  13.454  -3.517 -11.839
  685    HA   ARG  91           HA       ARG  91  11.369  -5.560 -11.928
  686   1HB   ARG  91          2HB       ARG  91  11.873  -4.050 -13.857
  687   2HB   ARG  91          1HB       ARG  91  13.441  -4.837 -14.027
  688   1HG   ARG  91          2HG       ARG  91  12.010  -5.934 -15.589
  689   2HG   ARG  91          1HG       ARG  91  12.151  -7.041 -14.224
  690   1HD   ARG  91          2HD       ARG  91  10.017  -6.016 -13.306
  691   2HD   ARG  91          1HD       ARG  91   9.848  -5.175 -14.847
  692    HE   ARG  91           HE       ARG  91   9.354  -7.268 -15.897
  693   1HH1  ARG  91          1HH2      ARG  91   7.943  -7.662 -13.209
  694   2HH1  ARG  91          2HH2      ARG  91   8.456  -9.264 -12.798
  695   1HH2  ARG  91          2HH1      ARG  91  11.047  -9.314 -15.112
  696   2HH2  ARG  91          1HH1      ARG  91  10.218 -10.201 -13.877
  697    H    VAL  92           H        VAL  92  11.903  -7.366 -10.739
  698    HA   VAL  92           HA       VAL  92  14.301  -8.890 -11.637
  699    HB   VAL  92           HB       VAL  92  14.668  -9.575  -9.222
  700   1HG1  VAL  92          1HG1      VAL  92  16.016  -7.833 -10.460
  701   2HG1  VAL  92          2HG1      VAL  92  15.992  -7.627  -8.709
  702   3HG1  VAL  92          3HG1      VAL  92  14.982  -6.604  -9.731
  703   1HG2  VAL  92          1HG2      VAL  92  12.895  -7.166  -8.686
  704   2HG2  VAL  92          2HG2      VAL  92  13.744  -8.125  -7.475
  705   3HG2  VAL  92          3HG2      VAL  92  12.427  -8.842  -8.400
  706    H    GLY  93           H        GLY  93  13.953 -11.098 -11.776
  707   1HA   GLY  93          2HA       GLY  93  11.169 -12.010 -11.588
  708   2HA   GLY  93          1HA       GLY  93  12.531 -12.950 -12.199
  709    H    HIS  94           HN       HIS  94  14.181 -13.572 -10.437
  710    HA   HIS  94           HA       HIS  94  12.669 -14.701  -8.153
  711   1HB   HIS  94          2HB       HIS  94  14.343 -16.001  -9.663
  712   2HB   HIS  94          1HB       HIS  94  15.592 -15.190  -8.719
  713    HD1  HIS  94           HD1      HIS  94  12.647 -17.540  -8.296
  714    HD2  HIS  94           HD2      HIS  94  15.970 -16.234  -6.145
  715    HE1  HIS  94           HE1      HIS  94  12.775 -18.990  -6.225
  Start of MODEL   22
    1   1H    MET   1          1H        MET   1 -28.268  -6.098  -8.859
    2   2H    MET   1          2H        MET   1 -27.053  -4.911  -8.912
    3   3H    MET   1          3H        MET   1 -27.435  -5.675  -7.441
    4    HA   MET   1           HA       MET   1 -26.588  -7.759  -8.219
    5   1HB   MET   1          2HB       MET   1 -27.336  -7.218 -10.626
    6   2HB   MET   1          1HB       MET   1 -25.799  -6.363 -10.779
    7   1HG   MET   1          2HG       MET   1 -24.695  -8.523  -9.929
    8   2HG   MET   1          1HG       MET   1 -26.249  -9.302 -10.234
    9   1HE   MET   1          1HE       MET   1 -27.569  -8.758 -12.593
   10   2HE   MET   1          2HE       MET   1 -26.857 -10.338 -12.266
   11   3HE   MET   1          3HE       MET   1 -26.683  -9.616 -13.863
   12    H    SER   2           H        SER   2 -24.406  -8.215  -7.793
   13    HA   SER   2           HA       SER   2 -22.750  -5.850  -7.111
   14   1HB   SER   2          2HB       SER   2 -23.272  -8.048  -5.656
   15   2HB   SER   2          1HB       SER   2 -21.846  -8.628  -6.516
   16    HG   SER   2           HG       SER   2 -21.640  -7.363  -4.423
   17    H    GLY   3           H        GLY   3 -22.549  -8.903  -8.961
   18   1HA   GLY   3          2HA       GLY   3 -20.089  -7.860 -10.307
   19   2HA   GLY   3          1HA       GLY   3 -20.527  -9.564 -10.204
   20    H    GLY   4           H        GLY   4 -21.487  -6.470 -11.695
   21   1HA   GLY   4          2HA       GLY   4 -22.443  -7.997 -14.058
   22   2HA   GLY   4          1HA       GLY   4 -23.576  -6.879 -13.299
   23    H    THR   5           H        THR   5 -22.529  -4.593 -12.915
   24    HA   THR   5           HA       THR   5 -21.292  -3.790 -15.503
   25    HB   THR   5           HB       THR   5 -22.496  -1.966 -13.401
   26    HG1  THR   5           HG1      THR   5 -24.093  -3.374 -14.110
   27   1HG2  THR   5          1HG2      THR   5 -22.791  -1.028 -16.065
   28   2HG2  THR   5          2HG2      THR   5 -21.119  -1.562 -15.889
   29   3HG2  THR   5          3HG2      THR   5 -21.780  -0.351 -14.789
   30    H    ALA   6           H        ALA   6 -20.475  -4.210 -12.176
   31    HA   ALA   6           HA       ALA   6 -18.257  -2.259 -12.244
   32   1HB   ALA   6          1HB       ALA   6 -17.839  -3.614  -9.952
   33   2HB   ALA   6          2HB       ALA   6 -19.544  -3.997 -10.188
   34   3HB   ALA   6          3HB       ALA   6 -19.026  -2.314 -10.071
   35    H    ALA   7           H        ALA   7 -16.761  -3.011 -13.744
   36    HA   ALA   7           HA       ALA   7 -14.942  -4.261 -14.524
   37   1HB   ALA   7          1HB       ALA   7 -14.153  -4.482 -12.241
   38   2HB   ALA   7          2HB       ALA   7 -14.005  -6.049 -13.034
   39   3HB   ALA   7          3HB       ALA   7 -15.328  -5.752 -11.908
   40    H    THR   8           H        THR   8 -15.160  -5.609 -16.206
   41    HA   THR   8           HA       THR   8 -17.510  -7.230 -16.534
   42    HB   THR   8           HB       THR   8 -16.346  -8.018 -18.625
   43    HG1  THR   8           HG1      THR   8 -14.295  -7.688 -18.790
   44   1HG2  THR   8          1HG2      THR   8 -17.589  -5.683 -18.112
   45   2HG2  THR   8          2HG2      THR   8 -16.921  -6.077 -19.696
   46   3HG2  THR   8          3HG2      THR   8 -16.005  -5.064 -18.578
   47    H    THR   9           H        THR   9 -14.144  -8.086 -15.664
   48    HA   THR   9           HA       THR   9 -15.040 -10.927 -15.461
   49    HB   THR   9           HB       THR   9 -12.523 -11.363 -15.216
   50    HG1  THR   9           HG1      THR   9 -11.209  -9.740 -15.483
   51   1HG2  THR   9          1HG2      THR   9 -12.270 -10.713 -17.796
   52   2HG2  THR   9          2HG2      THR   9 -14.009 -10.468 -17.641
   53   3HG2  THR   9          3HG2      THR   9 -13.304 -12.042 -17.267
   54    H    ALA  10           H        ALA  10 -14.146  -8.223 -13.461
   55    HA   ALA  10           HA       ALA  10 -13.343  -9.858 -11.168
   56   1HB   ALA  10          1HB       ALA  10 -14.274  -6.993 -11.019
   57   2HB   ALA  10          2HB       ALA  10 -12.676  -7.407 -11.638
   58   3HB   ALA  10          3HB       ALA  10 -13.119  -7.829  -9.985
   59    H    GLY  11           H        GLY  11 -16.166  -7.715 -11.756
   60   1HA   GLY  11          2HA       GLY  11 -18.453  -8.401 -11.358
   61   2HA   GLY  11          1HA       GLY  11 -17.860  -9.671 -10.289
   62    H    SER  12           H        SER  12 -18.182  -9.264  -8.154
   63    HA   SER  12           HA       SER  12 -18.990  -6.608  -7.270
   64   1HB   SER  12          2HB       SER  12 -19.092  -7.687  -5.008
   65   2HB   SER  12          1HB       SER  12 -20.038  -8.524  -6.234
   66    HG   SER  12           HG       SER  12 -18.699  -9.908  -4.923
   67    H    LYS  13           H        LYS  13 -16.274  -8.741  -6.250
   68    HA   LYS  13           HA       LYS  13 -14.652  -6.262  -5.825
   69   1HB   LYS  13          2HB       LYS  13 -14.534  -8.721  -4.052
   70   2HB   LYS  13          1HB       LYS  13 -13.700  -7.189  -3.805
   71   1HG   LYS  13          2HG       LYS  13 -16.274  -6.319  -3.983
   72   2HG   LYS  13          1HG       LYS  13 -16.522  -7.909  -3.260
   73   1HD   LYS  13          2HD       LYS  13 -14.340  -6.217  -2.128
   74   2HD   LYS  13          1HD       LYS  13 -15.999  -5.745  -1.768
   75   1HE   LYS  13          2HE       LYS  13 -16.456  -7.714  -0.610
   76   2HE   LYS  13          1HE       LYS  13 -15.188  -8.617  -1.443
   77   1HZ   LYS  13          1HZ       LYS  13 -13.581  -7.082  -0.283
   78   2HZ   LYS  13          2HZ       LYS  13 -14.380  -8.209   0.707
   79   3HZ   LYS  13          3HZ       LYS  13 -14.882  -6.586   0.689
   80    H    VAL  14           H        VAL  14 -12.266  -6.752  -5.821
   81    HA   VAL  14           HA       VAL  14 -11.644  -8.921  -7.788
   82    HB   VAL  14           HB       VAL  14  -9.521  -7.488  -8.160
   83   1HG1  VAL  14          1HG1      VAL  14 -10.778  -5.919  -9.665
   84   2HG1  VAL  14          2HG1      VAL  14 -12.275  -6.494  -8.932
   85   3HG1  VAL  14          3HG1      VAL  14 -11.253  -7.608  -9.840
   86   1HG2  VAL  14          1HG2      VAL  14  -9.886  -6.087  -6.105
   87   2HG2  VAL  14          2HG2      VAL  14 -11.299  -5.382  -6.889
   88   3HG2  VAL  14          3HG2      VAL  14  -9.695  -5.135  -7.577
   89    H    THR  15           H        THR  15 -10.557 -10.626  -6.941
   90    HA   THR  15           HA       THR  15  -9.084 -10.270  -4.374
   91    HB   THR  15           HB       THR  15  -9.806 -12.838  -5.832
   92    HG1  THR  15           HG1      THR  15 -11.702 -12.482  -5.041
   93   1HG2  THR  15          1HG2      THR  15  -7.953 -13.194  -4.337
   94   2HG2  THR  15          2HG2      THR  15  -9.398 -13.802  -3.529
   95   3HG2  THR  15          3HG2      THR  15  -8.724 -12.240  -3.069
   96    H    PHE  16           H        PHE  16  -6.867 -10.415  -4.307
   97    HA   PHE  16           HA       PHE  16  -5.470 -11.132  -6.859
   98   1HB   PHE  16          2HB       PHE  16  -4.515  -9.207  -4.724
   99   2HB   PHE  16          1HB       PHE  16  -3.751  -9.518  -6.278
  100    HD1  PHE  16           HD1      PHE  16  -5.152  -9.060  -8.406
  101    HD2  PHE  16           HD2      PHE  16  -6.157  -7.525  -4.523
  102    HE1  PHE  16           HE1      PHE  16  -6.576  -7.328  -9.460
  103    HE2  PHE  16           HE2      PHE  16  -7.581  -5.791  -5.579
  104    HZ   PHE  16           HZ       PHE  16  -7.790  -5.695  -8.047
  105    H    LYS  17           H        LYS  17  -3.894 -12.651  -6.751
  106    HA   LYS  17           HA       LYS  17  -3.209 -13.774  -4.065
  107   1HB   LYS  17          2HB       LYS  17  -4.167 -15.065  -6.333
  108   2HB   LYS  17          1HB       LYS  17  -2.431 -15.362  -6.410
  109   1HG   LYS  17          2HG       LYS  17  -2.580 -16.037  -3.945
  110   2HG   LYS  17          1HG       LYS  17  -4.332 -16.051  -4.162
  111   1HD   LYS  17          2HD       LYS  17  -4.059 -17.653  -6.051
  112   2HD   LYS  17          1HD       LYS  17  -2.323 -17.690  -5.736
  113   1HE   LYS  17          2HE       LYS  17  -3.601 -18.139  -3.245
  114   2HE   LYS  17          1HE       LYS  17  -4.413 -19.170  -4.421
  115   1HZ   LYS  17          1HZ       LYS  17  -2.622 -20.432  -3.706
  116   2HZ   LYS  17          2HZ       LYS  17  -1.554 -19.110  -3.689
  117   3HZ   LYS  17          3HZ       LYS  17  -2.066 -19.774  -5.167
  118    H    ILE  18           H        ILE  18  -1.344 -12.738  -3.440
  119    HA   ILE  18           HA       ILE  18   0.804 -12.355  -5.480
  120    HB   ILE  18           HB       ILE  18   0.538 -11.063  -2.748
  121   1HG1  ILE  18          2HG1      ILE  18   0.202  -9.196  -4.871
  122   2HG1  ILE  18          1HG1      ILE  18  -0.880 -10.546  -5.204
  123   1HG2  ILE  18          1HG2      ILE  18   2.130  -9.411  -3.950
  124   2HG2  ILE  18          2HG2      ILE  18   2.390 -10.723  -5.101
  125   3HG2  ILE  18          3HG2      ILE  18   2.799 -10.948  -3.402
  126   1HD1  ILE  18          1HD1      ILE  18  -0.941  -9.873  -2.386
  127   2HD1  ILE  18          2HD1      ILE  18  -2.270  -9.924  -3.545
  128   3HD1  ILE  18          3HD1      ILE  18  -1.309  -8.456  -3.371
  129    H    THR  19           H        THR  19   2.609 -13.584  -5.337
  130    HA   THR  19           HA       THR  19   3.133 -15.075  -2.791
  131    HB   THR  19           HB       THR  19   4.213 -16.805  -4.192
  132    HG1  THR  19           HG1      THR  19   4.470 -16.531  -6.283
  133   1HG2  THR  19          1HG2      THR  19   2.243 -17.841  -4.771
  134   2HG2  THR  19          2HG2      THR  19   1.592 -16.402  -5.553
  135   3HG2  THR  19          3HG2      THR  19   1.584 -16.530  -3.796
  136    H    LEU  20           H        LEU  20   5.212 -14.897  -1.914
  137    HA   LEU  20           HA       LEU  20   6.896 -12.727  -2.816
  138   1HB   LEU  20          2HB       LEU  20   6.687 -14.249  -0.480
  139   2HB   LEU  20          1HB       LEU  20   8.267 -14.681  -1.129
  140    HG   LEU  20           HG       LEU  20   8.446 -12.731   0.364
  141   1HD1  LEU  20          1HD1      LEU  20   9.959 -11.658  -0.972
  142   2HD1  LEU  20          2HD1      LEU  20   8.805 -11.440  -2.284
  143   3HD1  LEU  20          3HD1      LEU  20   9.610 -12.992  -2.070
  144   1HD2  LEU  20          1HD2      LEU  20   7.253 -10.698  -1.234
  145   2HD2  LEU  20          2HD2      LEU  20   6.798 -11.200   0.393
  146   3HD2  LEU  20          3HD2      LEU  20   6.040 -11.959  -1.006
  147    H    THR  21           H        THR  21   8.400 -12.774  -4.401
  148    HA   THR  21           HA       THR  21   8.999 -15.312  -5.751
  149    HB   THR  21           HB       THR  21  10.294 -13.810  -7.322
  150    HG1  THR  21           HG1      THR  21  10.681 -11.869  -6.671
  151   1HG2  THR  21          1HG2      THR  21   8.280 -13.963  -8.323
  152   2HG2  THR  21          2HG2      THR  21   7.920 -12.388  -7.614
  153   3HG2  THR  21          3HG2      THR  21   7.427 -13.864  -6.782
  154    H    SER  22           H        SER  22  10.884 -12.820  -3.989
  155    HA   SER  22           HA       SER  22  13.409 -14.170  -4.343
  156   1HB   SER  22          2HB       SER  22  12.413 -11.862  -2.776
  157   2HB   SER  22          1HB       SER  22  13.837 -12.671  -2.124
  158    HG   SER  22           HG       SER  22  13.579 -11.085  -4.316
  159    H    ASP  23           H        ASP  23  11.095 -14.102  -1.602
  160    HA   ASP  23           HA       ASP  23  12.705 -16.225  -0.282
  161   1HB   ASP  23          2HB       ASP  23  11.462 -14.000   0.754
  162   2HB   ASP  23          1HB       ASP  23  10.288 -15.269   1.100
  163    HA   PRO  24           HA       PRO  24   9.633 -19.039  -1.959
  164   1HB   PRO  24          2HB       PRO  24  11.127 -21.287  -1.436
  165   2HB   PRO  24          1HB       PRO  24  11.370 -20.256  -2.856
  166   1HG   PRO  24          2HG       PRO  24  13.025 -20.466  -0.384
  167   2HG   PRO  24          1HG       PRO  24  13.510 -19.999  -2.022
  168   1HD   PRO  24          2HD       PRO  24  13.048 -18.228   0.133
  169   2HD   PRO  24          1HD       PRO  24  13.190 -17.774  -1.579
  170    H    LYS  25           H        LYS  25  11.223 -19.186   1.210
  171    HA   LYS  25           HA       LYS  25   9.524 -21.167   2.411
  172   1HB   LYS  25          2HB       LYS  25  11.785 -20.023   3.221
  173   2HB   LYS  25          1HB       LYS  25  10.671 -18.929   4.040
  174   1HG   LYS  25          2HG       LYS  25   9.560 -21.364   4.632
  175   2HG   LYS  25          1HG       LYS  25  11.279 -21.763   4.606
  176   1HD   LYS  25          2HD       LYS  25  11.317 -20.957   6.729
  177   2HD   LYS  25          1HD       LYS  25  11.247 -19.365   5.975
  178   1HE   LYS  25          2HE       LYS  25   8.631 -20.710   6.251
  179   2HE   LYS  25          1HE       LYS  25   9.402 -20.278   7.776
  180   1HZ   LYS  25          1HZ       LYS  25   9.641 -18.019   6.992
  181   2HZ   LYS  25          2HZ       LYS  25   8.010 -18.487   6.909
  182   3HZ   LYS  25          3HZ       LYS  25   8.954 -18.427   5.497
  183    H    LEU  26           H        LEU  26   9.267 -17.630   2.102
  184    HA   LEU  26           HA       LEU  26   7.034 -17.267   3.853
  185   1HB   LEU  26          2HB       LEU  26   8.401 -15.702   1.750
  186   2HB   LEU  26          1HB       LEU  26   6.705 -15.287   1.995
  187    HG   LEU  26           HG       LEU  26   7.973 -15.646   4.557
  188   1HD1  LEU  26          1HD1      LEU  26  10.083 -14.983   3.926
  189   2HD1  LEU  26          2HD1      LEU  26   9.350 -13.387   4.095
  190   3HD1  LEU  26          3HD1      LEU  26   9.499 -14.124   2.500
  191   1HD2  LEU  26          1HD2      LEU  26   6.137 -13.926   3.216
  192   2HD2  LEU  26          2HD2      LEU  26   7.378 -12.907   3.950
  193   3HD2  LEU  26          3HD2      LEU  26   6.457 -14.033   4.947
  194    HA   PRO  27           HA       PRO  27   3.892 -19.181   1.372
  195   1HB   PRO  27          2HB       PRO  27   1.788 -18.466   2.993
  196   2HB   PRO  27          1HB       PRO  27   2.899 -19.799   3.351
  197   1HG   PRO  27          2HG       PRO  27   2.747 -17.097   4.599
  198   2HG   PRO  27          1HG       PRO  27   3.359 -18.614   5.277
  199   1HD   PRO  27          2HD       PRO  27   4.935 -16.491   4.261
  200   2HD   PRO  27          1HD       PRO  27   5.506 -18.128   4.645
  201    H    PHE  28           H        PHE  28   1.963 -18.542   0.133
  202    HA   PHE  28           HA       PHE  28   2.169 -15.893  -1.002
  203   1HB   PHE  28          2HB       PHE  28   0.275 -16.546  -2.405
  204   2HB   PHE  28          1HB       PHE  28   1.438 -17.865  -2.318
  205    HD1  PHE  28           HD1      PHE  28   0.915 -19.939  -1.160
  206    HD2  PHE  28           HD2      PHE  28  -1.880 -16.676  -1.206
  207    HE1  PHE  28           HE1      PHE  28  -0.865 -21.451  -0.332
  208    HE2  PHE  28           HE2      PHE  28  -3.658 -18.190  -0.375
  209    HZ   PHE  28           HZ       PHE  28  -3.151 -20.577   0.061
  210    H    LYS  29           H        LYS  29   0.318 -14.356  -1.150
  211    HA   LYS  29           HA       LYS  29  -1.365 -14.327   1.327
  212   1HB   LYS  29          2HB       LYS  29   0.663 -12.440   0.462
  213   2HB   LYS  29          1HB       LYS  29  -0.913 -11.653   0.556
  214   1HG   LYS  29          2HG       LYS  29  -0.352 -11.439   2.766
  215   2HG   LYS  29          1HG       LYS  29  -0.976 -13.088   2.854
  216   1HD   LYS  29          2HD       LYS  29   1.520 -13.683   2.118
  217   2HD   LYS  29          1HD       LYS  29   1.857 -12.130   2.885
  218   1HE   LYS  29          2HE       LYS  29   1.049 -12.855   4.981
  219   2HE   LYS  29          1HE       LYS  29   0.179 -14.217   4.273
  220   1HZ   LYS  29          1HZ       LYS  29   2.685 -14.771   3.528
  221   2HZ   LYS  29          2HZ       LYS  29   1.972 -15.345   4.960
  222   3HZ   LYS  29          3HZ       LYS  29   2.974 -13.973   5.002
  223    H    VAL  30           H        VAL  30  -3.507 -14.040   0.914
  224    HA   VAL  30           HA       VAL  30  -4.313 -13.256  -1.855
  225    HB   VAL  30           HB       VAL  30  -5.944 -14.657   0.291
  226   1HG1  VAL  30          1HG1      VAL  30  -7.386 -15.212  -1.725
  227   2HG1  VAL  30          2HG1      VAL  30  -6.441 -14.031  -2.632
  228   3HG1  VAL  30          3HG1      VAL  30  -7.400 -13.514  -1.244
  229   1HG2  VAL  30          1HG2      VAL  30  -4.190 -16.151  -0.392
  230   2HG2  VAL  30          2HG2      VAL  30  -4.384 -15.704  -2.086
  231   3HG2  VAL  30          3HG2      VAL  30  -5.636 -16.642  -1.274
  232    H    LEU  31           H        LEU  31  -5.160 -11.253  -2.104
  233    HA   LEU  31           HA       LEU  31  -6.252  -9.864   0.313
  234   1HB   LEU  31          2HB       LEU  31  -4.320  -9.054  -1.687
  235   2HB   LEU  31          1HB       LEU  31  -5.699  -7.956  -1.696
  236    HG   LEU  31           HG       LEU  31  -4.994  -8.575   1.029
  237   1HD1  LEU  31          1HD1      LEU  31  -2.752  -7.582   1.088
  238   2HD1  LEU  31          2HD1      LEU  31  -2.759  -7.421  -0.668
  239   3HD1  LEU  31          3HD1      LEU  31  -2.746  -9.024   0.070
  240   1HD2  LEU  31          1HD2      LEU  31  -4.920  -6.160   1.209
  241   2HD2  LEU  31          2HD2      LEU  31  -6.232  -6.577   0.106
  242   3HD2  LEU  31          3HD2      LEU  31  -4.696  -5.992  -0.533
  243    H    SER  32           H        SER  32  -8.440  -9.785   0.234
  244    HA   SER  32           HA       SER  32  -9.782  -9.665  -2.430
  245   1HB   SER  32          2HB       SER  32 -11.841 -10.310  -1.114
  246   2HB   SER  32          1HB       SER  32 -10.566 -11.522  -1.103
  247    HG   SER  32           HG       SER  32 -11.081 -11.318   0.992
  248    H    VAL  33           H        VAL  33 -10.068  -7.560  -3.002
  249    HA   VAL  33           HA       VAL  33 -11.392  -5.747  -1.026
  250    HB   VAL  33           HB       VAL  33 -10.006  -3.865  -2.016
  251   1HG1  VAL  33          1HG1      VAL  33  -7.846  -5.365  -0.891
  252   2HG1  VAL  33          2HG1      VAL  33  -9.326  -5.809  -0.041
  253   3HG1  VAL  33          3HG1      VAL  33  -8.831  -4.119  -0.122
  254   1HG2  VAL  33          1HG2      VAL  33  -8.042  -5.960  -2.891
  255   2HG2  VAL  33          2HG2      VAL  33  -8.203  -4.287  -3.425
  256   3HG2  VAL  33          3HG2      VAL  33  -9.346  -5.505  -3.989
  257    HA   PRO  34           HA       PRO  34 -14.094  -4.808  -4.369
  258   1HB   PRO  34          2HB       PRO  34 -14.768  -2.211  -3.749
  259   2HB   PRO  34          1HB       PRO  34 -15.395  -3.625  -2.885
  260   1HG   PRO  34          2HG       PRO  34 -13.306  -1.670  -2.026
  261   2HG   PRO  34          1HG       PRO  34 -14.421  -2.629  -1.037
  262   1HD   PRO  34          2HD       PRO  34 -11.701  -3.219  -1.454
  263   2HD   PRO  34          1HD       PRO  34 -12.918  -4.353  -0.831
  264    H    GLU  35           H        GLU  35 -14.370  -3.340  -6.271
  265    HA   GLU  35           HA       GLU  35 -11.915  -2.752  -7.591
  266   1HB   GLU  35          2HB       GLU  35 -14.798  -2.118  -8.114
  267   2HB   GLU  35          1HB       GLU  35 -13.564  -1.296  -9.070
  268   1HG   GLU  35          2HG       GLU  35 -13.842  -3.181 -10.375
  269   2HG   GLU  35          1HG       GLU  35 -12.595  -3.775  -9.280
  270    H    SER  36           H        SER  36 -13.984  -0.752  -5.550
  271    HA   SER  36           HA       SER  36 -12.974   1.819  -6.245
  272   1HB   SER  36          2HB       SER  36 -14.592   0.672  -4.138
  273   2HB   SER  36          1HB       SER  36 -13.456   1.835  -3.462
  274    HG   SER  36           HG       SER  36 -15.503   2.705  -4.260
  275    H    THR  37           H        THR  37 -11.747  -0.640  -3.982
  276    HA   THR  37           HA       THR  37  -9.670   0.956  -2.818
  277    HB   THR  37           HB       THR  37  -9.777  -2.049  -3.240
  278    HG1  THR  37           HG1      THR  37 -10.645  -0.341  -1.154
  279   1HG2  THR  37          1HG2      THR  37  -7.534  -1.529  -2.687
  280   2HG2  THR  37          2HG2      THR  37  -8.278  -1.952  -1.145
  281   3HG2  THR  37          3HG2      THR  37  -8.019  -0.258  -1.563
  282    HA   PRO  38           HA       PRO  38  -7.071   1.108  -6.438
  283   1HB   PRO  38          2HB       PRO  38  -5.139   2.687  -5.287
  284   2HB   PRO  38          1HB       PRO  38  -6.679   3.313  -5.903
  285   1HG   PRO  38          2HG       PRO  38  -5.818   2.901  -3.079
  286   2HG   PRO  38          1HG       PRO  38  -7.004   4.041  -3.736
  287   1HD   PRO  38          2HD       PRO  38  -7.589   1.598  -2.421
  288   2HD   PRO  38          1HD       PRO  38  -8.735   2.590  -3.348
  289    H    PHE  39           H        PHE  39  -4.867   0.406  -7.009
  290    HA   PHE  39           HA       PHE  39  -3.998  -1.952  -5.624
  291   1HB   PHE  39          2HB       PHE  39  -3.608  -1.246  -8.103
  292   2HB   PHE  39          1HB       PHE  39  -2.203  -0.387  -7.472
  293    HD1  PHE  39           HD1      PHE  39  -3.822  -3.715  -6.779
  294    HD2  PHE  39           HD2      PHE  39  -0.222  -1.578  -7.745
  295    HE1  PHE  39           HE1      PHE  39  -2.544  -5.839  -6.721
  296    HE2  PHE  39           HE2      PHE  39   1.054  -3.703  -7.687
  297    HZ   PHE  39           HZ       PHE  39  -0.108  -5.832  -7.175
  298    H    THR  40           H        THR  40  -3.290   1.417  -5.130
  299    HA   THR  40           HA       THR  40  -0.710   1.231  -3.922
  300    HB   THR  40           HB       THR  40  -1.419   3.333  -2.690
  301    HG1  THR  40           HG1      THR  40  -3.481   3.579  -2.505
  302   1HG2  THR  40          1HG2      THR  40  -2.196   4.312  -5.179
  303   2HG2  THR  40          2HG2      THR  40  -1.247   2.876  -5.565
  304   3HG2  THR  40          3HG2      THR  40  -0.539   4.165  -4.591
  305    H    ALA  41           H        ALA  41  -3.987   0.938  -2.539
  306    HA   ALA  41           HA       ALA  41  -3.023   0.393   0.153
  307   1HB   ALA  41          1HB       ALA  41  -5.376  -0.164   0.631
  308   2HB   ALA  41          2HB       ALA  41  -5.741  -0.131  -1.094
  309   3HB   ALA  41          3HB       ALA  41  -5.268   1.352  -0.264
  310    H    VAL  42           H        VAL  42  -4.088  -1.572  -2.619
  311    HA   VAL  42           HA       VAL  42  -4.122  -4.114  -1.308
  312    HB   VAL  42           HB       VAL  42  -3.460  -3.443  -4.198
  313   1HG1  VAL  42          1HG1      VAL  42  -4.217  -5.819  -4.586
  314   2HG1  VAL  42          2HG1      VAL  42  -4.184  -6.053  -2.837
  315   3HG1  VAL  42          3HG1      VAL  42  -2.695  -5.683  -3.705
  316   1HG2  VAL  42          1HG2      VAL  42  -6.048  -4.190  -2.799
  317   2HG2  VAL  42          2HG2      VAL  42  -5.856  -4.117  -4.550
  318   3HG2  VAL  42          3HG2      VAL  42  -5.679  -2.654  -3.583
  319    H    LEU  43           H        LEU  43  -1.511  -2.459  -3.109
  320    HA   LEU  43           HA       LEU  43   0.488  -4.472  -2.702
  321   1HB   LEU  43          2HB       LEU  43   0.545  -2.507  -4.344
  322   2HB   LEU  43          1HB       LEU  43   1.020  -1.503  -2.974
  323    HG   LEU  43           HG       LEU  43   2.570  -3.995  -3.197
  324   1HD1  LEU  43          1HD1      LEU  43   3.954  -3.048  -5.099
  325   2HD1  LEU  43          2HD1      LEU  43   2.633  -1.919  -5.403
  326   3HD1  LEU  43          3HD1      LEU  43   2.365  -3.653  -5.570
  327   1HD2  LEU  43          1HD2      LEU  43   3.030  -2.011  -1.696
  328   2HD2  LEU  43          2HD2      LEU  43   3.432  -1.086  -3.142
  329   3HD2  LEU  43          3HD2      LEU  43   4.400  -2.492  -2.698
  330    H    LYS  44           H        LYS  44  -0.544  -1.696  -0.750
  331    HA   LYS  44           HA       LYS  44   1.616  -1.757   1.141
  332   1HB   LYS  44          2HB       LYS  44  -1.156  -0.621   1.091
  333   2HB   LYS  44          1HB       LYS  44  -0.321  -0.724   2.641
  334   1HG   LYS  44          2HG       LYS  44   1.672   0.391   1.416
  335   2HG   LYS  44          1HG       LYS  44   0.492   0.807   0.173
  336   1HD   LYS  44          2HD       LYS  44  -0.821   2.082   1.708
  337   2HD   LYS  44          1HD       LYS  44   0.056   1.439   3.097
  338   1HE   LYS  44          2HE       LYS  44   2.155   2.483   1.956
  339   2HE   LYS  44          1HE       LYS  44   0.983   3.442   1.051
  340   1HZ   LYS  44          1HZ       LYS  44   1.942   4.001   3.542
  341   2HZ   LYS  44          2HZ       LYS  44   0.395   3.368   3.850
  342   3HZ   LYS  44          3HZ       LYS  44   0.579   4.705   2.817
  343    H    PHE  45           H        PHE  45  -1.682  -3.159   1.297
  344    HA   PHE  45           HA       PHE  45  -1.346  -4.479   3.806
  345   1HB   PHE  45          2HB       PHE  45  -3.217  -4.699   1.498
  346   2HB   PHE  45          1HB       PHE  45  -3.139  -6.082   2.587
  347    HD1  PHE  45           HD1      PHE  45  -3.590  -5.777   5.035
  348    HD2  PHE  45           HD2      PHE  45  -4.224  -2.629   2.176
  349    HE1  PHE  45           HE1      PHE  45  -4.998  -4.565   6.676
  350    HE2  PHE  45           HE2      PHE  45  -5.630  -1.421   3.821
  351    HZ   PHE  45           HZ       PHE  45  -6.016  -2.390   6.068
  352    H    ALA  46           H        ALA  46  -0.793  -5.625   0.463
  353    HA   ALA  46           HA       ALA  46  -0.072  -8.306   1.119
  354   1HB   ALA  46          1HB       ALA  46   0.917  -8.409  -1.087
  355   2HB   ALA  46          2HB       ALA  46   1.049  -6.652  -1.162
  356   3HB   ALA  46          3HB       ALA  46  -0.538  -7.420  -1.197
  357    H    ALA  47           H        ALA  47   1.951  -5.376   0.758
  358    HA   ALA  47           HA       ALA  47   4.450  -6.670   1.339
  359   1HB   ALA  47          1HB       ALA  47   4.897  -4.611   0.441
  360   2HB   ALA  47          2HB       ALA  47   4.912  -4.123   2.134
  361   3HB   ALA  47          3HB       ALA  47   3.464  -3.873   1.159
  362    H    GLU  48           H        GLU  48   2.116  -4.929   3.418
  363    HA   GLU  48           HA       GLU  48   3.613  -5.077   5.842
  364   1HB   GLU  48          2HB       GLU  48   0.807  -4.552   5.085
  365   2HB   GLU  48          1HB       GLU  48   1.008  -5.232   6.698
  366   1HG   GLU  48          2HG       GLU  48   1.204  -2.921   7.081
  367   2HG   GLU  48          1HG       GLU  48   2.884  -3.446   6.972
  368    H    GLU  49           H        GLU  49   1.204  -7.330   4.457
  369    HA   GLU  49           HA       GLU  49   1.387  -9.236   6.629
  370   1HB   GLU  49          2HB       GLU  49   0.193  -9.199   3.889
  371   2HB   GLU  49          1HB       GLU  49   0.485 -10.773   4.628
  372   1HG   GLU  49          2HG       GLU  49  -1.570 -10.419   5.560
  373   2HG   GLU  49          1HG       GLU  49  -0.646  -9.471   6.726
  374    H    PHE  50           H        PHE  50   3.246  -8.662   3.710
  375    HA   PHE  50           HA       PHE  50   4.609 -11.263   3.819
  376   1HB   PHE  50          2HB       PHE  50   4.568  -8.913   2.009
  377   2HB   PHE  50          1HB       PHE  50   6.090  -9.796   2.087
  378    HD1  PHE  50           HD1      PHE  50   5.579 -12.524   2.278
  379    HD2  PHE  50           HD2      PHE  50   3.188  -9.587   0.255
  380    HE1  PHE  50           HE1      PHE  50   4.638 -14.294   0.823
  381    HE2  PHE  50           HE2      PHE  50   2.245 -11.358  -1.200
  382    HZ   PHE  50           HZ       PHE  50   2.971 -13.712  -0.917
  383    H    LYS  51           H        LYS  51   4.866  -8.625   5.760
  384    HA   LYS  51           HA       LYS  51   6.504  -7.858   7.231
  385   1HB   LYS  51          2HB       LYS  51   7.794 -10.447   6.331
  386   2HB   LYS  51          1HB       LYS  51   8.521  -9.394   7.544
  387   1HG   LYS  51          2HG       LYS  51   6.954  -9.910   9.130
  388   2HG   LYS  51          1HG       LYS  51   5.653 -10.048   7.947
  389   1HD   LYS  51          2HD       LYS  51   7.364 -12.148   7.290
  390   2HD   LYS  51          1HD       LYS  51   7.372 -12.135   9.053
  391   1HE   LYS  51          2HE       LYS  51   5.108 -12.596   9.210
  392   2HE   LYS  51          1HE       LYS  51   4.743 -11.852   7.654
  393   1HZ   LYS  51          1HZ       LYS  51   6.447 -14.233   7.678
  394   2HZ   LYS  51          2HZ       LYS  51   5.325 -13.711   6.514
  395   3HZ   LYS  51          3HZ       LYS  51   4.786 -14.442   7.948
  396    H    VAL  52           H        VAL  52   6.463  -6.832   4.552
  397    HA   VAL  52           HA       VAL  52   9.328  -6.031   4.299
  398    HB   VAL  52           HB       VAL  52   8.969  -5.932   1.795
  399   1HG1  VAL  52          1HG1      VAL  52  10.147  -7.810   2.986
  400   2HG1  VAL  52          2HG1      VAL  52   9.398  -8.288   1.462
  401   3HG1  VAL  52          3HG1      VAL  52   8.620  -8.694   2.992
  402   1HG2  VAL  52          1HG2      VAL  52   6.411  -6.023   2.082
  403   2HG2  VAL  52          2HG2      VAL  52   6.617  -7.758   2.321
  404   3HG2  VAL  52          3HG2      VAL  52   7.102  -7.013   0.798
  405    HA   PRO  53           HA       PRO  53   7.703  -1.951   4.248
  406   1HB   PRO  53          2HB       PRO  53   9.670  -0.678   2.810
  407   2HB   PRO  53          1HB       PRO  53   9.850  -1.192   4.495
  408   1HG   PRO  53          2HG       PRO  53  10.998  -2.413   2.026
  409   2HG   PRO  53          1HG       PRO  53  11.616  -2.452   3.685
  410   1HD   PRO  53          2HD       PRO  53  10.246  -4.555   2.390
  411   2HD   PRO  53          1HD       PRO  53  10.549  -4.431   4.136
  412    H    ALA  54           H        ALA  54   6.031  -1.219   3.048
  413    HA   ALA  54           HA       ALA  54   5.622  -1.955   0.280
  414   1HB   ALA  54          1HB       ALA  54   4.200  -0.162   2.232
  415   2HB   ALA  54          2HB       ALA  54   3.623  -1.635   1.454
  416   3HB   ALA  54          3HB       ALA  54   3.749  -0.141   0.527
  417    H    ALA  55           H        ALA  55   6.981   0.878   1.878
  418    HA   ALA  55           HA       ALA  55   6.833   2.741  -0.270
  419   1HB   ALA  55          1HB       ALA  55   7.716   2.920   2.256
  420   2HB   ALA  55          2HB       ALA  55   8.211   4.067   1.011
  421   3HB   ALA  55          3HB       ALA  55   9.272   2.727   1.447
  422    H    THR  56           H        THR  56   9.269   0.242   0.476
  423    HA   THR  56           HA       THR  56  10.516   0.796  -2.188
  424    HB   THR  56           HB       THR  56  12.523  -0.417  -1.214
  425    HG1  THR  56           HG1      THR  56  12.288  -1.274   0.668
  426   1HG2  THR  56          1HG2      THR  56  13.311   1.523  -0.006
  427   2HG2  THR  56          2HG2      THR  56  11.658   2.045   0.321
  428   3HG2  THR  56          3HG2      THR  56  12.284   2.080  -1.328
  429    H    SER  57           H        SER  57   8.152  -0.768  -2.013
  430    HA   SER  57           HA       SER  57   9.234  -3.464  -2.728
  431   1HB   SER  57          2HB       SER  57   7.014  -2.733  -0.906
  432   2HB   SER  57          1HB       SER  57   6.695  -4.066  -2.007
  433    HG   SER  57           HG       SER  57   7.696  -4.665   0.024
  434    H    ALA  58           H        ALA  58   8.021  -4.579  -4.365
  435    HA   ALA  58           HA       ALA  58   6.084  -2.955  -5.933
  436   1HB   ALA  58          1HB       ALA  58   7.446  -2.703  -7.721
  437   2HB   ALA  58          2HB       ALA  58   7.919  -4.401  -7.675
  438   3HB   ALA  58          3HB       ALA  58   8.774  -3.222  -6.681
  439    H    ILE  59           H        ILE  59   4.904  -4.355  -7.541
  440    HA   ILE  59           HA       ILE  59   4.916  -7.224  -6.684
  441    HB   ILE  59           HB       ILE  59   2.609  -5.335  -7.138
  442   1HG1  ILE  59          2HG1      ILE  59   3.108  -7.464  -5.035
  443   2HG1  ILE  59          1HG1      ILE  59   3.597  -5.779  -4.852
  444   1HG2  ILE  59          1HG2      ILE  59   1.555  -7.920  -6.750
  445   2HG2  ILE  59          2HG2      ILE  59   2.764  -8.096  -8.020
  446   3HG2  ILE  59          3HG2      ILE  59   1.447  -6.942  -8.213
  447   1HD1  ILE  59          1HD1      ILE  59   0.796  -6.888  -5.092
  448   2HD1  ILE  59          2HD1      ILE  59   1.151  -5.178  -5.336
  449   3HD1  ILE  59          3HD1      ILE  59   1.480  -5.933  -3.776
  450    H    ILE  60           H        ILE  60   5.711  -8.376  -8.364
  451    HA   ILE  60           HA       ILE  60   5.165  -7.454 -11.139
  452    HB   ILE  60           HB       ILE  60   6.913  -9.050 -11.817
  453   1HG1  ILE  60          2HG1      ILE  60   7.949  -9.698  -9.192
  454   2HG1  ILE  60          1HG1      ILE  60   6.293 -10.284  -9.347
  455   1HG2  ILE  60          1HG2      ILE  60   8.611  -7.996  -9.856
  456   2HG2  ILE  60          2HG2      ILE  60   7.298  -6.825  -9.986
  457   3HG2  ILE  60          3HG2      ILE  60   8.229  -7.268 -11.416
  458   1HD1  ILE  60          1HD1      ILE  60   8.623 -10.877 -11.190
  459   2HD1  ILE  60          2HD1      ILE  60   6.952 -11.299 -11.566
  460   3HD1  ILE  60          3HD1      ILE  60   7.751 -12.022 -10.171
  461    H    THR  61           H        THR  61   4.938  -9.542 -12.691
  462    HA   THR  61           HA       THR  61   2.777 -11.220 -11.471
  463    HB   THR  61           HB       THR  61   1.823 -11.370 -13.756
  464    HG1  THR  61           HG1      THR  61   2.902 -10.645 -15.396
  465   1HG2  THR  61          1HG2      THR  61   0.809  -9.254 -13.710
  466   2HG2  THR  61          2HG2      THR  61   2.275  -8.460 -13.140
  467   3HG2  THR  61          3HG2      THR  61   1.341  -9.479 -12.045
  468    H    ASN  62           H        ASN  62   2.534 -13.398 -12.459
  469    HA   ASN  62           HA       ASN  62   4.981 -14.873 -12.444
  470   1HB   ASN  62          2HB       ASN  62   2.376 -15.556 -12.206
  471   2HB   ASN  62          1HB       ASN  62   2.651 -16.037 -13.879
  472   1HD2  ASN  62          1HD2      ASN  62   2.197 -17.868 -11.614
  473   2HD2  ASN  62          2HD2      ASN  62   3.587 -18.830 -11.480
  474    H    ASP  63           H        ASP  63   3.296 -13.222 -15.025
  475    HA   ASP  63           HA       ASP  63   4.622 -14.678 -17.187
  476   1HB   ASP  63          2HB       ASP  63   3.332 -11.952 -17.420
  477   2HB   ASP  63          1HB       ASP  63   3.501 -13.187 -18.666
  478    H    GLY  64           H        GLY  64   5.040 -11.533 -15.556
  479   1HA   GLY  64          2HA       GLY  64   7.552 -11.022 -15.245
  480   2HA   GLY  64          1HA       GLY  64   7.639 -11.198 -16.996
  481    H    VAL  65           H        VAL  65   5.331  -9.541 -14.815
  482    HA   VAL  65           HA       VAL  65   5.880  -7.006 -16.305
  483    HB   VAL  65           HB       VAL  65   3.166  -7.972 -15.332
  484   1HG1  VAL  65          1HG1      VAL  65   3.414  -5.526 -15.272
  485   2HG1  VAL  65          2HG1      VAL  65   2.332  -6.000 -16.580
  486   3HG1  VAL  65          3HG1      VAL  65   3.995  -5.533 -16.938
  487   1HG2  VAL  65          1HG2      VAL  65   2.967  -7.667 -18.041
  488   2HG2  VAL  65          2HG2      VAL  65   3.292  -9.209 -17.248
  489   3HG2  VAL  65          3HG2      VAL  65   4.625  -8.251 -17.894
  490    H    GLY  66           H        GLY  66   6.699  -5.554 -14.885
  491   1HA   GLY  66          2HA       GLY  66   6.462  -5.923 -12.004
  492   2HA   GLY  66          1HA       GLY  66   7.303  -4.603 -12.814
  493    H    VAL  67           H        VAL  67   4.152  -5.742 -11.734
  494    HA   VAL  67           HA       VAL  67   2.709  -3.341 -12.496
  495    HB   VAL  67           HB       VAL  67   1.958  -5.396 -10.391
  496   1HG1  VAL  67          1HG1      VAL  67  -0.131  -4.114 -12.007
  497   2HG1  VAL  67          2HG1      VAL  67   0.767  -2.977 -11.003
  498   3HG1  VAL  67          3HG1      VAL  67  -0.048  -4.353 -10.262
  499   1HG2  VAL  67          1HG2      VAL  67   1.616  -5.348 -13.396
  500   2HG2  VAL  67          2HG2      VAL  67   0.560  -6.305 -12.356
  501   3HG2  VAL  67          3HG2      VAL  67   2.292  -6.635 -12.396
  502    H    ASN  68           H        ASN  68   2.536  -1.451 -11.389
  503    HA   ASN  68           HA       ASN  68   3.737  -1.317  -8.649
  504   1HB   ASN  68          2HB       ASN  68   3.802   0.547 -10.997
  505   2HB   ASN  68          1HB       ASN  68   3.869   1.233  -9.376
  506   1HD2  ASN  68          1HD2      ASN  68   6.020   0.903 -11.575
  507   2HD2  ASN  68          2HD2      ASN  68   7.314   0.159 -10.768
  508    HA   PRO  69           HA       PRO  69  -0.072   0.264  -7.113
  509   1HB   PRO  69          2HB       PRO  69   0.831   2.063  -5.231
  510   2HB   PRO  69          1HB       PRO  69   0.906   0.305  -5.024
  511   1HG   PRO  69          2HG       PRO  69   3.107   2.217  -5.638
  512   2HG   PRO  69          1HG       PRO  69   3.182   0.641  -4.834
  513   1HD   PRO  69          2HD       PRO  69   3.883   1.171  -7.527
  514   2HD   PRO  69          1HD       PRO  69   3.656  -0.434  -6.801
  515    H    ALA  70           H        ALA  70  -0.015   1.387  -9.466
  516    HA   ALA  70           HA       ALA  70  -0.497   4.301  -9.014
  517   1HB   ALA  70          1HB       ALA  70   1.691   3.959 -10.168
  518   2HB   ALA  70          2HB       ALA  70   0.524   4.817 -11.174
  519   3HB   ALA  70          3HB       ALA  70   0.845   3.107 -11.460
  520    H    GLN  71           H        GLN  71  -2.300   1.917  -9.177
  521    HA   GLN  71           HA       GLN  71  -4.238   3.043 -11.061
  522   1HB   GLN  71          2HB       GLN  71  -4.547   0.833 -12.257
  523   2HB   GLN  71          1HB       GLN  71  -3.033   1.653 -12.633
  524   1HG   GLN  71          2HG       GLN  71  -2.603   0.012 -10.327
  525   2HG   GLN  71          1HG       GLN  71  -3.397  -0.968 -11.559
  526   1HE2  GLN  71          1HE2      GLN  71  -2.199  -1.493 -13.471
  527   2HE2  GLN  71          2HE2      GLN  71  -0.578  -1.040 -13.695
  528    HA   PRO  72           HA       PRO  72  -7.033   1.275  -8.168
  529   1HB   PRO  72          2HB       PRO  72  -9.199   0.693  -9.761
  530   2HB   PRO  72          1HB       PRO  72  -8.749   2.335  -9.270
  531   1HG   PRO  72          2HG       PRO  72  -8.399   1.004 -11.918
  532   2HG   PRO  72          1HG       PRO  72  -8.586   2.724 -11.543
  533   1HD   PRO  72          2HD       PRO  72  -6.155   1.431 -12.156
  534   2HD   PRO  72          1HD       PRO  72  -6.317   3.043 -11.427
  535    H    ALA  73           H        ALA  73  -8.001  -0.727  -7.420
  536    HA   ALA  73           HA       ALA  73  -6.638  -3.121  -8.157
  537   1HB   ALA  73          1HB       ALA  73  -7.696  -2.807  -5.952
  538   2HB   ALA  73          2HB       ALA  73  -8.294  -4.270  -6.730
  539   3HB   ALA  73          3HB       ALA  73  -9.288  -2.813  -6.711
  540    H    GLY  74           H        GLY  74  -9.780  -1.804  -9.175
  541   1HA   GLY  74          2HA       GLY  74 -10.800  -4.071 -10.545
  542   2HA   GLY  74          1HA       GLY  74 -11.170  -2.399 -10.969
  543    H    ASN  75           H        ASN  75  -8.577  -1.508 -11.654
  544    HA   ASN  75           HA       ASN  75  -8.345  -2.489 -14.361
  545   1HB   ASN  75          2HB       ASN  75  -7.736  -0.164 -13.609
  546   2HB   ASN  75          1HB       ASN  75  -6.331  -0.846 -12.793
  547   1HD2  ASN  75          1HD2      ASN  75  -4.498  -1.399 -14.083
  548   2HD2  ASN  75          2HD2      ASN  75  -4.447  -1.178 -15.766
  549    H    ILE  76           H        ILE  76  -6.540  -3.096 -11.358
  550    HA   ILE  76           HA       ILE  76  -4.376  -4.582 -12.490
  551    HB   ILE  76           HB       ILE  76  -5.690  -4.805  -9.763
  552   1HG1  ILE  76          2HG1      ILE  76  -4.684  -2.576 -10.449
  553   2HG1  ILE  76          1HG1      ILE  76  -3.961  -3.302  -9.017
  554   1HG2  ILE  76          1HG2      ILE  76  -3.142  -5.607  -9.361
  555   2HG2  ILE  76          2HG2      ILE  76  -3.369  -6.191 -11.009
  556   3HG2  ILE  76          3HG2      ILE  76  -4.448  -6.735  -9.725
  557   1HD1  ILE  76          1HD1      ILE  76  -2.271  -2.410 -10.646
  558   2HD1  ILE  76          2HD1      ILE  76  -2.838  -3.599 -11.818
  559   3HD1  ILE  76          3HD1      ILE  76  -2.085  -4.133 -10.315
  560    H    PHE  77           H        PHE  77  -7.547  -5.649 -11.231
  561    HA   PHE  77           HA       PHE  77  -7.134  -8.450 -11.757
  562   1HB   PHE  77          2HB       PHE  77  -8.938  -7.247 -10.290
  563   2HB   PHE  77          1HB       PHE  77  -9.850  -7.150 -11.796
  564    HD1  PHE  77           HD1      PHE  77  -8.525  -9.374  -9.196
  565    HD2  PHE  77           HD2      PHE  77 -10.586  -9.198 -12.962
  566    HE1  PHE  77           HE1      PHE  77  -9.232 -11.734  -8.921
  567    HE2  PHE  77           HE2      PHE  77 -11.291 -11.558 -12.686
  568    HZ   PHE  77           HZ       PHE  77 -10.615 -12.826 -10.665
  569    H    LEU  78           H        LEU  78  -8.484  -5.777 -13.662
  570    HA   LEU  78           HA       LEU  78  -9.455  -7.379 -15.851
  571   1HB   LEU  78          2HB       LEU  78  -9.107  -4.536 -15.236
  572   2HB   LEU  78          1HB       LEU  78  -8.785  -4.900 -16.929
  573    HG   LEU  78           HG       LEU  78 -11.174  -4.352 -16.521
  574   1HD1  LEU  78          1HD1      LEU  78 -11.747  -7.027 -17.227
  575   2HD1  LEU  78          2HD1      LEU  78 -10.112  -6.713 -17.808
  576   3HD1  LEU  78          3HD1      LEU  78 -11.444  -5.677 -18.321
  577   1HD2  LEU  78          1HD2      LEU  78 -11.399  -6.975 -15.052
  578   2HD2  LEU  78          2HD2      LEU  78 -12.543  -5.633 -15.098
  579   3HD2  LEU  78          3HD2      LEU  78 -11.047  -5.485 -14.176
  580    H    LYS  79           H        LYS  79  -6.332  -5.867 -15.139
  581    HA   LYS  79           HA       LYS  79  -5.172  -6.441 -17.746
  582   1HB   LYS  79          2HB       LYS  79  -4.505  -4.760 -15.721
  583   2HB   LYS  79          1HB       LYS  79  -3.389  -6.088 -15.404
  584   1HG   LYS  79          2HG       LYS  79  -2.348  -5.877 -17.504
  585   2HG   LYS  79          1HG       LYS  79  -3.693  -4.967 -18.188
  586   1HD   LYS  79          2HD       LYS  79  -1.546  -3.661 -17.548
  587   2HD   LYS  79          1HD       LYS  79  -3.097  -2.989 -17.048
  588   1HE   LYS  79          2HE       LYS  79  -2.460  -3.082 -14.885
  589   2HE   LYS  79          1HE       LYS  79  -2.209  -4.820 -15.019
  590   1HZ   LYS  79          1HZ       LYS  79  -0.219  -3.405 -14.384
  591   2HZ   LYS  79          2HZ       LYS  79  -0.199  -2.888 -16.002
  592   3HZ   LYS  79          3HZ       LYS  79   0.007  -4.533 -15.630
  593    H    HIS  80           H        HIS  80  -4.508  -7.776 -14.474
  594    HA   HIS  80           HA       HIS  80  -3.557 -10.282 -15.812
  595   1HB   HIS  80          2HB       HIS  80  -2.840  -9.069 -13.126
  596   2HB   HIS  80          1HB       HIS  80  -2.314 -10.668 -13.657
  597    HD1  HIS  80           HD1      HIS  80  -0.808 -10.722 -15.879
  598    HD2  HIS  80           HD2      HIS  80  -1.335  -6.958 -14.164
  599    HE1  HIS  80           HE1      HIS  80   0.959  -9.218 -16.895
  600    H    GLY  81           H        GLY  81  -5.034  -9.296 -12.682
  601   1HA   GLY  81          2HA       GLY  81  -7.331 -10.241 -12.213
  602   2HA   GLY  81          1HA       GLY  81  -6.722 -11.767 -12.853
  603    H    SER  82           H        SER  82  -6.128 -13.195 -11.306
  604    HA   SER  82           HA       SER  82  -5.457 -12.168  -8.594
  605   1HB   SER  82          2HB       SER  82  -5.855 -14.513  -7.867
  606   2HB   SER  82          1HB       SER  82  -7.253 -13.822  -8.683
  607    HG   SER  82           HG       SER  82  -7.072 -15.552  -9.879
  608    H    GLU  83           H        GLU  83  -3.909 -13.457 -11.376
  609    HA   GLU  83           HA       GLU  83  -1.733 -14.817  -9.997
  610   1HB   GLU  83          2HB       GLU  83  -2.372 -15.412 -12.305
  611   2HB   GLU  83          1HB       GLU  83  -1.936 -13.793 -12.849
  612   1HG   GLU  83          2HG       GLU  83   0.334 -14.632 -11.485
  613   2HG   GLU  83          1HG       GLU  83  -0.213 -16.098 -12.298
  614    H    LEU  84           H        LEU  84  -0.576 -13.506  -8.614
  615    HA   LEU  84           HA       LEU  84   0.882 -11.219  -9.829
  616   1HB   LEU  84          2HB       LEU  84  -0.972 -11.093  -7.463
  617   2HB   LEU  84          1HB       LEU  84   0.423 -10.016  -7.540
  618    HG   LEU  84           HG       LEU  84  -1.631 -10.281  -9.754
  619   1HD1  LEU  84          1HD1      LEU  84  -1.344  -7.998  -7.791
  620   2HD1  LEU  84          2HD1      LEU  84  -2.485  -9.320  -7.547
  621   3HD1  LEU  84          3HD1      LEU  84  -2.643  -8.269  -8.954
  622   1HD2  LEU  84          1HD2      LEU  84  -0.003  -7.841  -9.501
  623   2HD2  LEU  84          2HD2      LEU  84  -0.349  -8.817 -10.929
  624   3HD2  LEU  84          3HD2      LEU  84   0.947  -9.291  -9.832
  625    H    ARG  85           H        ARG  85   2.679 -10.475  -8.333
  626    HA   ARG  85           HA       ARG  85   3.621 -12.516  -6.393
  627   1HB   ARG  85          2HB       ARG  85   4.850 -11.915  -9.045
  628   2HB   ARG  85          1HB       ARG  85   5.948 -12.123  -7.681
  629   1HG   ARG  85          2HG       ARG  85   5.448 -14.349  -7.438
  630   2HG   ARG  85          1HG       ARG  85   3.776 -14.137  -7.955
  631   1HD   ARG  85          2HD       ARG  85   4.334 -14.187 -10.231
  632   2HD   ARG  85          1HD       ARG  85   6.019 -13.767  -9.925
  633    HE   ARG  85           HE       ARG  85   4.830 -16.457  -9.394
  634   1HH1  ARG  85          1HH2      ARG  85   6.647 -16.225 -11.701
  635   2HH1  ARG  85          2HH2      ARG  85   8.188 -16.644 -11.030
  636   1HH2  ARG  85          2HH1      ARG  85   7.178 -16.180  -7.737
  637   2HH2  ARG  85          1HH1      ARG  85   8.489 -16.619  -8.779
  638    H    LEU  86           H        LEU  86   4.993 -11.608  -4.796
  639    HA   LEU  86           HA       LEU  86   5.248  -8.635  -4.930
  640   1HB   LEU  86          2HB       LEU  86   4.093  -9.976  -2.954
  641   2HB   LEU  86          1HB       LEU  86   5.757 -10.167  -2.408
  642    HG   LEU  86           HG       LEU  86   5.276  -7.438  -3.267
  643   1HD1  LEU  86          1HD1      LEU  86   3.495  -6.765  -1.972
  644   2HD1  LEU  86          2HD1      LEU  86   3.719  -8.063  -0.798
  645   3HD1  LEU  86          3HD1      LEU  86   2.952  -8.401  -2.350
  646   1HD2  LEU  86          1HD2      LEU  86   5.885  -8.557  -0.515
  647   2HD2  LEU  86          2HD2      LEU  86   6.259  -6.942  -1.116
  648   3HD2  LEU  86          3HD2      LEU  86   7.104  -8.344  -1.773
  649    H    ILE  87           H        ILE  87   7.227  -7.658  -4.775
  650    HA   ILE  87           HA       ILE  87   9.617  -9.257  -4.088
  651    HB   ILE  87           HB       ILE  87   9.509  -9.576  -6.489
  652   1HG1  ILE  87          2HG1      ILE  87  11.480  -7.322  -6.050
  653   2HG1  ILE  87          1HG1      ILE  87  11.718  -8.926  -5.357
  654   1HG2  ILE  87          1HG2      ILE  87   9.711  -6.690  -7.148
  655   2HG2  ILE  87          2HG2      ILE  87   8.129  -7.240  -6.601
  656   3HG2  ILE  87          3HG2      ILE  87   8.882  -7.988  -8.006
  657   1HD1  ILE  87          1HD1      ILE  87  11.120  -9.561  -7.949
  658   2HD1  ILE  87          2HD1      ILE  87  12.760  -9.373  -7.330
  659   3HD1  ILE  87          3HD1      ILE  87  11.973  -8.031  -8.159
  660    HA   PRO  88           HA       PRO  88  10.281  -5.323  -2.143
  661   1HB   PRO  88          2HB       PRO  88  12.612  -6.054  -0.873
  662   2HB   PRO  88          1HB       PRO  88  10.995  -6.483  -0.290
  663   1HG   PRO  88          2HG       PRO  88  13.017  -8.198  -1.656
  664   2HG   PRO  88          1HG       PRO  88  11.741  -8.658  -0.517
  665   1HD   PRO  88          2HD       PRO  88  11.635  -8.995  -3.319
  666   2HD   PRO  88          1HD       PRO  88  10.250  -9.089  -2.210
  667    H    ARG  89           H        ARG  89  10.820  -3.896  -3.788
  668    HA   ARG  89           HA       ARG  89  13.231  -4.134  -5.394
  669   1HB   ARG  89          2HB       ARG  89  10.853  -2.505  -5.360
  670   2HB   ARG  89          1HB       ARG  89  12.268  -1.459  -5.454
  671   1HG   ARG  89          2HG       ARG  89  12.773  -3.623  -7.206
  672   2HG   ARG  89          1HG       ARG  89  11.113  -3.114  -7.512
  673   1HD   ARG  89          2HD       ARG  89  12.046  -1.500  -8.806
  674   2HD   ARG  89          1HD       ARG  89  12.410  -0.701  -7.277
  675    HE   ARG  89           HE       ARG  89  14.359  -2.489  -8.679
  676   1HH1  ARG  89          2HH1      ARG  89  14.688   0.418  -9.153
  677   2HH1  ARG  89          1HH1      ARG  89  15.788   0.889  -7.901
  678   1HH2  ARG  89          1HH2      ARG  89  15.272  -1.979  -6.001
  679   2HH2  ARG  89          2HH2      ARG  89  16.120  -0.472  -6.108
  680    H    ASP  90           H        ASP  90  15.101  -4.029  -4.180
  681    HA   ASP  90           HA       ASP  90  15.919  -1.451  -3.136
  682   1HB   ASP  90          2HB       ASP  90  16.466  -2.713  -0.815
  683   2HB   ASP  90          1HB       ASP  90  14.990  -1.786  -1.065
  684    H    ARG  91           H        ARG  91  18.190  -1.443  -2.541
  685    HA   ARG  91           HA       ARG  91  19.781  -3.234  -4.132
  686   1HB   ARG  91          2HB       ARG  91  20.173  -0.797  -2.737
  687   2HB   ARG  91          1HB       ARG  91  21.362  -1.937  -2.105
  688   1HG   ARG  91          2HG       ARG  91  22.467  -1.045  -3.968
  689   2HG   ARG  91          1HG       ARG  91  21.765  -2.526  -4.620
  690   1HD   ARG  91          2HD       ARG  91  19.779  -0.505  -4.844
  691   2HD   ARG  91          1HD       ARG  91  21.288   0.189  -5.437
  692    HE   ARG  91           HE       ARG  91  21.323  -1.459  -7.183
  693   1HH1  ARG  91          2HH1      ARG  91  18.376  -0.753  -7.199
  694   2HH1  ARG  91          1HH1      ARG  91  17.646  -2.324  -7.210
  695   1HH2  ARG  91          1HH2      ARG  91  20.539  -3.975  -6.228
  696   2HH2  ARG  91          2HH2      ARG  91  18.872  -4.148  -6.661
  697    H    VAL  92           H        VAL  92  19.310  -2.977  -0.586
  698    HA   VAL  92           HA       VAL  92  20.776  -5.551  -0.293
  699    HB   VAL  92           HB       VAL  92  21.536  -3.760   1.180
  700   1HG1  VAL  92          1HG1      VAL  92  19.568  -3.321   3.052
  701   2HG1  VAL  92          2HG1      VAL  92  18.641  -3.376   1.555
  702   3HG1  VAL  92          3HG1      VAL  92  19.961  -2.224   1.729
  703   1HG2  VAL  92          1HG2      VAL  92  20.140  -5.238   3.264
  704   2HG2  VAL  92          2HG2      VAL  92  21.852  -5.251   2.845
  705   3HG2  VAL  92          3HG2      VAL  92  20.731  -6.316   1.999
  706    H    GLY  93           H        GLY  93  19.723  -7.411   0.149
  707   1HA   GLY  93          2HA       GLY  93  18.021  -8.897   0.796
  708   2HA   GLY  93          1HA       GLY  93  17.222  -7.548   1.603
  709    H    HIS  94           HN       HIS  94  18.075  -8.176  -1.816
  710    HA   HIS  94           HA       HIS  94  15.616  -7.016  -2.795
  711   1HB   HIS  94          2HB       HIS  94  18.019  -7.608  -3.938
  712   2HB   HIS  94          1HB       HIS  94  17.035  -8.935  -4.552
  713    HD1  HIS  94           HD1      HIS  94  14.357  -7.622  -5.028
  714    HD2  HIS  94           HD2      HIS  94  17.956  -5.738  -5.966
  715    HE1  HIS  94           HE1      HIS  94  13.819  -5.882  -6.790
  Start of MODEL   23
    1   1H    MET   1          1H        MET   1 -18.380 -18.762  -5.332
    2   2H    MET   1          2H        MET   1 -17.338 -19.793  -6.191
    3   3H    MET   1          3H        MET   1 -17.720 -20.128  -4.569
    4    HA   MET   1           HA       MET   1 -19.686 -20.114  -6.796
    5   1HB   MET   1          2HB       MET   1 -17.713 -22.021  -6.246
    6   2HB   MET   1          1HB       MET   1 -19.175 -22.667  -5.498
    7   1HG   MET   1          2HG       MET   1 -19.728 -23.386  -7.563
    8   2HG   MET   1          1HG       MET   1 -20.111 -21.701  -7.908
    9   1HE   MET   1          1HE       MET   1 -17.367 -24.432  -9.736
   10   2HE   MET   1          2HE       MET   1 -18.399 -24.621  -8.323
   11   3HE   MET   1          3HE       MET   1 -16.696 -24.209  -8.113
   12    H    SER   2           H        SER   2 -21.440 -21.798  -5.952
   13    HA   SER   2           HA       SER   2 -22.044 -21.551  -3.090
   14   1HB   SER   2          2HB       SER   2 -23.369 -19.914  -5.188
   15   2HB   SER   2          1HB       SER   2 -24.431 -20.667  -4.004
   16    HG   SER   2           HG       SER   2 -22.944 -19.749  -2.399
   17    H    GLY   3           H        GLY   3 -24.273 -22.634  -2.686
   18   1HA   GLY   3          2HA       GLY   3 -24.305 -25.134  -4.261
   19   2HA   GLY   3          1HA       GLY   3 -25.201 -24.839  -2.769
   20    H    GLY   4           H        GLY   4 -26.374 -22.308  -3.691
   21   1HA   GLY   4          2HA       GLY   4 -27.872 -22.917  -6.127
   22   2HA   GLY   4          1HA       GLY   4 -28.826 -23.078  -4.654
   23    H    THR   5           H        THR   5 -28.631 -21.071  -3.136
   24    HA   THR   5           HA       THR   5 -28.525 -18.587  -4.803
   25    HB   THR   5           HB       THR   5 -30.573 -19.225  -2.661
   26    HG1  THR   5           HG1      THR   5 -31.293 -20.339  -4.315
   27   1HG2  THR   5          1HG2      THR   5 -30.046 -16.825  -2.866
   28   2HG2  THR   5          2HG2      THR   5 -31.668 -17.171  -3.464
   29   3HG2  THR   5          3HG2      THR   5 -30.347 -16.906  -4.603
   30    H    ALA   6           H        ALA   6 -26.979 -17.281  -4.009
   31    HA   ALA   6           HA       ALA   6 -26.195 -17.460  -1.147
   32   1HB   ALA   6          1HB       ALA   6 -24.976 -15.970  -3.493
   33   2HB   ALA   6          2HB       ALA   6 -24.371 -17.463  -2.773
   34   3HB   ALA   6          3HB       ALA   6 -24.325 -15.958  -1.854
   35    H    ALA   7           H        ALA   7 -26.570 -15.763   0.293
   36    HA   ALA   7           HA       ALA   7 -28.253 -13.533  -0.763
   37   1HB   ALA   7          1HB       ALA   7 -28.129 -14.960   1.873
   38   2HB   ALA   7          2HB       ALA   7 -29.522 -14.588   0.861
   39   3HB   ALA   7          3HB       ALA   7 -28.762 -13.317   1.804
   40    H    THR   8           H        THR   8 -25.436 -14.156   1.353
   41    HA   THR   8           HA       THR   8 -25.007 -11.465   2.205
   42    HB   THR   8           HB       THR   8 -22.595 -12.184   2.469
   43    HG1  THR   8           HG1      THR   8 -22.079 -13.718   1.135
   44   1HG2  THR   8          1HG2      THR   8 -24.130 -14.444   3.585
   45   2HG2  THR   8          2HG2      THR   8 -24.807 -12.849   3.914
   46   3HG2  THR   8          3HG2      THR   8 -23.156 -13.225   4.407
   47    H    THR   9           H        THR   9 -24.870  -9.768   0.808
   48    HA   THR   9           HA       THR   9 -23.253 -10.196  -1.673
   49    HB   THR   9           HB       THR   9 -25.620  -8.344  -1.305
   50    HG1  THR   9           HG1      THR   9 -26.487 -10.302  -1.469
   51   1HG2  THR   9          1HG2      THR   9 -24.899  -8.981  -4.025
   52   2HG2  THR   9          2HG2      THR   9 -23.498  -8.332  -3.176
   53   3HG2  THR   9          3HG2      THR   9 -24.991  -7.401  -3.248
   54    H    ALA  10           H        ALA  10 -21.623  -8.868  -2.033
   55    HA   ALA  10           HA       ALA  10 -21.329  -6.428  -0.332
   56   1HB   ALA  10          1HB       ALA  10 -19.147  -8.101  -1.618
   57   2HB   ALA  10          2HB       ALA  10 -19.634  -8.225   0.073
   58   3HB   ALA  10          3HB       ALA  10 -18.915  -6.732  -0.529
   59    H    GLY  11           H        GLY  11 -21.201  -7.821  -3.561
   60   1HA   GLY  11          2HA       GLY  11 -22.006  -6.087  -5.290
   61   2HA   GLY  11          1HA       GLY  11 -20.631  -5.134  -4.726
   62    H    SER  12           H        SER  12 -19.092  -5.238  -6.285
   63    HA   SER  12           HA       SER  12 -18.376  -7.941  -7.357
   64   1HB   SER  12          2HB       SER  12 -19.074  -5.482  -8.765
   65   2HB   SER  12          1HB       SER  12 -17.473  -6.058  -9.220
   66    HG   SER  12           HG       SER  12 -18.855  -7.154 -10.507
   67    H    LYS  13           H        LYS  13 -16.458  -8.467  -6.400
   68    HA   LYS  13           HA       LYS  13 -14.427  -6.289  -6.061
   69   1HB   LYS  13          2HB       LYS  13 -14.837  -8.740  -4.323
   70   2HB   LYS  13          1HB       LYS  13 -13.626  -7.481  -4.074
   71   1HG   LYS  13          2HG       LYS  13 -15.733  -5.884  -4.147
   72   2HG   LYS  13          1HG       LYS  13 -16.596  -7.354  -3.696
   73   1HD   LYS  13          2HD       LYS  13 -14.412  -7.412  -2.011
   74   2HD   LYS  13          1HD       LYS  13 -14.776  -5.689  -2.101
   75   1HE   LYS  13          2HE       LYS  13 -17.144  -6.176  -1.543
   76   2HE   LYS  13          1HE       LYS  13 -16.742  -7.888  -1.399
   77   1HZ   LYS  13          1HZ       LYS  13 -15.434  -7.506   0.455
   78   2HZ   LYS  13          2HZ       LYS  13 -16.757  -6.471   0.704
   79   3HZ   LYS  13          3HZ       LYS  13 -15.279  -5.845   0.146
   80    H    VAL  14           H        VAL  14 -12.202  -6.931  -6.265
   81    HA   VAL  14           HA       VAL  14 -11.821  -9.329  -8.012
   82    HB   VAL  14           HB       VAL  14  -9.731  -8.127  -8.773
   83   1HG1  VAL  14          1HG1      VAL  14 -11.070  -6.302 -10.020
   84   2HG1  VAL  14          2HG1      VAL  14 -12.475  -6.928  -9.156
   85   3HG1  VAL  14          3HG1      VAL  14 -11.574  -7.977 -10.251
   86   1HG2  VAL  14          1HG2      VAL  14 -10.971  -5.724  -7.406
   87   2HG2  VAL  14          2HG2      VAL  14  -9.409  -5.813  -8.219
   88   3HG2  VAL  14          3HG2      VAL  14  -9.655  -6.655  -6.691
   89    H    THR  15           H        THR  15 -10.386 -10.896  -7.339
   90    HA   THR  15           HA       THR  15  -9.158 -10.521  -4.652
   91    HB   THR  15           HB       THR  15  -8.806 -13.033  -4.804
   92    HG1  THR  15           HG1      THR  15  -9.113 -13.853  -6.695
   93   1HG2  THR  15          1HG2      THR  15 -11.586 -13.184  -5.044
   94   2HG2  THR  15          2HG2      THR  15 -11.280 -11.533  -4.500
   95   3HG2  THR  15          3HG2      THR  15 -10.677 -12.897  -3.560
   96    H    PHE  16           H        PHE  16  -6.932 -10.837  -4.307
   97    HA   PHE  16           HA       PHE  16  -5.249 -11.121  -6.765
   98   1HB   PHE  16          2HB       PHE  16  -4.822  -9.224  -4.438
   99   2HB   PHE  16          1HB       PHE  16  -3.660  -9.495  -5.734
  100    HD1  PHE  16           HD1      PHE  16  -6.318  -7.449  -4.669
  101    HD2  PHE  16           HD2      PHE  16  -4.693  -9.289  -8.194
  102    HE1  PHE  16           HE1      PHE  16  -7.498  -5.789  -6.081
  103    HE2  PHE  16           HE2      PHE  16  -5.873  -7.628  -9.605
  104    HZ   PHE  16           HZ       PHE  16  -7.274  -5.880  -8.548
  105    H    LYS  17           H        LYS  17  -3.421 -12.384  -6.531
  106    HA   LYS  17           HA       LYS  17  -2.972 -13.635  -3.849
  107   1HB   LYS  17          2HB       LYS  17  -3.990 -15.065  -5.803
  108   2HB   LYS  17          1HB       LYS  17  -2.341 -15.050  -6.432
  109   1HG   LYS  17          2HG       LYS  17  -2.419 -15.636  -3.570
  110   2HG   LYS  17          1HG       LYS  17  -3.341 -16.808  -4.514
  111   1HD   LYS  17          2HD       LYS  17  -1.040 -16.436  -6.027
  112   2HD   LYS  17          1HD       LYS  17  -0.443 -16.413  -4.366
  113   1HE   LYS  17          2HE       LYS  17  -1.868 -18.516  -3.996
  114   2HE   LYS  17          1HE       LYS  17  -2.014 -18.591  -5.752
  115   1HZ   LYS  17          1HZ       LYS  17  -0.162 -19.886  -5.264
  116   2HZ   LYS  17          2HZ       LYS  17   0.419 -18.803  -4.091
  117   3HZ   LYS  17          3HZ       LYS  17   0.511 -18.403  -5.741
  118    H    ILE  18           H        ILE  18  -1.184 -12.470  -3.185
  119    HA   ILE  18           HA       ILE  18   1.054 -12.068  -5.107
  120    HB   ILE  18           HB       ILE  18   0.693 -10.948  -2.309
  121   1HG1  ILE  18          2HG1      ILE  18   0.469  -8.881  -4.166
  122   2HG1  ILE  18          1HG1      ILE  18  -0.456 -10.193  -4.895
  123   1HG2  ILE  18          1HG2      ILE  18   2.807 -10.221  -2.548
  124   2HG2  ILE  18          2HG2      ILE  18   2.336  -9.351  -4.007
  125   3HG2  ILE  18          3HG2      ILE  18   2.914 -11.013  -4.121
  126   1HD1  ILE  18          1HD1      ILE  18  -2.111  -9.991  -3.371
  127   2HD1  ILE  18          2HD1      ILE  18  -1.354  -8.471  -2.897
  128   3HD1  ILE  18          3HD1      ILE  18  -0.966  -9.956  -2.029
  129    H    THR  19           H        THR  19   2.881 -13.282  -4.960
  130    HA   THR  19           HA       THR  19   3.256 -14.955  -2.504
  131    HB   THR  19           HB       THR  19   4.217 -15.571  -5.317
  132    HG1  THR  19           HG1      THR  19   2.274 -16.268  -5.601
  133   1HG2  THR  19          1HG2      THR  19   5.428 -16.492  -3.217
  134   2HG2  THR  19          2HG2      THR  19   4.943 -17.642  -4.462
  135   3HG2  THR  19          3HG2      THR  19   3.980 -17.475  -2.994
  136    H    LEU  20           H        LEU  20   5.009 -14.385  -1.331
  137    HA   LEU  20           HA       LEU  20   6.896 -12.389  -2.199
  138   1HB   LEU  20          2HB       LEU  20   6.198 -13.603   0.228
  139   2HB   LEU  20          1HB       LEU  20   7.870 -14.087  -0.033
  140    HG   LEU  20           HG       LEU  20   7.669 -11.943   1.229
  141   1HD1  LEU  20          1HD1      LEU  20   9.267 -12.482  -1.085
  142   2HD1  LEU  20          2HD1      LEU  20   9.681 -11.520   0.332
  143   3HD1  LEU  20          3HD1      LEU  20   8.898 -10.758  -1.052
  144   1HD2  LEU  20          1HD2      LEU  20   7.084 -10.159  -0.899
  145   2HD2  LEU  20          2HD2      LEU  20   6.147 -10.427   0.569
  146   3HD2  LEU  20          3HD2      LEU  20   5.798 -11.367  -0.881
  147    H    THR  21           H        THR  21   8.916 -12.620  -3.124
  148    HA   THR  21           HA       THR  21   9.580 -15.046  -4.509
  149    HB   THR  21           HB       THR  21  11.837 -13.881  -4.839
  150    HG1  THR  21           HG1      THR  21  12.185 -12.071  -3.824
  151   1HG2  THR  21          1HG2      THR  21   9.226 -13.268  -5.853
  152   2HG2  THR  21          2HG2      THR  21  10.782 -13.153  -6.679
  153   3HG2  THR  21          3HG2      THR  21  10.164 -11.776  -5.764
  154    H    SER  22           H        SER  22  11.105 -13.513  -1.648
  155    HA   SER  22           HA       SER  22  12.747 -15.895  -1.146
  156   1HB   SER  22          2HB       SER  22  12.498 -13.161  -0.002
  157   2HB   SER  22          1HB       SER  22  13.062 -14.419   1.094
  158    HG   SER  22           HG       SER  22  14.628 -13.210  -0.355
  159    H    ASP  23           H        ASP  23   9.643 -14.680  -0.138
  160    HA   ASP  23           HA       ASP  23   8.024 -15.531   1.312
  161   1HB   ASP  23          2HB       ASP  23   9.710 -18.053   1.139
  162   2HB   ASP  23          1HB       ASP  23   8.053 -17.961   1.731
  163    HA   PRO  24           HA       PRO  24  10.942 -14.866   4.864
  164   1HB   PRO  24          2HB       PRO  24  10.046 -12.336   5.476
  165   2HB   PRO  24          1HB       PRO  24  11.372 -12.659   4.344
  166   1HG   PRO  24          2HG       PRO  24   8.574 -11.818   3.761
  167   2HG   PRO  24          1HG       PRO  24  10.043 -11.568   2.805
  168   1HD   PRO  24          2HD       PRO  24   8.050 -13.524   2.319
  169   2HD   PRO  24          1HD       PRO  24   9.656 -13.447   1.563
  170    H    LYS  25           H        LYS  25   9.586 -16.509   5.859
  171    HA   LYS  25           HA       LYS  25   8.244 -17.196   7.653
  172   1HB   LYS  25          2HB       LYS  25   8.507 -14.458   8.155
  173   2HB   LYS  25          1HB       LYS  25   6.765 -14.746   8.170
  174   1HG   LYS  25          2HG       LYS  25   7.413 -16.842   9.615
  175   2HG   LYS  25          1HG       LYS  25   8.894 -15.934   9.919
  176   1HD   LYS  25          2HD       LYS  25   7.760 -14.189  10.986
  177   2HD   LYS  25          1HD       LYS  25   6.223 -14.594  10.220
  178   1HE   LYS  25          2HE       LYS  25   7.383 -16.729  11.908
  179   2HE   LYS  25          1HE       LYS  25   6.863 -15.284  12.777
  180   1HZ   LYS  25          1HZ       LYS  25   5.056 -16.336  10.740
  181   2HZ   LYS  25          2HZ       LYS  25   4.708 -15.614  12.239
  182   3HZ   LYS  25          3HZ       LYS  25   5.211 -17.236  12.170
  183    H    LEU  26           H        LEU  26   6.790 -15.097   5.173
  184    HA   LEU  26           HA       LEU  26   4.321 -16.773   5.328
  185   1HB   LEU  26          2HB       LEU  26   4.574 -13.998   5.474
  186   2HB   LEU  26          1HB       LEU  26   4.076 -14.292   3.809
  187    HG   LEU  26           HG       LEU  26   2.516 -16.023   5.410
  188   1HD1  LEU  26          1HD1      LEU  26   1.393 -13.937   6.672
  189   2HD1  LEU  26          2HD1      LEU  26   3.067 -13.379   6.675
  190   3HD1  LEU  26          3HD1      LEU  26   2.649 -14.921   7.423
  191   1HD2  LEU  26          1HD2      LEU  26   0.771 -14.119   4.719
  192   2HD2  LEU  26          2HD2      LEU  26   1.461 -15.215   3.521
  193   3HD2  LEU  26          3HD2      LEU  26   2.122 -13.591   3.716
  194    HA   PRO  27           HA       PRO  27   5.526 -18.132   1.269
  195   1HB   PRO  27          2HB       PRO  27   3.268 -19.631   0.797
  196   2HB   PRO  27          1HB       PRO  27   4.613 -20.172   1.817
  197   1HG   PRO  27          2HG       PRO  27   1.911 -19.212   2.629
  198   2HG   PRO  27          1HG       PRO  27   3.020 -20.297   3.482
  199   1HD   PRO  27          2HD       PRO  27   2.606 -17.554   4.063
  200   2HD   PRO  27          1HD       PRO  27   3.924 -18.569   4.685
  201    H    PHE  28           H        PHE  28   1.996 -17.409   1.530
  202    HA   PHE  28           HA       PHE  28   2.288 -15.415  -0.649
  203   1HB   PHE  28          2HB       PHE  28   0.381 -16.390  -1.896
  204   2HB   PHE  28          1HB       PHE  28   1.741 -17.506  -1.810
  205    HD1  PHE  28           HD1      PHE  28  -1.666 -16.784  -0.604
  206    HD2  PHE  28           HD2      PHE  28   1.638 -19.525  -0.434
  207    HE1  PHE  28           HE1      PHE  28  -3.126 -18.480   0.462
  208    HE2  PHE  28           HE2      PHE  28   0.177 -21.219   0.633
  209    HZ   PHE  28           HZ       PHE  28  -2.205 -20.696   1.082
  210    H    LYS  29           H        LYS  29   0.321 -14.056  -0.883
  211    HA   LYS  29           HA       LYS  29  -1.401 -14.014   1.561
  212   1HB   LYS  29          2HB       LYS  29   0.470 -12.321   1.686
  213   2HB   LYS  29          1HB       LYS  29  -0.202 -11.557   0.246
  214   1HG   LYS  29          2HG       LYS  29  -1.202 -10.326   1.966
  215   2HG   LYS  29          1HG       LYS  29  -2.434 -11.537   1.613
  216   1HD   LYS  29          2HD       LYS  29  -0.634 -12.696   3.489
  217   2HD   LYS  29          1HD       LYS  29  -1.043 -11.086   4.082
  218   1HE   LYS  29          2HE       LYS  29  -3.397 -11.559   3.988
  219   2HE   LYS  29          1HE       LYS  29  -3.117 -13.071   3.123
  220   1HZ   LYS  29          1HZ       LYS  29  -2.145 -14.035   5.016
  221   2HZ   LYS  29          2HZ       LYS  29  -3.551 -13.259   5.575
  222   3HZ   LYS  29          3HZ       LYS  29  -2.027 -12.549   5.827
  223    H    VAL  30           H        VAL  30  -3.533 -13.885   1.047
  224    HA   VAL  30           HA       VAL  30  -4.271 -13.193  -1.759
  225    HB   VAL  30           HB       VAL  30  -5.909 -14.578   0.393
  226   1HG1  VAL  30          1HG1      VAL  30  -7.661 -14.320  -0.995
  227   2HG1  VAL  30          2HG1      VAL  30  -6.761 -15.094  -2.299
  228   3HG1  VAL  30          3HG1      VAL  30  -6.655 -13.349  -2.070
  229   1HG2  VAL  30          1HG2      VAL  30  -4.033 -15.981  -0.283
  230   2HG2  VAL  30          2HG2      VAL  30  -4.365 -15.663  -1.986
  231   3HG2  VAL  30          3HG2      VAL  30  -5.505 -16.610  -1.027
  232    H    LEU  31           H        LEU  31  -5.189 -11.225  -2.112
  233    HA   LEU  31           HA       LEU  31  -6.410  -9.805   0.227
  234   1HB   LEU  31          2HB       LEU  31  -4.413  -8.978  -1.725
  235   2HB   LEU  31          1HB       LEU  31  -5.800  -7.889  -1.728
  236    HG   LEU  31           HG       LEU  31  -5.184  -8.515   0.993
  237   1HD1  LEU  31          1HD1      LEU  31  -2.944  -8.860   0.885
  238   2HD1  LEU  31          2HD1      LEU  31  -2.839  -7.128   0.569
  239   3HD1  LEU  31          3HD1      LEU  31  -2.846  -8.270  -0.774
  240   1HD2  LEU  31          1HD2      LEU  31  -5.916  -6.329  -0.589
  241   2HD2  LEU  31          2HD2      LEU  31  -4.337  -5.882   0.058
  242   3HD2  LEU  31          3HD2      LEU  31  -5.651  -6.307   1.154
  243    H    SER  32           H        SER  32  -8.578  -9.621   0.039
  244    HA   SER  32           HA       SER  32  -9.785  -9.632  -2.696
  245   1HB   SER  32          2HB       SER  32 -10.411 -11.338  -0.764
  246   2HB   SER  32          1HB       SER  32 -11.413 -10.003  -0.203
  247    HG   SER  32           HG       SER  32 -12.718 -10.952  -1.618
  248    H    VAL  33           H        VAL  33 -10.091  -7.557  -3.351
  249    HA   VAL  33           HA       VAL  33 -11.567  -5.718  -1.535
  250    HB   VAL  33           HB       VAL  33 -10.060  -3.832  -2.303
  251   1HG1  VAL  33          1HG1      VAL  33  -9.889  -5.140  -0.090
  252   2HG1  VAL  33          2HG1      VAL  33  -8.481  -4.200  -0.581
  253   3HG1  VAL  33          3HG1      VAL  33  -8.501  -5.947  -0.819
  254   1HG2  VAL  33          1HG2      VAL  33  -7.677  -4.877  -2.898
  255   2HG2  VAL  33          2HG2      VAL  33  -8.862  -4.533  -4.158
  256   3HG2  VAL  33          3HG2      VAL  33  -8.674  -6.177  -3.551
  257    HA   PRO  34           HA       PRO  34 -13.812  -4.729  -5.180
  258   1HB   PRO  34          2HB       PRO  34 -14.557  -2.143  -4.602
  259   2HB   PRO  34          1HB       PRO  34 -15.287  -3.569  -3.845
  260   1HG   PRO  34          2HG       PRO  34 -13.322  -1.632  -2.702
  261   2HG   PRO  34          1HG       PRO  34 -14.549  -2.607  -1.875
  262   1HD   PRO  34          2HD       PRO  34 -11.797  -3.191  -1.968
  263   2HD   PRO  34          1HD       PRO  34 -13.078  -4.332  -1.512
  264    H    GLU  35           H        GLU  35 -13.825  -3.264  -7.088
  265    HA   GLU  35           HA       GLU  35 -11.228  -2.640  -8.060
  266   1HB   GLU  35          2HB       GLU  35 -12.399  -1.467  -9.906
  267   2HB   GLU  35          1HB       GLU  35 -13.105  -3.048  -9.576
  268   1HG   GLU  35          2HG       GLU  35 -14.389  -1.068  -7.918
  269   2HG   GLU  35          1HG       GLU  35 -14.427  -0.537  -9.598
  270    H    SER  36           H        SER  36 -13.445  -0.709  -6.151
  271    HA   SER  36           HA       SER  36 -12.429   1.893  -6.744
  272   1HB   SER  36          2HB       SER  36 -14.176   0.688  -4.768
  273   2HB   SER  36          1HB       SER  36 -13.127   1.886  -4.018
  274    HG   SER  36           HG       SER  36 -14.888   2.963  -4.816
  275    H    THR  37           H        THR  37 -11.373  -0.562  -4.376
  276    HA   THR  37           HA       THR  37  -9.372   1.074  -3.115
  277    HB   THR  37           HB       THR  37  -9.589  -1.943  -3.389
  278    HG1  THR  37           HG1      THR  37 -11.201  -1.293  -2.122
  279   1HG2  THR  37          1HG2      THR  37  -7.315  -1.582  -2.878
  280   2HG2  THR  37          2HG2      THR  37  -8.064  -1.805  -1.298
  281   3HG2  THR  37          3HG2      THR  37  -7.673  -0.183  -1.867
  282    HA   PRO  38           HA       PRO  38  -6.524   1.052  -6.538
  283   1HB   PRO  38          2HB       PRO  38  -4.634   2.619  -5.302
  284   2HB   PRO  38          1HB       PRO  38  -6.112   3.260  -6.040
  285   1HG   PRO  38          2HG       PRO  38  -5.456   2.909  -3.152
  286   2HG   PRO  38          1HG       PRO  38  -6.561   4.060  -3.919
  287   1HD   PRO  38          2HD       PRO  38  -7.308   1.679  -2.582
  288   2HD   PRO  38          1HD       PRO  38  -8.355   2.667  -3.622
  289    H    PHE  39           H        PHE  39  -4.243   0.375  -6.903
  290    HA   PHE  39           HA       PHE  39  -3.548  -2.012  -5.467
  291   1HB   PHE  39          2HB       PHE  39  -2.901  -1.157  -7.903
  292   2HB   PHE  39          1HB       PHE  39  -1.480  -0.545  -7.060
  293    HD1  PHE  39           HD1      PHE  39  -3.595  -3.657  -7.076
  294    HD2  PHE  39           HD2      PHE  39   0.357  -1.975  -6.967
  295    HE1  PHE  39           HE1      PHE  39  -2.624  -5.938  -7.063
  296    HE2  PHE  39           HE2      PHE  39   1.327  -4.256  -6.955
  297    HZ   PHE  39           HZ       PHE  39  -0.162  -6.238  -7.002
  298    H    THR  40           H        THR  40  -2.867   1.337  -4.856
  299    HA   THR  40           HA       THR  40  -0.402   1.129  -3.429
  300    HB   THR  40           HB       THR  40  -1.676   3.102  -2.052
  301    HG1  THR  40           HG1      THR  40  -3.331   3.872  -3.113
  302   1HG2  THR  40          1HG2      THR  40  -1.019   4.246  -4.563
  303   2HG2  THR  40          2HG2      THR  40   0.083   2.895  -4.302
  304   3HG2  THR  40          3HG2      THR  40  -0.028   4.186  -3.106
  305    H    ALA  41           H        ALA  41  -3.786   0.886  -2.309
  306    HA   ALA  41           HA       ALA  41  -3.064   0.237   0.425
  307   1HB   ALA  41          1HB       ALA  41  -5.438  -0.259   0.714
  308   2HB   ALA  41          2HB       ALA  41  -5.673  -0.285  -1.033
  309   3HB   ALA  41          3HB       ALA  41  -5.265   1.226  -0.220
  310    H    VAL  42           H        VAL  42  -3.897  -1.660  -2.474
  311    HA   VAL  42           HA       VAL  42  -4.073  -4.224  -1.214
  312    HB   VAL  42           HB       VAL  42  -3.151  -3.528  -4.025
  313   1HG1  VAL  42          1HG1      VAL  42  -2.586  -5.856  -3.169
  314   2HG1  VAL  42          2HG1      VAL  42  -3.620  -5.814  -4.597
  315   3HG1  VAL  42          3HG1      VAL  42  -4.321  -6.132  -3.009
  316   1HG2  VAL  42          1HG2      VAL  42  -5.729  -3.429  -2.700
  317   2HG2  VAL  42          2HG2      VAL  42  -5.756  -4.618  -4.004
  318   3HG2  VAL  42          3HG2      VAL  42  -5.308  -2.945  -4.344
  319    H    LEU  43           H        LEU  43  -1.290  -2.598  -2.776
  320    HA   LEU  43           HA       LEU  43   0.620  -4.660  -2.182
  321   1HB   LEU  43          2HB       LEU  43   0.787  -2.664  -3.844
  322   2HB   LEU  43          1HB       LEU  43   1.337  -1.741  -2.446
  323    HG   LEU  43           HG       LEU  43   2.666  -4.350  -2.703
  324   1HD1  LEU  43          1HD1      LEU  43   2.529  -4.009  -5.068
  325   2HD1  LEU  43          2HD1      LEU  43   4.141  -3.468  -4.596
  326   3HD1  LEU  43          3HD1      LEU  43   2.869  -2.286  -4.909
  327   1HD2  LEU  43          1HD2      LEU  43   3.588  -2.809  -1.165
  328   2HD2  LEU  43          2HD2      LEU  43   3.440  -1.460  -2.292
  329   3HD2  LEU  43          3HD2      LEU  43   4.668  -2.698  -2.556
  330    H    LYS  44           H        LYS  44  -0.480  -1.805  -0.389
  331    HA   LYS  44           HA       LYS  44   1.539  -1.854   1.648
  332   1HB   LYS  44          2HB       LYS  44  -0.743  -0.305   1.049
  333   2HB   LYS  44          1HB       LYS  44  -1.010  -0.946   2.668
  334   1HG   LYS  44          2HG       LYS  44   0.902   0.079   3.535
  335   2HG   LYS  44          1HG       LYS  44   1.665   0.210   1.949
  336   1HD   LYS  44          2HD       LYS  44  -0.153   1.846   1.311
  337   2HD   LYS  44          1HD       LYS  44  -0.667   1.828   2.999
  338   1HE   LYS  44          2HE       LYS  44   0.809   3.697   2.784
  339   2HE   LYS  44          1HE       LYS  44   1.734   2.439   3.603
  340   1HZ   LYS  44          1HZ       LYS  44   2.603   1.798   1.376
  341   2HZ   LYS  44          2HZ       LYS  44   3.082   3.342   1.895
  342   3HZ   LYS  44          3HZ       LYS  44   1.853   3.178   0.734
  343    H    PHE  45           H        PHE  45  -1.761  -3.245   1.576
  344    HA   PHE  45           HA       PHE  45  -1.617  -4.452   4.172
  345   1HB   PHE  45          2HB       PHE  45  -3.644  -4.075   2.496
  346   2HB   PHE  45          1HB       PHE  45  -3.237  -5.715   1.991
  347    HD1  PHE  45           HD1      PHE  45  -3.482  -3.822   5.236
  348    HD2  PHE  45           HD2      PHE  45  -4.442  -7.394   3.051
  349    HE1  PHE  45           HE1      PHE  45  -4.653  -4.725   7.226
  350    HE2  PHE  45           HE2      PHE  45  -5.613  -8.296   5.042
  351    HZ   PHE  45           HZ       PHE  45  -5.719  -6.961   7.129
  352    H    ALA  46           H        ALA  46  -0.892  -5.737   0.915
  353    HA   ALA  46           HA       ALA  46  -0.279  -8.408   1.754
  354   1HB   ALA  46          1HB       ALA  46  -0.400  -8.438  -0.521
  355   2HB   ALA  46          2HB       ALA  46   1.319  -8.051  -0.439
  356   3HB   ALA  46          3HB       ALA  46   0.135  -6.764  -0.668
  357    H    ALA  47           H        ALA  47   1.860  -5.592   1.170
  358    HA   ALA  47           HA       ALA  47   4.297  -6.883   1.931
  359   1HB   ALA  47          1HB       ALA  47   5.157  -4.559   2.238
  360   2HB   ALA  47          2HB       ALA  47   3.511  -3.955   2.053
  361   3HB   ALA  47          3HB       ALA  47   4.308  -4.769   0.706
  362    H    GLU  48           H        GLU  48   1.839  -5.157   3.829
  363    HA   GLU  48           HA       GLU  48   3.254  -4.950   6.289
  364   1HB   GLU  48          2HB       GLU  48   1.055  -3.857   5.777
  365   2HB   GLU  48          1HB       GLU  48   0.280  -5.433   5.930
  366   1HG   GLU  48          2HG       GLU  48   1.999  -4.882   8.214
  367   2HG   GLU  48          1HG       GLU  48   0.788  -3.617   8.005
  368    H    GLU  49           H        GLU  49   1.097  -7.558   5.106
  369    HA   GLU  49           HA       GLU  49   1.557  -9.244   7.427
  370   1HB   GLU  49          2HB       GLU  49   0.248  -9.605   4.747
  371   2HB   GLU  49          1HB       GLU  49   0.597 -11.020   5.739
  372   1HG   GLU  49          2HG       GLU  49  -1.395 -10.576   6.733
  373   2HG   GLU  49          1HG       GLU  49  -0.515  -9.304   7.580
  374    H    PHE  50           H        PHE  50   3.176  -8.791   4.343
  375    HA   PHE  50           HA       PHE  50   4.691 -11.291   4.503
  376   1HB   PHE  50          2HB       PHE  50   4.584  -8.942   2.662
  377   2HB   PHE  50          1HB       PHE  50   6.053  -9.914   2.667
  378    HD1  PHE  50           HD1      PHE  50   5.299 -12.625   2.980
  379    HD2  PHE  50           HD2      PHE  50   3.167  -9.522   0.908
  380    HE1  PHE  50           HE1      PHE  50   4.171 -14.332   1.579
  381    HE2  PHE  50           HE2      PHE  50   2.040 -11.231  -0.489
  382    HZ   PHE  50           HZ       PHE  50   2.543 -13.634  -0.154
  383    H    LYS  51           H        LYS  51   4.921  -8.484   6.277
  384    HA   LYS  51           HA       LYS  51   6.580  -7.613   7.667
  385   1HB   LYS  51          2HB       LYS  51   7.666 -10.325   6.989
  386   2HB   LYS  51          1HB       LYS  51   8.726  -9.169   7.792
  387   1HG   LYS  51          2HG       LYS  51   7.721  -9.588   9.756
  388   2HG   LYS  51          1HG       LYS  51   6.170  -9.088   9.080
  389   1HD   LYS  51          2HD       LYS  51   6.238 -11.490   7.975
  390   2HD   LYS  51          1HD       LYS  51   7.344 -11.836   9.305
  391   1HE   LYS  51          2HE       LYS  51   5.648 -11.919  10.785
  392   2HE   LYS  51          1HE       LYS  51   5.039 -10.353  10.252
  393   1HZ   LYS  51          1HZ       LYS  51   3.913 -11.427   8.425
  394   2HZ   LYS  51          2HZ       LYS  51   3.435 -12.137   9.894
  395   3HZ   LYS  51          3HZ       LYS  51   4.539 -12.938   8.879
  396    H    VAL  52           H        VAL  52   6.443  -6.787   4.914
  397    HA   VAL  52           HA       VAL  52   9.282  -5.943   4.528
  398    HB   VAL  52           HB       VAL  52   8.861  -6.031   2.038
  399   1HG1  VAL  52          1HG1      VAL  52   9.346  -8.380   1.854
  400   2HG1  VAL  52          2HG1      VAL  52   8.567  -8.720   3.399
  401   3HG1  VAL  52          3HG1      VAL  52  10.079  -7.813   3.355
  402   1HG2  VAL  52          1HG2      VAL  52   6.219  -6.485   2.837
  403   2HG2  VAL  52          2HG2      VAL  52   6.768  -8.053   2.248
  404   3HG2  VAL  52          3HG2      VAL  52   6.852  -6.639   1.199
  405    HA   PRO  53           HA       PRO  53   7.564  -1.909   4.236
  406   1HB   PRO  53          2HB       PRO  53   9.471  -0.695   2.670
  407   2HB   PRO  53          1HB       PRO  53   9.701  -1.089   4.380
  408   1HG   PRO  53          2HG       PRO  53  10.818  -2.452   1.972
  409   2HG   PRO  53          1HG       PRO  53  11.476  -2.363   3.614
  410   1HD   PRO  53          2HD       PRO  53  10.124  -4.580   2.502
  411   2HD   PRO  53          1HD       PRO  53  10.464  -4.328   4.227
  412    H    ALA  54           H        ALA  54   5.866  -1.260   3.019
  413    HA   ALA  54           HA       ALA  54   5.390  -2.223   0.335
  414   1HB   ALA  54          1HB       ALA  54   3.640  -0.128   0.636
  415   2HB   ALA  54          2HB       ALA  54   3.976  -0.556   2.315
  416   3HB   ALA  54          3HB       ALA  54   3.341  -1.770   1.205
  417    H    ALA  55           H        ALA  55   6.574   0.848   1.673
  418    HA   ALA  55           HA       ALA  55   6.493   2.385  -0.733
  419   1HB   ALA  55          1HB       ALA  55   6.884   3.387   1.489
  420   2HB   ALA  55          2HB       ALA  55   8.175   3.821   0.367
  421   3HB   ALA  55          3HB       ALA  55   8.445   2.572   1.583
  422    H    THR  56           H        THR  56   8.915   0.115   0.536
  423    HA   THR  56           HA       THR  56  10.531   0.524  -1.945
  424    HB   THR  56           HB       THR  56  11.446  -1.022   0.486
  425    HG1  THR  56           HG1      THR  56  11.493   0.775   1.538
  426   1HG2  THR  56          1HG2      THR  56  12.889  -1.294  -1.386
  427   2HG2  THR  56          2HG2      THR  56  13.663  -0.072  -0.377
  428   3HG2  THR  56          3HG2      THR  56  12.772   0.413  -1.818
  429    H    SER  57           H        SER  57   8.116  -0.963  -2.128
  430    HA   SER  57           HA       SER  57   9.220  -3.645  -2.806
  431   1HB   SER  57          2HB       SER  57   7.011  -3.041  -0.910
  432   2HB   SER  57          1HB       SER  57   6.749  -4.382  -2.020
  433    HG   SER  57           HG       SER  57   7.859  -4.831   0.057
  434    H    ALA  58           H        ALA  58   7.925  -4.782  -4.407
  435    HA   ALA  58           HA       ALA  58   5.892  -3.181  -5.863
  436   1HB   ALA  58          1HB       ALA  58   7.605  -4.414  -7.804
  437   2HB   ALA  58          2HB       ALA  58   8.600  -3.438  -6.723
  438   3HB   ALA  58          3HB       ALA  58   7.254  -2.698  -7.590
  439    H    ILE  59           H        ILE  59   4.834  -4.608  -7.609
  440    HA   ILE  59           HA       ILE  59   5.006  -7.502  -6.880
  441    HB   ILE  59           HB       ILE  59   2.571  -5.727  -6.946
  442   1HG1  ILE  59          2HG1      ILE  59   3.288  -8.017  -5.101
  443   2HG1  ILE  59          1HG1      ILE  59   3.860  -6.372  -4.826
  444   1HG2  ILE  59          1HG2      ILE  59   1.524  -7.311  -8.200
  445   2HG2  ILE  59          2HG2      ILE  59   1.531  -8.255  -6.711
  446   3HG2  ILE  59          3HG2      ILE  59   2.789  -8.507  -7.918
  447   1HD1  ILE  59          1HD1      ILE  59   0.954  -7.215  -5.052
  448   2HD1  ILE  59          2HD1      ILE  59   1.523  -5.566  -4.791
  449   3HD1  ILE  59          3HD1      ILE  59   1.791  -6.797  -3.556
  450    H    ILE  60           H        ILE  60   5.196  -8.782  -8.658
  451    HA   ILE  60           HA       ILE  60   4.638  -7.563 -11.326
  452    HB   ILE  60           HB       ILE  60   6.128  -9.270 -12.249
  453   1HG1  ILE  60          2HG1      ILE  60   7.229 -10.330  -9.798
  454   2HG1  ILE  60          1HG1      ILE  60   5.497 -10.651  -9.851
  455   1HG2  ILE  60          1HG2      ILE  60   7.298  -7.317 -11.567
  456   2HG2  ILE  60          2HG2      ILE  60   8.231  -8.658 -10.906
  457   3HG2  ILE  60          3HG2      ILE  60   7.156  -7.733  -9.858
  458   1HD1  ILE  60          1HD1      ILE  60   6.667 -11.117 -12.454
  459   2HD1  ILE  60          2HD1      ILE  60   5.783 -12.239 -11.420
  460   3HD1  ILE  60          3HD1      ILE  60   7.526 -12.048 -11.225
  461    H    THR  61           H        THR  61   3.759  -9.173 -12.993
  462    HA   THR  61           HA       THR  61   1.698 -10.902 -11.681
  463    HB   THR  61           HB       THR  61   0.801  -9.022 -13.030
  464    HG1  THR  61           HG1      THR  61  -0.590 -10.639 -13.099
  465   1HG2  THR  61          1HG2      THR  61   1.133  -9.684 -15.652
  466   2HG2  THR  61          2HG2      THR  61   2.709 -10.128 -14.998
  467   3HG2  THR  61          3HG2      THR  61   2.109  -8.482 -14.808
  468    H    ASN  62           H        ASN  62   0.988 -12.768 -13.229
  469    HA   ASN  62           HA       ASN  62   3.256 -14.493 -13.645
  470   1HB   ASN  62          2HB       ASN  62   0.645 -14.969 -13.238
  471   2HB   ASN  62          1HB       ASN  62   0.668 -15.103 -14.997
  472   1HD2  ASN  62          1HD2      ASN  62   1.421 -17.065 -15.856
  473   2HD2  ASN  62          2HD2      ASN  62   2.220 -18.261 -14.956
  474    H    ASP  63           H        ASP  63   1.748 -12.131 -15.679
  475    HA   ASP  63           HA       ASP  63   2.556 -13.336 -18.216
  476   1HB   ASP  63          2HB       ASP  63   1.749 -10.470 -17.626
  477   2HB   ASP  63          1HB       ASP  63   1.800 -11.239 -19.212
  478    H    GLY  64           H        GLY  64   4.083 -11.339 -15.809
  479   1HA   GLY  64          2HA       GLY  64   6.510 -11.084 -15.808
  480   2HA   GLY  64          1HA       GLY  64   6.478 -11.113 -17.571
  481    H    VAL  65           H        VAL  65   4.466  -9.225 -15.314
  482    HA   VAL  65           HA       VAL  65   5.635  -6.727 -16.477
  483    HB   VAL  65           HB       VAL  65   2.726  -7.129 -15.704
  484   1HG1  VAL  65          1HG1      VAL  65   4.126  -4.911 -17.228
  485   2HG1  VAL  65          2HG1      VAL  65   3.603  -4.810 -15.546
  486   3HG1  VAL  65          3HG1      VAL  65   2.408  -4.976 -16.833
  487   1HG2  VAL  65          1HG2      VAL  65   3.803  -6.852 -18.514
  488   2HG2  VAL  65          2HG2      VAL  65   2.201  -7.384 -18.005
  489   3HG2  VAL  65          3HG2      VAL  65   3.596  -8.434 -17.762
  490    H    GLY  66           H        GLY  66   6.315  -5.290 -14.946
  491   1HA   GLY  66          2HA       GLY  66   6.121  -6.011 -12.127
  492   2HA   GLY  66          1HA       GLY  66   6.976  -4.618 -12.784
  493    H    VAL  67           H        VAL  67   3.872  -5.823 -11.717
  494    HA   VAL  67           HA       VAL  67   2.290  -3.496 -12.265
  495    HB   VAL  67           HB       VAL  67   1.890  -5.402  -9.942
  496   1HG1  VAL  67          1HG1      VAL  67   0.024  -3.699 -11.616
  497   2HG1  VAL  67          2HG1      VAL  67   0.420  -3.471  -9.911
  498   3HG1  VAL  67          3HG1      VAL  67  -0.513  -4.880 -10.419
  499   1HG2  VAL  67          1HG2      VAL  67   2.095  -6.883 -11.765
  500   2HG2  VAL  67          2HG2      VAL  67   1.374  -5.737 -12.894
  501   3HG2  VAL  67          3HG2      VAL  67   0.362  -6.561 -11.708
  502    H    ASN  68           H        ASN  68   2.213  -1.555 -11.248
  503    HA   ASN  68           HA       ASN  68   3.824  -1.220  -8.754
  504   1HB   ASN  68          2HB       ASN  68   3.159   0.590 -11.059
  505   2HB   ASN  68          1HB       ASN  68   3.542   1.295  -9.488
  506   1HD2  ASN  68          1HD2      ASN  68   5.745   1.219  -8.772
  507   2HD2  ASN  68          2HD2      ASN  68   7.000   0.575  -9.718
  508    HA   PRO  69           HA       PRO  69   0.201  -0.148  -6.501
  509   1HB   PRO  69          2HB       PRO  69   1.288   1.604  -4.677
  510   2HB   PRO  69          1HB       PRO  69   1.528  -0.149  -4.614
  511   1HG   PRO  69          2HG       PRO  69   3.439   1.977  -5.451
  512   2HG   PRO  69          1HG       PRO  69   3.771   0.363  -4.800
  513   1HD   PRO  69          2HD       PRO  69   3.927   1.130  -7.528
  514   2HD   PRO  69          1HD       PRO  69   3.969  -0.530  -6.900
  515    H    ALA  70           H        ALA  70  -0.343   1.071  -8.677
  516    HA   ALA  70           HA       ALA  70  -0.976   3.892  -7.965
  517   1HB   ALA  70          1HB       ALA  70   0.292   3.015 -10.578
  518   2HB   ALA  70          2HB       ALA  70   1.053   4.008  -9.335
  519   3HB   ALA  70          3HB       ALA  70  -0.322   4.635 -10.244
  520    H    GLN  71           H        GLN  71  -1.483   1.264 -10.348
  521    HA   GLN  71           HA       GLN  71  -3.960   2.346 -11.371
  522   1HB   GLN  71          2HB       GLN  71  -2.843  -0.473 -11.443
  523   2HB   GLN  71          1HB       GLN  71  -4.249   0.068 -12.359
  524   1HG   GLN  71          2HG       GLN  71  -2.833   0.712 -13.989
  525   2HG   GLN  71          1HG       GLN  71  -2.261   1.976 -12.899
  526   1HE2  GLN  71          1HE2      GLN  71  -1.613  -1.389 -13.942
  527   2HE2  GLN  71          2HE2      GLN  71   0.003  -1.404 -13.425
  528    HA   PRO  72           HA       PRO  72  -6.829   0.943  -8.335
  529   1HB   PRO  72          2HB       PRO  72  -9.039   0.570  -9.929
  530   2HB   PRO  72          1HB       PRO  72  -8.431   2.165  -9.453
  531   1HG   PRO  72          2HG       PRO  72  -8.216   0.782 -12.087
  532   2HG   PRO  72          1HG       PRO  72  -8.226   2.517 -11.729
  533   1HD   PRO  72          2HD       PRO  72  -5.938   0.969 -12.325
  534   2HD   PRO  72          1HD       PRO  72  -5.938   2.602 -11.625
  535    H    ALA  73           H        ALA  73  -7.922  -0.976  -7.567
  536    HA   ALA  73           HA       ALA  73  -6.800  -3.473  -8.232
  537   1HB   ALA  73          1HB       ALA  73  -8.521  -4.467  -6.868
  538   2HB   ALA  73          2HB       ALA  73  -9.582  -3.079  -7.099
  539   3HB   ALA  73          3HB       ALA  73  -8.109  -2.914  -6.144
  540    H    GLY  74           H        GLY  74  -9.761  -1.951  -9.504
  541   1HA   GLY  74          2HA       GLY  74 -10.789  -4.170 -10.949
  542   2HA   GLY  74          1HA       GLY  74 -11.061  -2.483 -11.383
  543    H    ASN  75           H        ASN  75  -8.576  -1.577 -12.070
  544    HA   ASN  75           HA       ASN  75  -8.163  -2.741 -14.679
  545   1HB   ASN  75          2HB       ASN  75  -7.717  -0.313 -13.897
  546   2HB   ASN  75          1HB       ASN  75  -6.182  -0.937 -13.290
  547   1HD2  ASN  75          1HD2      ASN  75  -8.124  -0.602 -16.285
  548   2HD2  ASN  75          2HD2      ASN  75  -6.799  -0.711 -17.341
  549    H    ILE  76           H        ILE  76  -6.450  -3.027 -11.579
  550    HA   ILE  76           HA       ILE  76  -4.130  -4.398 -12.521
  551    HB   ILE  76           HB       ILE  76  -5.571  -4.594  -9.855
  552   1HG1  ILE  76          2HG1      ILE  76  -4.699  -2.330 -10.578
  553   2HG1  ILE  76          1HG1      ILE  76  -3.984  -2.943  -9.090
  554   1HG2  ILE  76          1HG2      ILE  76  -3.942  -5.970  -9.067
  555   2HG2  ILE  76          2HG2      ILE  76  -2.674  -5.155  -9.980
  556   3HG2  ILE  76          3HG2      ILE  76  -3.684  -6.366 -10.765
  557   1HD1  ILE  76          1HD1      ILE  76  -2.022  -3.737 -10.355
  558   2HD1  ILE  76          2HD1      ILE  76  -2.258  -2.005 -10.584
  559   3HD1  ILE  76          3HD1      ILE  76  -2.738  -3.135 -11.851
  560    H    PHE  77           H        PHE  77  -7.292  -5.644 -11.420
  561    HA   PHE  77           HA       PHE  77  -6.572  -8.428 -11.840
  562   1HB   PHE  77          2HB       PHE  77  -8.403  -7.489 -10.290
  563   2HB   PHE  77          1HB       PHE  77  -9.385  -7.326 -11.745
  564    HD1  PHE  77           HD1      PHE  77  -7.682  -9.717  -9.495
  565    HD2  PHE  77           HD2      PHE  77 -10.247  -9.267 -12.912
  566    HE1  PHE  77           HE1      PHE  77  -8.269 -12.123  -9.374
  567    HE2  PHE  77           HE2      PHE  77 -10.832 -11.674 -12.789
  568    HZ   PHE  77           HZ       PHE  77  -9.842 -13.101 -11.020
  569    H    LEU  78           H        LEU  78  -8.166  -5.930 -13.791
  570    HA   LEU  78           HA       LEU  78  -9.098  -7.709 -15.868
  571   1HB   LEU  78          2HB       LEU  78  -8.621  -4.729 -15.734
  572   2HB   LEU  78          1HB       LEU  78  -9.155  -5.514 -17.220
  573    HG   LEU  78           HG       LEU  78 -10.601  -5.909 -14.593
  574   1HD1  LEU  78          1HD1      LEU  78 -11.539  -3.868 -14.746
  575   2HD1  LEU  78          2HD1      LEU  78 -11.974  -4.153 -16.432
  576   3HD1  LEU  78          3HD1      LEU  78 -10.393  -3.483 -16.031
  577   1HD2  LEU  78          1HD2      LEU  78 -12.049  -7.147 -15.822
  578   2HD2  LEU  78          2HD2      LEU  78 -10.795  -7.170 -17.061
  579   3HD2  LEU  78          3HD2      LEU  78 -12.079  -5.963 -17.128
  580    H    LYS  79           H        LYS  79  -6.122  -5.778 -15.473
  581    HA   LYS  79           HA       LYS  79  -5.120  -6.717 -18.089
  582   1HB   LYS  79          2HB       LYS  79  -4.808  -4.348 -16.915
  583   2HB   LYS  79          1HB       LYS  79  -3.416  -5.154 -16.192
  584   1HG   LYS  79          2HG       LYS  79  -3.454  -5.839 -18.957
  585   2HG   LYS  79          1HG       LYS  79  -3.675  -4.093 -18.843
  586   1HD   LYS  79          2HD       LYS  79  -1.600  -3.748 -17.916
  587   2HD   LYS  79          1HD       LYS  79  -1.600  -5.304 -17.082
  588   1HE   LYS  79          2HE       LYS  79  -1.609  -6.074 -19.722
  589   2HE   LYS  79          1HE       LYS  79  -0.621  -4.615 -19.771
  590   1HZ   LYS  79          1HZ       LYS  79  -0.038  -6.406 -17.574
  591   2HZ   LYS  79          2HZ       LYS  79   1.014  -5.582 -18.623
  592   3HZ   LYS  79          3HZ       LYS  79   0.295  -7.042 -19.111
  593    H    HIS  80           H        HIS  80  -4.027  -6.890 -14.668
  594    HA   HIS  80           HA       HIS  80  -2.032  -8.933 -15.401
  595   1HB   HIS  80          2HB       HIS  80  -2.732  -7.914 -12.633
  596   2HB   HIS  80          1HB       HIS  80  -1.260  -8.752 -13.122
  597    HD1  HIS  80           HD1      HIS  80   0.004  -7.385 -15.260
  598    HD2  HIS  80           HD2      HIS  80  -2.358  -5.186 -12.621
  599    HE1  HIS  80           HE1      HIS  80   0.696  -4.964 -15.526
  600    H    GLY  81           H        GLY  81  -4.659  -8.825 -12.939
  601   1HA   GLY  81          2HA       GLY  81  -6.378 -10.673 -13.100
  602   2HA   GLY  81          1HA       GLY  81  -5.026 -11.763 -13.407
  603    H    SER  82           H        SER  82  -5.018 -13.061 -11.606
  604    HA   SER  82           HA       SER  82  -5.010 -11.719  -8.931
  605   1HB   SER  82          2HB       SER  82  -6.792 -13.529  -9.621
  606   2HB   SER  82          1HB       SER  82  -5.486 -14.665  -9.293
  607    HG   SER  82           HG       SER  82  -6.160 -14.431  -7.304
  608    H    GLU  83           H        GLU  83  -3.472 -14.356 -10.812
  609    HA   GLU  83           HA       GLU  83  -1.523 -15.058  -8.851
  610   1HB   GLU  83          2HB       GLU  83  -2.137 -15.827 -11.506
  611   2HB   GLU  83          1HB       GLU  83  -0.442 -15.337 -11.513
  612   1HG   GLU  83          2HG       GLU  83  -1.601 -17.214  -9.438
  613   2HG   GLU  83          1HG       GLU  83  -0.861 -17.780 -10.935
  614    H    LEU  84           H        LEU  84  -0.264 -13.516  -7.938
  615    HA   LEU  84           HA       LEU  84   1.427 -11.845  -9.740
  616   1HB   LEU  84          2HB       LEU  84  -0.121 -10.884  -7.315
  617   2HB   LEU  84          1HB       LEU  84   1.130  -9.942  -8.123
  618    HG   LEU  84           HG       LEU  84  -0.913 -11.029  -9.948
  619   1HD1  LEU  84          1HD1      LEU  84  -1.988 -10.211  -7.603
  620   2HD1  LEU  84          2HD1      LEU  84  -2.783  -9.973  -9.159
  621   3HD1  LEU  84          3HD1      LEU  84  -1.861  -8.657  -8.431
  622   1HD2  LEU  84          1HD2      LEU  84   0.067  -8.199  -9.467
  623   2HD2  LEU  84          2HD2      LEU  84  -0.724  -8.818 -10.917
  624   3HD2  LEU  84          3HD2      LEU  84   0.901  -9.361 -10.499
  625    H    ARG  85           H        ARG  85   3.389 -11.033  -8.614
  626    HA   ARG  85           HA       ARG  85   4.172 -12.710  -6.261
  627   1HB   ARG  85          2HB       ARG  85   5.312 -12.657  -8.917
  628   2HB   ARG  85          1HB       ARG  85   6.506 -12.111  -7.739
  629   1HG   ARG  85          2HG       ARG  85   6.678 -14.163  -6.780
  630   2HG   ARG  85          1HG       ARG  85   4.940 -14.452  -6.870
  631   1HD   ARG  85          2HD       ARG  85   6.406 -14.419  -9.457
  632   2HD   ARG  85          1HD       ARG  85   6.722 -15.790  -8.394
  633    HE   ARG  85           HE       ARG  85   4.260 -16.235  -8.429
  634   1HH1  ARG  85          1HH2      ARG  85   5.432 -16.538 -11.222
  635   2HH1  ARG  85          2HH2      ARG  85   4.261 -15.688 -12.173
  636   1HH2  ARG  85          2HH1      ARG  85   2.823 -14.091  -9.450
  637   2HH2  ARG  85          1HH1      ARG  85   2.782 -14.298 -11.168
  638    H    LEU  86           H        LEU  86   5.641 -11.668  -4.786
  639    HA   LEU  86           HA       LEU  86   5.654  -8.696  -5.057
  640   1HB   LEU  86          2HB       LEU  86   4.796 -10.191  -2.960
  641   2HB   LEU  86          1HB       LEU  86   6.480  -9.946  -2.499
  642    HG   LEU  86           HG       LEU  86   5.006  -7.560  -3.504
  643   1HD1  LEU  86          1HD1      LEU  86   4.297  -9.079  -1.029
  644   2HD1  LEU  86          2HD1      LEU  86   3.270  -8.106  -2.081
  645   3HD1  LEU  86          3HD1      LEU  86   4.348  -7.319  -0.928
  646   1HD2  LEU  86          1HD2      LEU  86   7.449  -8.117  -2.233
  647   2HD2  LEU  86          2HD2      LEU  86   6.460  -7.342  -0.995
  648   3HD2  LEU  86          3HD2      LEU  86   6.757  -6.522  -2.528
  649    H    ILE  87           H        ILE  87   7.532  -7.788  -5.664
  650    HA   ILE  87           HA       ILE  87  10.093  -9.186  -4.984
  651    HB   ILE  87           HB       ILE  87  11.024  -8.138  -7.062
  652   1HG1  ILE  87          2HG1      ILE  87   8.199  -7.625  -7.957
  653   2HG1  ILE  87          1HG1      ILE  87   9.041  -6.391  -7.020
  654   1HG2  ILE  87          1HG2      ILE  87   8.762 -10.105  -7.102
  655   2HG2  ILE  87          2HG2      ILE  87  10.476 -10.365  -7.426
  656   3HG2  ILE  87          3HG2      ILE  87   9.460  -9.575  -8.632
  657   1HD1  ILE  87          1HD1      ILE  87  10.954  -6.587  -8.676
  658   2HD1  ILE  87          2HD1      ILE  87   9.465  -5.906  -9.333
  659   3HD1  ILE  87          3HD1      ILE  87   9.891  -7.584  -9.669
  660    HA   PRO  88           HA       PRO  88  11.353  -5.451  -3.041
  661   1HB   PRO  88          2HB       PRO  88  14.074  -5.577  -3.449
  662   2HB   PRO  88          1HB       PRO  88  13.207  -6.588  -2.279
  663   1HG   PRO  88          2HG       PRO  88  14.336  -7.341  -4.935
  664   2HG   PRO  88          1HG       PRO  88  14.054  -8.351  -3.507
  665   1HD   PRO  88          2HD       PRO  88  12.419  -8.255  -5.812
  666   2HD   PRO  88          1HD       PRO  88  11.981  -8.985  -4.253
  667    H    ARG  89           H        ARG  89  10.546  -3.720  -4.260
  668    HA   ARG  89           HA       ARG  89  10.692  -1.788  -5.574
  669   1HB   ARG  89          2HB       ARG  89  13.204  -2.027  -4.835
  670   2HB   ARG  89          1HB       ARG  89  13.445  -2.543  -6.504
  671   1HG   ARG  89          2HG       ARG  89  13.670  -0.299  -6.876
  672   2HG   ARG  89          1HG       ARG  89  11.908  -0.346  -6.916
  673   1HD   ARG  89          2HD       ARG  89  13.484   0.118  -4.374
  674   2HD   ARG  89          1HD       ARG  89  12.907   1.432  -5.399
  675    HE   ARG  89           HE       ARG  89  11.220  -0.349  -3.747
  676   1HH1  ARG  89          2HH1      ARG  89  11.369   2.783  -4.171
  677   2HH1  ARG  89          1HH1      ARG  89   9.809   3.038  -4.879
  678   1HH2  ARG  89          1HH2      ARG  89   9.252  -0.330  -5.516
  679   2HH2  ARG  89          2HH2      ARG  89   8.608   1.273  -5.640
  680    H    ASP  90           H        ASP  90  10.090  -1.320  -7.669
  681    HA   ASP  90           HA       ASP  90   9.772  -3.602  -9.500
  682   1HB   ASP  90          2HB       ASP  90   8.214  -1.421  -8.960
  683   2HB   ASP  90          1HB       ASP  90   9.034  -0.885 -10.424
  684    H    ARG  91           H        ARG  91  11.574  -0.544  -9.359
  685    HA   ARG  91           HA       ARG  91  13.376   0.259 -10.594
  686   1HB   ARG  91          2HB       ARG  91  13.645  -2.714 -10.801
  687   2HB   ARG  91          1HB       ARG  91  14.659  -1.717 -11.844
  688   1HG   ARG  91          2HG       ARG  91  15.810  -0.774 -10.061
  689   2HG   ARG  91          1HG       ARG  91  14.461  -0.986  -8.945
  690   1HD   ARG  91          2HD       ARG  91  16.142  -3.248 -10.057
  691   2HD   ARG  91          1HD       ARG  91  16.355  -2.532  -8.459
  692    HE   ARG  91           HE       ARG  91  13.795  -3.240  -8.242
  693   1HH1  ARG  91          1HH2      ARG  91  13.873  -4.896 -10.700
  694   2HH1  ARG  91          2HH2      ARG  91  14.324  -6.456 -10.097
  695   1HH2  ARG  91          2HH1      ARG  91  15.495  -5.218  -7.060
  696   2HH2  ARG  91          1HH1      ARG  91  15.248  -6.640  -8.018
  697    H    VAL  92           H        VAL  92  11.135   0.846 -11.827
  698    HA   VAL  92           HA       VAL  92  11.677   0.311 -14.716
  699    HB   VAL  92           HB       VAL  92   9.155   0.501 -15.059
  700   1HG1  VAL  92          1HG1      VAL  92   8.758  -1.868 -14.360
  701   2HG1  VAL  92          2HG1      VAL  92  10.285  -1.821 -13.478
  702   3HG1  VAL  92          3HG1      VAL  92  10.275  -1.641 -15.232
  703   1HG2  VAL  92          1HG2      VAL  92   8.033  -0.415 -12.786
  704   2HG2  VAL  92          2HG2      VAL  92   8.141   1.305 -13.155
  705   3HG2  VAL  92          3HG2      VAL  92   9.322   0.558 -12.080
  706    H    GLY  93           H        GLY  93  12.695   2.497 -13.274
  707   1HA   GLY  93          2HA       GLY  93  12.918   4.768 -14.149
  708   2HA   GLY  93          1HA       GLY  93  11.199   4.745 -14.542
  709    H    HIS  94           HN       HIS  94  13.208   4.219 -11.609
  710    HA   HIS  94           HA       HIS  94  11.172   5.756 -10.055
  711   1HB   HIS  94          2HB       HIS  94  13.262   3.725  -9.247
  712   2HB   HIS  94          1HB       HIS  94  12.444   4.745  -8.063
  713    HD1  HIS  94           HD1      HIS  94  10.499   3.561  -7.064
  714    HD2  HIS  94           HD2      HIS  94  11.025   2.516 -11.058
  715    HE1  HIS  94           HE1      HIS  94   8.649   1.927  -7.623
  Start of MODEL   24
    1   1H    MET   1          1H        MET   1  -8.328 -19.080 -17.351
    2   2H    MET   1          2H        MET   1  -7.337 -17.705 -17.235
    3   3H    MET   1          3H        MET   1  -7.142 -18.789 -18.528
    4    HA   MET   1           HA       MET   1  -8.286 -16.858 -19.323
    5   1HB   MET   1          2HB       MET   1  -9.087 -19.428 -19.723
    6   2HB   MET   1          1HB       MET   1 -10.578 -18.724 -19.100
    7   1HG   MET   1          2HG       MET   1 -10.181 -16.817 -20.782
    8   2HG   MET   1          1HG       MET   1  -8.994 -17.883 -21.530
    9   1HE   MET   1          1HE       MET   1 -12.246 -17.771 -23.751
   10   2HE   MET   1          2HE       MET   1 -10.493 -17.860 -23.916
   11   3HE   MET   1          3HE       MET   1 -11.211 -16.601 -22.921
   12    H    SER   2           H        SER   2 -10.468 -18.466 -16.960
   13    HA   SER   2           HA       SER   2 -11.707 -15.823 -16.391
   14   1HB   SER   2          2HB       SER   2 -13.349 -17.255 -15.067
   15   2HB   SER   2          1HB       SER   2 -13.330 -17.532 -16.805
   16    HG   SER   2           HG       SER   2 -13.263 -19.465 -15.470
   17    H    GLY   3           H        GLY   3 -10.254 -18.579 -14.618
   18   1HA   GLY   3          2HA       GLY   3  -9.609 -16.679 -12.391
   19   2HA   GLY   3          1HA       GLY   3 -10.125 -18.338 -12.087
   20    H    GLY   4           H        GLY   4  -7.434 -16.314 -12.753
   21   1HA   GLY   4          2HA       GLY   4  -5.281 -17.562 -11.995
   22   2HA   GLY   4          1HA       GLY   4  -5.684 -18.676 -13.302
   23    H    THR   5           H        THR   5  -5.875 -17.669 -15.521
   24    HA   THR   5           HA       THR   5  -3.815 -15.522 -15.836
   25    HB   THR   5           HB       THR   5  -4.838 -17.365 -18.011
   26    HG1  THR   5           HG1      THR   5  -3.702 -18.886 -17.152
   27   1HG2  THR   5          1HG2      THR   5  -2.081 -16.232 -17.887
   28   2HG2  THR   5          2HG2      THR   5  -3.397 -15.121 -18.265
   29   3HG2  THR   5          3HG2      THR   5  -3.112 -16.528 -19.288
   30    H    ALA   6           H        ALA   6  -4.430 -13.571 -16.690
   31    HA   ALA   6           HA       ALA   6  -5.880 -11.869 -17.406
   32   1HB   ALA   6          1HB       ALA   6  -5.718 -12.502 -19.610
   33   2HB   ALA   6          2HB       ALA   6  -7.428 -12.861 -19.380
   34   3HB   ALA   6          3HB       ALA   6  -6.235 -14.157 -19.284
   35    H    ALA   7           H        ALA   7  -6.773 -12.971 -15.061
   36    HA   ALA   7           HA       ALA   7  -9.414 -14.053 -15.081
   37   1HB   ALA   7          1HB       ALA   7  -7.835 -13.998 -13.109
   38   2HB   ALA   7          2HB       ALA   7  -9.487 -13.504 -12.735
   39   3HB   ALA   7          3HB       ALA   7  -8.225 -12.287 -12.926
   40    H    THR   8           H        THR   8 -11.348 -13.112 -15.500
   41    HA   THR   8           HA       THR   8 -11.441 -10.196 -16.007
   42    HB   THR   8           HB       THR   8 -13.922 -10.897 -16.607
   43    HG1  THR   8           HG1      THR   8 -14.266 -12.963 -16.667
   44   1HG2  THR   8          1HG2      THR   8 -13.188 -11.381 -18.881
   45   2HG2  THR   8          2HG2      THR   8 -11.576 -11.800 -18.301
   46   3HG2  THR   8          3HG2      THR   8 -12.148 -10.136 -18.185
   47    H    THR   9           H        THR   9 -12.554  -8.757 -14.722
   48    HA   THR   9           HA       THR   9 -13.132  -9.454 -11.997
   49    HB   THR   9           HB       THR   9 -13.961  -7.019 -13.614
   50    HG1  THR   9           HG1      THR   9 -12.059  -6.255 -13.099
   51   1HG2  THR   9          1HG2      THR   9 -13.633  -6.812 -10.688
   52   2HG2  THR   9          2HG2      THR   9 -15.019  -7.771 -11.203
   53   3HG2  THR   9          3HG2      THR   9 -14.856  -6.098 -11.736
   54    H    ALA  10           H        ALA  10 -14.742 -10.942 -11.649
   55    HA   ALA  10           HA       ALA  10 -17.438 -10.336 -12.802
   56   1HB   ALA  10          1HB       ALA  10 -17.215 -12.334 -13.861
   57   2HB   ALA  10          2HB       ALA  10 -17.492 -13.044 -12.271
   58   3HB   ALA  10          3HB       ALA  10 -15.845 -12.810 -12.858
   59    H    GLY  11           H        GLY  11 -18.888  -9.875 -11.225
   60   1HA   GLY  11          2HA       GLY  11 -20.021 -10.870  -9.181
   61   2HA   GLY  11          1HA       GLY  11 -18.406 -10.997  -8.488
   62    H    SER  12           H        SER  12 -17.838  -9.360  -7.154
   63    HA   SER  12           HA       SER  12 -18.965  -6.642  -7.658
   64   1HB   SER  12          2HB       SER  12 -19.537  -8.389  -5.411
   65   2HB   SER  12          1HB       SER  12 -18.776  -6.897  -4.865
   66    HG   SER  12           HG       SER  12 -20.787  -6.222  -5.067
   67    H    LYS  13           H        LYS  13 -16.573  -8.495  -5.716
   68    HA   LYS  13           HA       LYS  13 -14.755  -6.119  -5.910
   69   1HB   LYS  13          2HB       LYS  13 -14.806  -8.344  -3.845
   70   2HB   LYS  13          1HB       LYS  13 -13.641  -7.022  -3.884
   71   1HG   LYS  13          2HG       LYS  13 -15.623  -5.427  -3.774
   72   2HG   LYS  13          1HG       LYS  13 -16.628  -6.834  -3.432
   73   1HD   LYS  13          2HD       LYS  13 -14.282  -6.869  -1.744
   74   2HD   LYS  13          1HD       LYS  13 -15.119  -5.327  -1.580
   75   1HE   LYS  13          2HE       LYS  13 -17.148  -6.371  -0.922
   76   2HE   LYS  13          1HE       LYS  13 -16.607  -7.954  -1.479
   77   1HZ   LYS  13          1HZ       LYS  13 -16.055  -8.264   0.650
   78   2HZ   LYS  13          2HZ       LYS  13 -16.098  -6.607   1.019
   79   3HZ   LYS  13          3HZ       LYS  13 -14.707  -7.289   0.319
   80    H    VAL  14           H        VAL  14 -12.385  -6.731  -5.957
   81    HA   VAL  14           HA       VAL  14 -11.979  -9.157  -7.666
   82    HB   VAL  14           HB       VAL  14 -10.006  -7.972  -8.603
   83   1HG1  VAL  14          1HG1      VAL  14 -12.303  -7.773  -9.617
   84   2HG1  VAL  14          2HG1      VAL  14 -11.236  -6.415  -9.976
   85   3HG1  VAL  14          3HG1      VAL  14 -12.493  -6.249  -8.749
   86   1HG2  VAL  14          1HG2      VAL  14 -10.143  -5.369  -8.080
   87   2HG2  VAL  14          2HG2      VAL  14  -9.217  -6.451  -7.041
   88   3HG2  VAL  14          3HG2      VAL  14 -10.832  -5.938  -6.563
   89    H    THR  15           H        THR  15 -10.508 -10.674  -6.994
   90    HA   THR  15           HA       THR  15  -9.132 -10.174  -4.398
   91    HB   THR  15           HB       THR  15 -10.624 -12.170  -4.592
   92    HG1  THR  15           HG1      THR  15  -9.220 -12.688  -3.123
   93   1HG2  THR  15          1HG2      THR  15  -8.968 -12.596  -6.979
   94   2HG2  THR  15          2HG2      THR  15 -10.557 -13.245  -6.582
   95   3HG2  THR  15          3HG2      THR  15  -9.105 -14.030  -5.962
   96    H    PHE  16           H        PHE  16  -6.873 -10.925  -4.162
   97    HA   PHE  16           HA       PHE  16  -5.369 -11.134  -6.731
   98   1HB   PHE  16          2HB       PHE  16  -4.723  -9.239  -4.454
   99   2HB   PHE  16          1HB       PHE  16  -3.663  -9.554  -5.825
  100    HD1  PHE  16           HD1      PHE  16  -4.740  -9.242  -8.206
  101    HD2  PHE  16           HD2      PHE  16  -6.291  -7.506  -4.595
  102    HE1  PHE  16           HE1      PHE  16  -5.957  -7.546  -9.544
  103    HE2  PHE  16           HE2      PHE  16  -7.508  -5.812  -5.935
  104    HZ   PHE  16           HZ       PHE  16  -7.339  -5.832  -8.407
  105    H    LYS  17           H        LYS  17  -3.548 -12.427  -6.620
  106    HA   LYS  17           HA       LYS  17  -2.961 -13.718  -3.982
  107   1HB   LYS  17          2HB       LYS  17  -3.587 -14.867  -6.601
  108   2HB   LYS  17          1HB       LYS  17  -2.058 -15.466  -5.959
  109   1HG   LYS  17          2HG       LYS  17  -3.056 -16.448  -4.110
  110   2HG   LYS  17          1HG       LYS  17  -4.414 -15.323  -4.116
  111   1HD   LYS  17          2HD       LYS  17  -4.405 -16.810  -6.584
  112   2HD   LYS  17          1HD       LYS  17  -4.333 -17.932  -5.225
  113   1HE   LYS  17          2HE       LYS  17  -6.369 -17.214  -4.346
  114   2HE   LYS  17          1HE       LYS  17  -6.270 -15.639  -5.132
  115   1HZ   LYS  17          1HZ       LYS  17  -6.433 -18.046  -6.806
  116   2HZ   LYS  17          2HZ       LYS  17  -6.997 -16.472  -7.113
  117   3HZ   LYS  17          3HZ       LYS  17  -7.843 -17.489  -6.048
  118    H    ILE  18           H        ILE  18  -1.037 -12.882  -3.299
  119    HA   ILE  18           HA       ILE  18   1.132 -12.527  -5.335
  120    HB   ILE  18           HB       ILE  18   0.732 -10.902  -2.803
  121   1HG1  ILE  18          2HG1      ILE  18   0.426  -9.258  -5.060
  122   2HG1  ILE  18          1HG1      ILE  18  -0.518 -10.700  -5.429
  123   1HG2  ILE  18          1HG2      ILE  18   2.944 -11.252  -4.563
  124   2HG2  ILE  18          2HG2      ILE  18   2.792 -10.118  -3.221
  125   3HG2  ILE  18          3HG2      ILE  18   2.297  -9.635  -4.843
  126   1HD1  ILE  18          1HD1      ILE  18  -2.119  -9.591  -4.221
  127   2HD1  ILE  18          2HD1      ILE  18  -0.933  -8.656  -3.311
  128   3HD1  ILE  18          3HD1      ILE  18  -1.270 -10.328  -2.861
  129    H    THR  19           H        THR  19   2.915 -13.751  -4.960
  130    HA   THR  19           HA       THR  19   3.337 -14.836  -2.200
  131    HB   THR  19           HB       THR  19   2.740 -16.488  -4.084
  132    HG1  THR  19           HG1      THR  19   3.601 -17.637  -2.569
  133   1HG2  THR  19          1HG2      THR  19   5.565 -16.578  -4.906
  134   2HG2  THR  19          2HG2      THR  19   4.700 -15.151  -5.475
  135   3HG2  THR  19          3HG2      THR  19   4.102 -16.759  -5.875
  136    H    LEU  20           H        LEU  20   5.557 -14.933  -1.458
  137    HA   LEU  20           HA       LEU  20   7.178 -12.712  -2.359
  138   1HB   LEU  20          2HB       LEU  20   7.068 -13.807   0.006
  139   2HB   LEU  20          1HB       LEU  20   8.254 -14.940  -0.642
  140    HG   LEU  20           HG       LEU  20   9.611 -12.910  -1.373
  141   1HD1  LEU  20          1HD1      LEU  20   7.596 -11.548   0.438
  142   2HD1  LEU  20          2HD1      LEU  20   7.862 -11.224  -1.274
  143   3HD1  LEU  20          3HD1      LEU  20   9.108 -10.812  -0.096
  144   1HD2  LEU  20          1HD2      LEU  20   9.579 -14.306   0.993
  145   2HD2  LEU  20          2HD2      LEU  20   9.430 -12.643   1.560
  146   3HD2  LEU  20          3HD2      LEU  20  10.802 -13.113   0.555
  147    H    THR  21           H        THR  21   8.835 -12.680  -3.794
  148    HA   THR  21           HA       THR  21   9.398 -15.146  -5.323
  149    HB   THR  21           HB       THR  21  10.682 -13.565  -6.814
  150    HG1  THR  21           HG1      THR  21  10.221 -11.310  -6.365
  151   1HG2  THR  21          1HG2      THR  21   8.388 -14.083  -7.360
  152   2HG2  THR  21          2HG2      THR  21   8.617 -12.349  -7.593
  153   3HG2  THR  21          3HG2      THR  21   7.793 -12.944  -6.152
  154    H    SER  22           H        SER  22  10.915 -13.125  -2.911
  155    HA   SER  22           HA       SER  22  13.654 -13.800  -3.378
  156   1HB   SER  22          2HB       SER  22  12.151 -12.393  -1.385
  157   2HB   SER  22          1HB       SER  22  13.211 -13.536  -0.568
  158    HG   SER  22           HG       SER  22  14.500 -11.831  -0.904
  159    H    ASP  23           H        ASP  23  11.270 -15.281  -1.131
  160    HA   ASP  23           HA       ASP  23  12.803 -17.825  -1.358
  161   1HB   ASP  23          2HB       ASP  23  12.489 -18.161   1.126
  162   2HB   ASP  23          1HB       ASP  23  13.609 -16.867   0.704
  163    HA   PRO  24           HA       PRO  24   8.793 -19.606  -1.679
  164   1HB   PRO  24          2HB       PRO  24   9.471 -22.199  -1.059
  165   2HB   PRO  24          1HB       PRO  24   9.847 -21.426  -2.609
  166   1HG   PRO  24          2HG       PRO  24  11.671 -22.069  -0.346
  167   2HG   PRO  24          1HG       PRO  24  12.044 -21.872  -2.066
  168   1HD   PRO  24          2HD       PRO  24  12.500 -19.956  -0.020
  169   2HD   PRO  24          1HD       PRO  24  12.612 -19.675  -1.771
  170    H    LYS  25           H        LYS  25  10.406 -19.330   1.323
  171    HA   LYS  25           HA       LYS  25   8.854 -20.947   3.068
  172   1HB   LYS  25          2HB       LYS  25  10.933 -19.189   3.396
  173   2HB   LYS  25          1HB       LYS  25   9.602 -18.282   4.114
  174   1HG   LYS  25          2HG       LYS  25   9.095 -20.095   5.631
  175   2HG   LYS  25          1HG       LYS  25  10.243 -21.159   4.821
  176   1HD   LYS  25          2HD       LYS  25  12.068 -20.171   5.799
  177   2HD   LYS  25          1HD       LYS  25  11.322 -18.574   5.828
  178   1HE   LYS  25          2HE       LYS  25   9.699 -19.917   7.561
  179   2HE   LYS  25          1HE       LYS  25  11.233 -20.736   7.849
  180   1HZ   LYS  25          1HZ       LYS  25  12.254 -18.507   8.119
  181   2HZ   LYS  25          2HZ       LYS  25  11.088 -18.872   9.300
  182   3HZ   LYS  25          3HZ       LYS  25  10.704 -17.820   8.025
  183    H    LEU  26           H        LEU  26   8.410 -17.441   2.389
  184    HA   LEU  26           HA       LEU  26   5.841 -17.287   3.667
  185   1HB   LEU  26          2HB       LEU  26   7.374 -15.548   1.756
  186   2HB   LEU  26          1HB       LEU  26   5.678 -15.187   2.077
  187    HG   LEU  26           HG       LEU  26   7.347 -15.747   4.466
  188   1HD1  LEU  26          1HD1      LEU  26   7.602 -13.119   2.977
  189   2HD1  LEU  26          2HD1      LEU  26   8.843 -14.372   2.983
  190   3HD1  LEU  26          3HD1      LEU  26   8.397 -13.567   4.487
  191   1HD2  LEU  26          1HD2      LEU  26   5.946 -14.052   5.433
  192   2HD2  LEU  26          2HD2      LEU  26   4.901 -15.041   4.411
  193   3HD2  LEU  26          3HD2      LEU  26   5.454 -13.464   3.844
  194    HA   PRO  27           HA       PRO  27   3.581 -19.364   0.429
  195   1HB   PRO  27          2HB       PRO  27   1.148 -19.227   1.704
  196   2HB   PRO  27          1HB       PRO  27   2.396 -20.422   2.091
  197   1HG   PRO  27          2HG       PRO  27   1.590 -17.985   3.613
  198   2HG   PRO  27          1HG       PRO  27   2.303 -19.496   4.206
  199   1HD   PRO  27          2HD       PRO  27   3.691 -17.069   3.811
  200   2HD   PRO  27          1HD       PRO  27   4.434 -18.666   4.043
  201    H    PHE  28           H        PHE  28   1.145 -18.828  -0.469
  202    HA   PHE  28           HA       PHE  28   1.364 -16.277  -1.802
  203   1HB   PHE  28          2HB       PHE  28  -0.395 -18.614  -1.895
  204   2HB   PHE  28          1HB       PHE  28  -1.266 -17.104  -2.147
  205    HD1  PHE  28           HD1      PHE  28   1.085 -19.487  -3.558
  206    HD2  PHE  28           HD2      PHE  28  -0.502 -15.514  -3.946
  207    HE1  PHE  28           HE1      PHE  28   1.952 -19.367  -5.877
  208    HE2  PHE  28           HE2      PHE  28   0.365 -15.393  -6.265
  209    HZ   PHE  28           HZ       PHE  28   1.592 -17.320  -7.232
  210    H    LYS  29           H        LYS  29  -0.277 -14.569  -1.728
  211    HA   LYS  29           HA       LYS  29  -1.547 -14.265   0.967
  212   1HB   LYS  29          2HB       LYS  29   0.423 -12.609  -0.333
  213   2HB   LYS  29          1HB       LYS  29  -1.075 -11.697  -0.163
  214   1HG   LYS  29          2HG       LYS  29  -0.294 -11.283   1.938
  215   2HG   LYS  29          1HG       LYS  29  -0.943 -12.886   2.284
  216   1HD   LYS  29          2HD       LYS  29   1.648 -13.232   1.133
  217   2HD   LYS  29          1HD       LYS  29   1.784 -12.016   2.404
  218   1HE   LYS  29          2HE       LYS  29   0.852 -13.495   4.043
  219   2HE   LYS  29          1HE       LYS  29   0.351 -14.651   2.811
  220   1HZ   LYS  29          1HZ       LYS  29   2.902 -14.326   4.079
  221   2HZ   LYS  29          2HZ       LYS  29   3.025 -14.382   2.387
  222   3HZ   LYS  29          3HZ       LYS  29   2.277 -15.654   3.230
  223    H    VAL  30           H        VAL  30  -3.734 -14.127   0.792
  224    HA   VAL  30           HA       VAL  30  -4.911 -13.447  -1.856
  225    HB   VAL  30           HB       VAL  30  -6.246 -14.589   0.622
  226   1HG1  VAL  30          1HG1      VAL  30  -7.169 -14.206  -2.242
  227   2HG1  VAL  30          2HG1      VAL  30  -7.858 -13.470  -0.794
  228   3HG1  VAL  30          3HG1      VAL  30  -8.021 -15.205  -1.064
  229   1HG2  VAL  30          1HG2      VAL  30  -4.921 -15.836  -1.776
  230   2HG2  VAL  30          2HG2      VAL  30  -6.290 -16.649  -1.017
  231   3HG2  VAL  30          3HG2      VAL  30  -4.832 -16.317  -0.081
  232    H    LEU  31           H        LEU  31  -5.568 -11.395  -2.162
  233    HA   LEU  31           HA       LEU  31  -6.475  -9.809   0.213
  234   1HB   LEU  31          2HB       LEU  31  -4.440  -9.250  -1.753
  235   2HB   LEU  31          1HB       LEU  31  -5.729  -8.056  -1.897
  236    HG   LEU  31           HG       LEU  31  -5.144  -8.571   0.893
  237   1HD1  LEU  31          1HD1      LEU  31  -2.875  -7.857   1.030
  238   2HD1  LEU  31          2HD1      LEU  31  -2.833  -7.413  -0.677
  239   3HD1  LEU  31          3HD1      LEU  31  -2.891  -9.113  -0.208
  240   1HD2  LEU  31          1HD2      LEU  31  -4.637  -6.051  -0.701
  241   2HD2  LEU  31          2HD2      LEU  31  -5.104  -6.192   0.994
  242   3HD2  LEU  31          3HD2      LEU  31  -6.267  -6.574  -0.276
  243    H    SER  32           H        SER  32  -8.683  -9.839   0.071
  244    HA   SER  32           HA       SER  32  -9.962  -9.573  -2.603
  245   1HB   SER  32          2HB       SER  32 -10.783 -10.686   0.026
  246   2HB   SER  32          1HB       SER  32 -12.048  -9.887  -0.904
  247    HG   SER  32           HG       SER  32 -11.621 -12.219  -1.310
  248    H    VAL  33           H        VAL  33 -10.102  -7.448  -3.167
  249    HA   VAL  33           HA       VAL  33 -11.420  -5.589  -1.236
  250    HB   VAL  33           HB       VAL  33  -9.925  -3.759  -2.142
  251   1HG1  VAL  33          1HG1      VAL  33  -9.321  -4.436   0.009
  252   2HG1  VAL  33          2HG1      VAL  33  -7.830  -4.722  -0.890
  253   3HG1  VAL  33          3HG1      VAL  33  -8.904  -6.069  -0.512
  254   1HG2  VAL  33          1HG2      VAL  33  -9.262  -5.190  -4.174
  255   2HG2  VAL  33          2HG2      VAL  33  -8.161  -6.031  -3.083
  256   3HG2  VAL  33          3HG2      VAL  33  -7.961  -4.304  -3.378
  257    HA   PRO  34           HA       PRO  34 -13.964  -4.570  -4.673
  258   1HB   PRO  34          2HB       PRO  34 -14.641  -1.985  -4.012
  259   2HB   PRO  34          1HB       PRO  34 -15.316  -3.415  -3.213
  260   1HG   PRO  34          2HG       PRO  34 -13.258  -1.499  -2.212
  261   2HG   PRO  34          1HG       PRO  34 -14.413  -2.485  -1.298
  262   1HD   PRO  34          2HD       PRO  34 -11.675  -3.067  -1.634
  263   2HD   PRO  34          1HD       PRO  34 -12.914  -4.210  -1.074
  264    H    GLU  35           H        GLU  35 -14.117  -3.114  -6.570
  265    HA   GLU  35           HA       GLU  35 -11.627  -2.498  -7.775
  266   1HB   GLU  35          2HB       GLU  35 -13.694  -2.845  -9.066
  267   2HB   GLU  35          1HB       GLU  35 -14.368  -1.359  -8.405
  268   1HG   GLU  35          2HG       GLU  35 -11.730  -0.910  -9.563
  269   2HG   GLU  35          1HG       GLU  35 -12.848  -1.592 -10.742
  270    H    SER  36           H        SER  36 -13.784  -0.481  -5.818
  271    HA   SER  36           HA       SER  36 -12.703   2.078  -6.352
  272   1HB   SER  36          2HB       SER  36 -13.438   2.623  -3.988
  273   2HB   SER  36          1HB       SER  36 -14.685   1.902  -4.999
  274    HG   SER  36           HG       SER  36 -14.036   1.058  -2.699
  275    H    THR  37           H        THR  37 -11.568  -0.424  -4.068
  276    HA   THR  37           HA       THR  37  -9.464   1.148  -2.903
  277    HB   THR  37           HB       THR  37  -9.797  -1.854  -3.202
  278    HG1  THR  37           HG1      THR  37 -11.288  -1.049  -1.824
  279   1HG2  THR  37          1HG2      THR  37  -8.057  -1.996  -1.417
  280   2HG2  THR  37          2HG2      THR  37  -7.772  -0.265  -1.600
  281   3HG2  THR  37          3HG2      THR  37  -7.424  -1.362  -2.937
  282    HA   PRO  38           HA       PRO  38  -6.816   1.115  -6.491
  283   1HB   PRO  38          2HB       PRO  38  -4.866   2.689  -5.362
  284   2HB   PRO  38          1HB       PRO  38  -6.379   3.326  -6.029
  285   1HG   PRO  38          2HG       PRO  38  -5.577   2.997  -3.177
  286   2HG   PRO  38          1HG       PRO  38  -6.723   4.139  -3.895
  287   1HD   PRO  38          2HD       PRO  38  -7.392   1.765  -2.503
  288   2HD   PRO  38          1HD       PRO  38  -8.495   2.746  -3.491
  289    H    PHE  39           H        PHE  39  -4.520   0.477  -6.953
  290    HA   PHE  39           HA       PHE  39  -3.765  -1.921  -5.559
  291   1HB   PHE  39          2HB       PHE  39  -3.226  -1.092  -8.010
  292   2HB   PHE  39          1HB       PHE  39  -1.794  -0.410  -7.242
  293    HD1  PHE  39           HD1      PHE  39  -3.778  -3.606  -7.082
  294    HD2  PHE  39           HD2      PHE  39   0.100  -1.763  -7.248
  295    HE1  PHE  39           HE1      PHE  39  -2.712  -5.844  -7.083
  296    HE2  PHE  39           HE2      PHE  39   1.163  -4.001  -7.249
  297    HZ   PHE  39           HZ       PHE  39  -0.242  -6.042  -7.166
  298    H    THR  40           H        THR  40  -3.100   1.419  -4.922
  299    HA   THR  40           HA       THR  40  -0.568   1.211  -3.608
  300    HB   THR  40           HB       THR  40  -1.369   3.256  -2.323
  301    HG1  THR  40           HG1      THR  40  -3.414   3.651  -2.336
  302   1HG2  THR  40          1HG2      THR  40  -0.183   3.609  -4.373
  303   2HG2  THR  40          2HG2      THR  40  -1.596   4.664  -4.419
  304   3HG2  THR  40          3HG2      THR  40  -1.592   3.158  -5.336
  305    H    ALA  41           H        ALA  41  -3.907   0.880  -2.391
  306    HA   ALA  41           HA       ALA  41  -3.075   0.222   0.320
  307   1HB   ALA  41          1HB       ALA  41  -5.270   1.182   0.014
  308   2HB   ALA  41          2HB       ALA  41  -5.498  -0.483   0.552
  309   3HB   ALA  41          3HB       ALA  41  -5.712  -0.068  -1.150
  310    H    VAL  42           H        VAL  42  -4.005  -1.619  -2.581
  311    HA   VAL  42           HA       VAL  42  -4.119  -4.210  -1.372
  312    HB   VAL  42           HB       VAL  42  -3.324  -3.423  -4.198
  313   1HG1  VAL  42          1HG1      VAL  42  -2.650  -5.624  -4.182
  314   2HG1  VAL  42          2HG1      VAL  42  -4.373  -5.886  -4.457
  315   3HG1  VAL  42          3HG1      VAL  42  -3.704  -6.048  -2.834
  316   1HG2  VAL  42          1HG2      VAL  42  -5.973  -4.297  -2.996
  317   2HG2  VAL  42          2HG2      VAL  42  -5.683  -4.011  -4.712
  318   3HG2  VAL  42          3HG2      VAL  42  -5.581  -2.674  -3.566
  319    H    LEU  43           H        LEU  43  -1.408  -2.463  -2.911
  320    HA   LEU  43           HA       LEU  43   0.551  -4.530  -2.497
  321   1HB   LEU  43          2HB       LEU  43   0.653  -2.448  -4.048
  322   2HB   LEU  43          1HB       LEU  43   1.208  -1.586  -2.612
  323    HG   LEU  43           HG       LEU  43   2.599  -4.133  -2.973
  324   1HD1  LEU  43          1HD1      LEU  43   2.892  -2.011  -5.121
  325   2HD1  LEU  43          2HD1      LEU  43   2.205  -3.618  -5.358
  326   3HD1  LEU  43          3HD1      LEU  43   3.910  -3.439  -4.941
  327   1HD2  LEU  43          1HD2      LEU  43   3.155  -2.056  -1.526
  328   2HD2  LEU  43          2HD2      LEU  43   3.760  -1.344  -3.021
  329   3HD2  LEU  43          3HD2      LEU  43   4.486  -2.823  -2.392
  330    H    LYS  44           H        LYS  44  -0.496  -1.751  -0.541
  331    HA   LYS  44           HA       LYS  44   1.560  -1.906   1.445
  332   1HB   LYS  44          2HB       LYS  44  -0.975  -0.513   1.089
  333   2HB   LYS  44          1HB       LYS  44  -0.736  -1.009   2.765
  334   1HG   LYS  44          2HG       LYS  44   1.560  -0.002   2.674
  335   2HG   LYS  44          1HG       LYS  44   1.179   0.614   1.066
  336   1HD   LYS  44          2HD       LYS  44  -1.005   1.440   2.531
  337   2HD   LYS  44          1HD       LYS  44   0.306   1.589   3.701
  338   1HE   LYS  44          2HE       LYS  44   0.607   3.618   2.688
  339   2HE   LYS  44          1HE       LYS  44   1.515   2.657   1.526
  340   1HZ   LYS  44          1HZ       LYS  44   0.106   3.469   0.028
  341   2HZ   LYS  44          2HZ       LYS  44  -0.981   4.031   1.206
  342   3HZ   LYS  44          3HZ       LYS  44  -1.057   2.419   0.678
  343    H    PHE  45           H        PHE  45  -1.694  -3.393   1.309
  344    HA   PHE  45           HA       PHE  45  -1.495  -4.716   3.854
  345   1HB   PHE  45          2HB       PHE  45  -3.512  -4.353   2.062
  346   2HB   PHE  45          1HB       PHE  45  -3.097  -6.033   1.732
  347    HD1  PHE  45           HD1      PHE  45  -4.161  -7.669   3.004
  348    HD2  PHE  45           HD2      PHE  45  -3.568  -3.761   4.693
  349    HE1  PHE  45           HE1      PHE  45  -5.370  -8.368   5.052
  350    HE2  PHE  45           HE2      PHE  45  -4.776  -4.463   6.740
  351    HZ   PHE  45           HZ       PHE  45  -5.677  -6.766   6.920
  352    H    ALA  46           H        ALA  46  -0.790  -5.801   0.519
  353    HA   ALA  46           HA       ALA  46  -0.054  -8.483   1.183
  354   1HB   ALA  46          1HB       ALA  46   1.022  -8.547  -0.996
  355   2HB   ALA  46          2HB       ALA  46   1.070  -6.785  -1.067
  356   3HB   ALA  46          3HB       ALA  46  -0.478  -7.628  -1.142
  357    H    ALA  47           H        ALA  47   1.921  -5.516   0.871
  358    HA   ALA  47           HA       ALA  47   4.435  -6.748   1.505
  359   1HB   ALA  47          1HB       ALA  47   4.425  -4.048   2.441
  360   2HB   ALA  47          2HB       ALA  47   3.470  -4.106   0.960
  361   3HB   ALA  47          3HB       ALA  47   5.137  -4.681   0.956
  362    H    GLU  48           H        GLU  48   1.875  -5.332   3.515
  363    HA   GLU  48           HA       GLU  48   3.257  -5.275   6.005
  364   1HB   GLU  48          2HB       GLU  48   1.021  -4.241   5.600
  365   2HB   GLU  48          1HB       GLU  48   0.314  -5.853   5.526
  366   1HG   GLU  48          2HG       GLU  48   1.947  -5.522   7.914
  367   2HG   GLU  48          1HG       GLU  48   0.675  -4.304   7.830
  368    H    GLU  49           H        GLU  49   1.306  -7.865   4.495
  369    HA   GLU  49           HA       GLU  49   1.739  -9.762   6.640
  370   1HB   GLU  49          2HB       GLU  49   0.666  -9.900   3.839
  371   2HB   GLU  49          1HB       GLU  49   1.082 -11.399   4.669
  372   1HG   GLU  49          2HG       GLU  49  -1.052 -11.234   5.470
  373   2HG   GLU  49          1HG       GLU  49  -0.305 -10.143   6.636
  374    H    PHE  50           H        PHE  50   3.505  -8.892   3.720
  375    HA   PHE  50           HA       PHE  50   5.260 -11.238   3.820
  376   1HB   PHE  50          2HB       PHE  50   5.043  -8.778   2.122
  377   2HB   PHE  50          1HB       PHE  50   6.560  -9.675   2.126
  378    HD1  PHE  50           HD1      PHE  50   5.970 -12.423   2.222
  379    HD2  PHE  50           HD2      PHE  50   3.696  -9.323   0.305
  380    HE1  PHE  50           HE1      PHE  50   4.981 -14.097   0.686
  381    HE2  PHE  50           HE2      PHE  50   2.707 -10.999  -1.230
  382    HZ   PHE  50           HZ       PHE  50   3.352 -13.385  -1.038
  383    H    LYS  51           H        LYS  51   5.104  -8.453   5.686
  384    HA   LYS  51           HA       LYS  51   6.585  -7.495   7.215
  385   1HB   LYS  51          2HB       LYS  51   7.692 -10.166   6.686
  386   2HB   LYS  51          1HB       LYS  51   8.917  -8.995   7.167
  387   1HG   LYS  51          2HG       LYS  51   8.259  -9.357   9.296
  388   2HG   LYS  51          1HG       LYS  51   6.785  -8.479   8.890
  389   1HD   LYS  51          2HD       LYS  51   6.295 -11.005   7.863
  390   2HD   LYS  51          1HD       LYS  51   7.174 -11.350   9.352
  391   1HE   LYS  51          2HE       LYS  51   5.377 -10.817  10.601
  392   2HE   LYS  51          1HE       LYS  51   5.243  -9.247   9.812
  393   1HZ   LYS  51          1HZ       LYS  51   4.176 -10.495   7.914
  394   2HZ   LYS  51          2HZ       LYS  51   3.259 -10.373   9.339
  395   3HZ   LYS  51          3HZ       LYS  51   4.058 -11.824   8.962
  396    H    VAL  52           H        VAL  52   6.545  -6.604   4.478
  397    HA   VAL  52           HA       VAL  52   9.327  -5.529   4.272
  398    HB   VAL  52           HB       VAL  52   9.029  -5.550   1.766
  399   1HG1  VAL  52          1HG1      VAL  52  10.369  -7.269   2.900
  400   2HG1  VAL  52          2HG1      VAL  52   9.503  -7.968   1.531
  401   3HG1  VAL  52          3HG1      VAL  52   8.919  -8.235   3.173
  402   1HG2  VAL  52          1HG2      VAL  52   7.071  -6.174   0.840
  403   2HG2  VAL  52          2HG2      VAL  52   6.385  -6.259   2.462
  404   3HG2  VAL  52          3HG2      VAL  52   7.087  -7.699   1.725
  405    HA   PRO  53           HA       PRO  53   7.334  -1.616   4.034
  406   1HB   PRO  53          2HB       PRO  53   9.228  -0.216   2.614
  407   2HB   PRO  53          1HB       PRO  53   9.400  -0.658   4.321
  408   1HG   PRO  53          2HG       PRO  53  10.733  -1.845   1.930
  409   2HG   PRO  53          1HG       PRO  53  11.294  -1.779   3.609
  410   1HD   PRO  53          2HD       PRO  53  10.157  -4.032   2.334
  411   2HD   PRO  53          1HD       PRO  53  10.400  -3.836   4.083
  412    H    ALA  54           H        ALA  54   5.669  -1.013   2.742
  413    HA   ALA  54           HA       ALA  54   5.310  -1.955   0.056
  414   1HB   ALA  54          1HB       ALA  54   3.710  -0.727   1.987
  415   2HB   ALA  54          2HB       ALA  54   3.205  -1.197   0.363
  416   3HB   ALA  54          3HB       ALA  54   3.769   0.446   0.671
  417    H    ALA  55           H        ALA  55   6.486   1.131   1.364
  418    HA   ALA  55           HA       ALA  55   6.526   2.598  -1.089
  419   1HB   ALA  55          1HB       ALA  55   7.275   3.058   1.585
  420   2HB   ALA  55          2HB       ALA  55   7.285   4.228   0.266
  421   3HB   ALA  55          3HB       ALA  55   8.743   3.307   0.639
  422    H    THR  56           H        THR  56   8.885   0.364   0.358
  423    HA   THR  56           HA       THR  56  10.636   0.740  -2.033
  424    HB   THR  56           HB       THR  56  11.425  -0.814   0.430
  425    HG1  THR  56           HG1      THR  56  11.590   1.990   0.041
  426   1HG2  THR  56          1HG2      THR  56  13.636   0.437  -0.375
  427   2HG2  THR  56          2HG2      THR  56  12.760   0.483  -1.906
  428   3HG2  THR  56          3HG2      THR  56  13.104  -1.064  -1.131
  429    H    SER  57           H        SER  57   8.251  -0.741  -2.384
  430    HA   SER  57           HA       SER  57   9.398  -3.368  -3.110
  431   1HB   SER  57          2HB       SER  57   7.472  -2.979  -0.945
  432   2HB   SER  57          1HB       SER  57   6.896  -4.103  -2.166
  433    HG   SER  57           HG       SER  57   8.108  -5.299  -0.780
  434    H    ALA  58           H        ALA  58   8.014  -4.549  -4.612
  435    HA   ALA  58           HA       ALA  58   5.854  -2.982  -5.916
  436   1HB   ALA  58          1HB       ALA  58   8.476  -3.770  -7.137
  437   2HB   ALA  58          2HB       ALA  58   7.510  -2.318  -7.402
  438   3HB   ALA  58          3HB       ALA  58   7.031  -3.843  -8.146
  439    H    ILE  59           H        ILE  59   4.711  -4.435  -7.584
  440    HA   ILE  59           HA       ILE  59   4.882  -7.302  -6.740
  441    HB   ILE  59           HB       ILE  59   2.480  -5.503  -7.020
  442   1HG1  ILE  59          2HG1      ILE  59   3.131  -7.697  -5.030
  443   2HG1  ILE  59          1HG1      ILE  59   3.629  -6.019  -4.811
  444   1HG2  ILE  59          1HG2      ILE  59   1.687  -7.213  -8.396
  445   2HG2  ILE  59          2HG2      ILE  59   1.213  -7.809  -6.805
  446   3HG2  ILE  59          3HG2      ILE  59   2.656  -8.449  -7.592
  447   1HD1  ILE  59          1HD1      ILE  59   0.840  -7.161  -4.858
  448   2HD1  ILE  59          2HD1      ILE  59   1.121  -5.453  -5.194
  449   3HD1  ILE  59          3HD1      ILE  59   1.591  -6.134  -3.637
  450    H    ILE  60           H        ILE  60   5.466  -8.519  -8.457
  451    HA   ILE  60           HA       ILE  60   4.892  -7.508 -11.195
  452    HB   ILE  60           HB       ILE  60   6.506  -9.227 -11.948
  453   1HG1  ILE  60          2HG1      ILE  60   7.533  -9.844  -9.273
  454   2HG1  ILE  60          1HG1      ILE  60   5.901 -10.461  -9.525
  455   1HG2  ILE  60          1HG2      ILE  60   8.421  -8.268 -10.245
  456   2HG2  ILE  60          2HG2      ILE  60   7.140  -7.074 -10.031
  457   3HG2  ILE  60          3HG2      ILE  60   7.797  -7.384 -11.637
  458   1HD1  ILE  60          1HD1      ILE  60   8.375 -11.485 -10.565
  459   2HD1  ILE  60          2HD1      ILE  60   7.355 -10.978 -11.911
  460   3HD1  ILE  60          3HD1      ILE  60   6.752 -12.151 -10.741
  461    H    THR  61           H        THR  61   4.310  -9.313 -12.822
  462    HA   THR  61           HA       THR  61   2.077 -10.890 -11.652
  463    HB   THR  61           HB       THR  61   1.331 -11.156 -14.001
  464    HG1  THR  61           HG1      THR  61   2.565 -10.564 -15.612
  465   1HG2  THR  61          1HG2      THR  61   0.257  -9.268 -13.387
  466   2HG2  THR  61          2HG2      THR  61   1.457  -8.422 -14.363
  467   3HG2  THR  61          3HG2      THR  61   1.695  -8.594 -12.624
  468    H    ASN  62           H        ASN  62   1.731 -13.103 -12.759
  469    HA   ASN  62           HA       ASN  62   4.041 -14.756 -12.271
  470   1HB   ASN  62          2HB       ASN  62   1.228 -15.145 -13.030
  471   2HB   ASN  62          1HB       ASN  62   2.315 -16.337 -13.743
  472   1HD2  ASN  62          1HD2      ASN  62   1.663 -14.781 -10.542
  473   2HD2  ASN  62          2HD2      ASN  62   2.018 -16.171  -9.636
  474    H    ASP  63           H        ASP  63   2.806 -13.153 -15.126
  475    HA   ASP  63           HA       ASP  63   4.330 -14.791 -17.017
  476   1HB   ASP  63          2HB       ASP  63   2.908 -12.127 -17.346
  477   2HB   ASP  63          1HB       ASP  63   3.631 -13.046 -18.666
  478    H    GLY  64           H        GLY  64   4.559 -11.381 -15.901
  479   1HA   GLY  64          2HA       GLY  64   7.132 -11.070 -15.196
  480   2HA   GLY  64          1HA       GLY  64   7.325 -11.228 -16.943
  481    H    VAL  65           H        VAL  65   5.042  -9.483 -14.790
  482    HA   VAL  65           HA       VAL  65   5.701  -6.977 -16.284
  483    HB   VAL  65           HB       VAL  65   2.932  -7.833 -15.375
  484   1HG1  VAL  65          1HG1      VAL  65   2.543  -5.608 -15.463
  485   2HG1  VAL  65          2HG1      VAL  65   2.727  -5.754 -17.211
  486   3HG1  VAL  65          3HG1      VAL  65   4.107  -5.288 -16.215
  487   1HG2  VAL  65          1HG2      VAL  65   4.365  -7.937 -18.018
  488   2HG2  VAL  65          2HG2      VAL  65   2.621  -7.676 -17.985
  489   3HG2  VAL  65          3HG2      VAL  65   3.308  -9.140 -17.280
  490    H    GLY  66           H        GLY  66   6.518  -5.535 -14.857
  491   1HA   GLY  66          2HA       GLY  66   6.276  -5.890 -11.986
  492   2HA   GLY  66          1HA       GLY  66   7.097  -4.559 -12.797
  493    H    VAL  67           H        VAL  67   4.002  -5.723 -11.633
  494    HA   VAL  67           HA       VAL  67   2.464  -3.391 -12.410
  495    HB   VAL  67           HB       VAL  67   1.858  -5.318 -10.147
  496   1HG1  VAL  67          1HG1      VAL  67  -0.207  -4.376 -10.085
  497   2HG1  VAL  67          2HG1      VAL  67  -0.292  -4.219 -11.839
  498   3HG1  VAL  67          3HG1      VAL  67   0.569  -3.011 -10.886
  499   1HG2  VAL  67          1HG2      VAL  67   0.382  -5.998 -12.453
  500   2HG2  VAL  67          2HG2      VAL  67   1.676  -6.934 -11.709
  501   3HG2  VAL  67          3HG2      VAL  67   2.046  -5.790 -12.999
  502    H    ASN  68           H        ASN  68   2.272  -1.461 -11.364
  503    HA   ASN  68           HA       ASN  68   3.692  -1.155  -8.749
  504   1HB   ASN  68          2HB       ASN  68   3.168   0.777 -11.017
  505   2HB   ASN  68          1HB       ASN  68   3.692   1.321  -9.423
  506   1HD2  ASN  68          1HD2      ASN  68   4.780  -0.047 -12.420
  507   2HD2  ASN  68          2HD2      ASN  68   6.393  -0.305 -11.960
  508    HA   PRO  69           HA       PRO  69  -0.082   0.041  -6.822
  509   1HB   PRO  69          2HB       PRO  69   0.876   1.822  -4.955
  510   2HB   PRO  69          1HB       PRO  69   1.083   0.067  -4.831
  511   1HG   PRO  69          2HG       PRO  69   3.090   2.146  -5.558
  512   2HG   PRO  69          1HG       PRO  69   3.340   0.546  -4.836
  513   1HD   PRO  69          2HD       PRO  69   3.746   1.230  -7.558
  514   2HD   PRO  69          1HD       PRO  69   3.696  -0.413  -6.886
  515    H    ALA  70           H        ALA  70  -0.383   1.227  -9.082
  516    HA   ALA  70           HA       ALA  70  -0.884   4.119  -8.510
  517   1HB   ALA  70          1HB       ALA  70  -0.475   3.894 -11.286
  518   2HB   ALA  70          2HB       ALA  70   0.823   2.957 -10.546
  519   3HB   ALA  70          3HB       ALA  70   0.605   4.653 -10.115
  520    H    GLN  71           H        GLN  71  -1.784   1.281 -10.482
  521    HA   GLN  71           HA       GLN  71  -4.258   2.558 -11.417
  522   1HB   GLN  71          2HB       GLN  71  -3.152  -0.250 -11.699
  523   2HB   GLN  71          1HB       GLN  71  -4.682   0.268 -12.402
  524   1HG   GLN  71          2HG       GLN  71  -3.399   0.823 -14.202
  525   2HG   GLN  71          1HG       GLN  71  -3.020   2.263 -13.255
  526   1HE2  GLN  71          1HE2      GLN  71  -1.819  -1.044 -13.981
  527   2HE2  GLN  71          2HE2      GLN  71  -0.199  -0.703 -13.607
  528    HA   PRO  72           HA       PRO  72  -6.935   1.075  -8.250
  529   1HB   PRO  72          2HB       PRO  72  -9.227   0.616  -9.702
  530   2HB   PRO  72          1HB       PRO  72  -8.637   2.233  -9.281
  531   1HG   PRO  72          2HG       PRO  72  -8.545   0.828 -11.909
  532   2HG   PRO  72          1HG       PRO  72  -8.578   2.565 -11.566
  533   1HD   PRO  72          2HD       PRO  72  -6.291   1.066 -12.285
  534   2HD   PRO  72          1HD       PRO  72  -6.291   2.710 -11.610
  535    H    ALA  73           H        ALA  73  -8.021  -0.855  -7.430
  536    HA   ALA  73           HA       ALA  73  -6.828  -3.331  -8.079
  537   1HB   ALA  73          1HB       ALA  73  -9.418  -2.660  -6.674
  538   2HB   ALA  73          2HB       ALA  73  -7.880  -3.135  -5.953
  539   3HB   ALA  73          3HB       ALA  73  -8.842  -4.318  -6.838
  540    H    GLY  74           H        GLY  74  -9.908  -1.952  -9.244
  541   1HA   GLY  74          2HA       GLY  74 -10.869  -4.227 -10.645
  542   2HA   GLY  74          1HA       GLY  74 -11.252  -2.560 -11.068
  543    H    ASN  75           H        ASN  75  -8.780  -1.555 -11.808
  544    HA   ASN  75           HA       ASN  75  -8.459  -2.629 -14.465
  545   1HB   ASN  75          2HB       ASN  75  -7.725  -0.275 -13.140
  546   2HB   ASN  75          1HB       ASN  75  -6.191  -1.038 -13.557
  547   1HD2  ASN  75          1HD2      ASN  75  -9.332  -0.057 -15.022
  548   2HD2  ASN  75          2HD2      ASN  75  -8.700   0.175 -16.581
  549    H    ILE  76           H        ILE  76  -6.566  -2.956 -11.465
  550    HA   ILE  76           HA       ILE  76  -4.325  -4.342 -12.571
  551    HB   ILE  76           HB       ILE  76  -5.573  -4.548  -9.809
  552   1HG1  ILE  76          2HG1      ILE  76  -4.770  -2.274 -10.572
  553   2HG1  ILE  76          1HG1      ILE  76  -3.935  -2.895  -9.152
  554   1HG2  ILE  76          1HG2      ILE  76  -4.017  -6.085  -9.280
  555   2HG2  ILE  76          2HG2      ILE  76  -2.730  -5.055  -9.907
  556   3HG2  ILE  76          3HG2      ILE  76  -3.571  -6.168 -10.985
  557   1HD1  ILE  76          1HD1      ILE  76  -1.963  -3.268 -10.305
  558   2HD1  ILE  76          2HD1      ILE  76  -2.579  -1.882 -11.202
  559   3HD1  ILE  76          3HD1      ILE  76  -2.785  -3.510 -11.846
  560    H    PHE  77           H        PHE  77  -7.457  -5.522 -11.349
  561    HA   PHE  77           HA       PHE  77  -6.819  -8.327 -11.726
  562   1HB   PHE  77          2HB       PHE  77  -8.644  -7.249 -10.217
  563   2HB   PHE  77          1HB       PHE  77  -9.616  -7.197 -11.686
  564    HD1  PHE  77           HD1      PHE  77 -10.622  -9.169 -12.579
  565    HD2  PHE  77           HD2      PHE  77  -7.748  -9.465  -9.397
  566    HE1  PHE  77           HE1      PHE  77 -11.189 -11.565 -12.284
  567    HE2  PHE  77           HE2      PHE  77  -8.318 -11.860  -9.107
  568    HZ   PHE  77           HZ       PHE  77 -10.038 -12.909 -10.550
  569    H    LEU  78           H        LEU  78  -8.432  -5.840 -13.691
  570    HA   LEU  78           HA       LEU  78  -9.366  -7.612 -15.761
  571   1HB   LEU  78          2HB       LEU  78  -8.825  -4.643 -15.643
  572   2HB   LEU  78          1HB       LEU  78  -9.356  -5.422 -17.134
  573    HG   LEU  78           HG       LEU  78 -10.845  -5.805 -14.533
  574   1HD1  LEU  78          1HD1      LEU  78 -11.193  -3.626 -16.613
  575   2HD1  LEU  78          2HD1      LEU  78 -10.814  -3.409 -14.903
  576   3HD1  LEU  78          3HD1      LEU  78 -12.398  -4.019 -15.386
  577   1HD2  LEU  78          1HD2      LEU  78 -12.634  -5.881 -16.612
  578   2HD2  LEU  78          2HD2      LEU  78 -11.839  -7.303 -15.937
  579   3HD2  LEU  78          3HD2      LEU  78 -11.184  -6.529 -17.381
  580    H    LYS  79           H        LYS  79  -6.347  -5.753 -15.365
  581    HA   LYS  79           HA       LYS  79  -5.349  -6.649 -17.986
  582   1HB   LYS  79          2HB       LYS  79  -4.710  -4.557 -16.100
  583   2HB   LYS  79          1HB       LYS  79  -3.255  -5.469 -16.497
  584   1HG   LYS  79          2HG       LYS  79  -3.144  -4.320 -18.429
  585   2HG   LYS  79          1HG       LYS  79  -4.612  -5.148 -18.941
  586   1HD   LYS  79          2HD       LYS  79  -5.248  -2.992 -17.108
  587   2HD   LYS  79          1HD       LYS  79  -4.310  -2.391 -18.475
  588   1HE   LYS  79          2HE       LYS  79  -5.883  -3.297 -20.057
  589   2HE   LYS  79          1HE       LYS  79  -6.737  -4.175 -18.790
  590   1HZ   LYS  79          1HZ       LYS  79  -7.689  -1.952 -19.602
  591   2HZ   LYS  79          2HZ       LYS  79  -6.467  -1.239 -18.662
  592   3HZ   LYS  79          3HZ       LYS  79  -7.631  -2.238 -17.932
  593    H    HIS  80           H        HIS  80  -4.221  -7.005 -14.593
  594    HA   HIS  80           HA       HIS  80  -2.447  -9.213 -15.436
  595   1HB   HIS  80          2HB       HIS  80  -2.851  -8.212 -12.612
  596   2HB   HIS  80          1HB       HIS  80  -1.449  -9.042 -13.284
  597    HD1  HIS  80           HD1      HIS  80  -0.320  -7.600 -15.420
  598    HD2  HIS  80           HD2      HIS  80  -2.503  -5.478 -12.571
  599    HE1  HIS  80           HE1      HIS  80   0.345  -5.170 -15.672
  600    H    GLY  81           H        GLY  81  -4.994  -8.785 -12.932
  601   1HA   GLY  81          2HA       GLY  81  -6.841 -10.451 -12.850
  602   2HA   GLY  81          1HA       GLY  81  -5.662 -11.680 -13.306
  603    H    SER  82           H        SER  82  -5.388 -12.997 -11.565
  604    HA   SER  82           HA       SER  82  -5.133 -11.730  -8.864
  605   1HB   SER  82          2HB       SER  82  -6.950 -13.598  -9.559
  606   2HB   SER  82          1HB       SER  82  -5.620 -14.658  -9.106
  607    HG   SER  82           HG       SER  82  -6.894 -14.159  -7.300
  608    H    GLU  83           H        GLU  83  -3.768 -14.249 -11.004
  609    HA   GLU  83           HA       GLU  83  -1.705 -15.141  -9.254
  610   1HB   GLU  83          2HB       GLU  83  -2.153 -15.198 -12.210
  611   2HB   GLU  83          1HB       GLU  83  -0.531 -15.558 -11.616
  612   1HG   GLU  83          2HG       GLU  83  -2.898 -16.887 -10.329
  613   2HG   GLU  83          1HG       GLU  83  -2.285 -17.506 -11.862
  614    H    LEU  84           H        LEU  84  -0.446 -13.632  -8.245
  615    HA   LEU  84           HA       LEU  84   1.255 -11.887  -9.963
  616   1HB   LEU  84          2HB       LEU  84  -0.442 -11.026  -7.613
  617   2HB   LEU  84          1HB       LEU  84   0.956 -10.092  -8.144
  618    HG   LEU  84           HG       LEU  84  -0.838 -10.871 -10.341
  619   1HD1  LEU  84          1HD1      LEU  84  -2.251 -10.283  -8.129
  620   2HD1  LEU  84          2HD1      LEU  84  -2.764  -9.777  -9.739
  621   3HD1  LEU  84          3HD1      LEU  84  -1.919  -8.642  -8.687
  622   1HD2  LEU  84          1HD2      LEU  84   1.149  -9.038  -9.935
  623   2HD2  LEU  84          2HD2      LEU  84  -0.284  -8.033  -9.711
  624   3HD2  LEU  84          3HD2      LEU  84  -0.053  -8.918 -11.220
  625    H    ARG  85           H        ARG  85   3.039 -10.871  -8.479
  626    HA   ARG  85           HA       ARG  85   3.853 -12.715  -6.286
  627   1HB   ARG  85          2HB       ARG  85   5.288 -12.233  -8.874
  628   2HB   ARG  85          1HB       ARG  85   6.243 -12.470  -7.411
  629   1HG   ARG  85          2HG       ARG  85   5.830 -14.686  -7.409
  630   2HG   ARG  85          1HG       ARG  85   4.096 -14.423  -7.580
  631   1HD   ARG  85          2HD       ARG  85   4.227 -15.120  -9.712
  632   2HD   ARG  85          1HD       ARG  85   5.274 -13.750 -10.074
  633    HE   ARG  85           HE       ARG  85   7.197 -15.262  -9.375
  634   1HH1  ARG  85          2HH1      ARG  85   5.574 -17.557  -8.377
  635   2HH1  ARG  85          1HH1      ARG  85   5.571 -18.631  -9.735
  636   1HH2  ARG  85          1HH2      ARG  85   6.589 -16.196 -12.002
  637   2HH2  ARG  85          2HH2      ARG  85   6.148 -17.858 -11.794
  638    H    LEU  86           H        LEU  86   5.413 -11.746  -4.820
  639    HA   LEU  86           HA       LEU  86   5.429  -8.763  -4.966
  640   1HB   LEU  86          2HB       LEU  86   4.485 -10.097  -2.928
  641   2HB   LEU  86          1HB       LEU  86   6.180 -10.346  -2.516
  642    HG   LEU  86           HG       LEU  86   5.930  -7.607  -3.190
  643   1HD1  LEU  86          1HD1      LEU  86   3.808  -7.057  -2.667
  644   2HD1  LEU  86          2HD1      LEU  86   4.189  -7.473  -0.997
  645   3HD1  LEU  86          3HD1      LEU  86   3.472  -8.681  -2.063
  646   1HD2  LEU  86          1HD2      LEU  86   7.477  -7.984  -1.539
  647   2HD2  LEU  86          2HD2      LEU  86   6.532  -9.281  -0.806
  648   3HD2  LEU  86          3HD2      LEU  86   6.113  -7.597  -0.489
  649    H    ILE  87           H        ILE  87   7.315  -7.767  -5.415
  650    HA   ILE  87           HA       ILE  87   9.867  -9.245  -4.915
  651    HB   ILE  87           HB       ILE  87   9.421  -9.136  -7.326
  652   1HG1  ILE  87          2HG1      ILE  87  11.507  -7.027  -6.770
  653   2HG1  ILE  87          1HG1      ILE  87  11.764  -8.704  -6.291
  654   1HG2  ILE  87          1HG2      ILE  87   8.487  -7.342  -8.322
  655   2HG2  ILE  87          2HG2      ILE  87   9.720  -6.263  -7.670
  656   3HG2  ILE  87          3HG2      ILE  87   8.288  -6.642  -6.716
  657   1HD1  ILE  87          1HD1      ILE  87  12.399  -7.699  -8.754
  658   2HD1  ILE  87          2HD1      ILE  87  10.789  -8.352  -9.057
  659   3HD1  ILE  87          3HD1      ILE  87  12.064  -9.402  -8.437
  660    HA   PRO  88           HA       PRO  88  10.698  -5.674  -2.415
  661   1HB   PRO  88          2HB       PRO  88  13.280  -6.379  -1.767
  662   2HB   PRO  88          1HB       PRO  88  11.844  -7.077  -0.999
  663   1HG   PRO  88          2HG       PRO  88  13.660  -8.286  -3.038
  664   2HG   PRO  88          1HG       PRO  88  12.681  -9.082  -1.793
  665   1HD   PRO  88          2HD       PRO  88  12.023  -8.918  -4.527
  666   2HD   PRO  88          1HD       PRO  88  10.900  -9.342  -3.219
  667    H    ARG  89           H        ARG  89  11.206  -3.690  -3.215
  668    HA   ARG  89           HA       ARG  89  12.928  -3.404  -5.570
  669   1HB   ARG  89          2HB       ARG  89  11.320  -1.455  -3.908
  670   2HB   ARG  89          1HB       ARG  89  12.366  -0.928  -5.226
  671   1HG   ARG  89          2HG       ARG  89  10.368  -3.120  -5.711
  672   2HG   ARG  89          1HG       ARG  89   9.833  -1.441  -5.711
  673   1HD   ARG  89          2HD       ARG  89  10.623  -1.183  -7.801
  674   2HD   ARG  89          1HD       ARG  89  12.245  -1.589  -7.238
  675    HE   ARG  89           HE       ARG  89  10.272  -3.599  -8.245
  676   1HH1  ARG  89          2HH1      ARG  89  12.609  -2.731  -9.939
  677   2HH1  ARG  89          1HH1      ARG  89  13.765  -3.980  -9.620
  678   1HH2  ARG  89          1HH2      ARG  89  12.129  -5.130  -6.774
  679   2HH2  ARG  89          2HH2      ARG  89  13.493  -5.345  -7.822
  680    H    ASP  90           H        ASP  90  14.787  -1.981  -5.631
  681    HA   ASP  90           HA       ASP  90  16.597  -2.360  -3.412
  682   1HB   ASP  90          2HB       ASP  90  18.152  -0.950  -4.753
  683   2HB   ASP  90          1HB       ASP  90  17.436  -2.244  -5.710
  684    H    ARG  91           H        ARG  91  17.464  -0.780  -1.983
  685    HA   ARG  91           HA       ARG  91  15.625   1.472  -1.416
  686   1HB   ARG  91          2HB       ARG  91  17.149  -0.270   0.193
  687   2HB   ARG  91          1HB       ARG  91  17.926   1.305   0.348
  688   1HG   ARG  91          2HG       ARG  91  14.990   1.436   0.440
  689   2HG   ARG  91          1HG       ARG  91  15.694   0.499   1.757
  690   1HD   ARG  91          2HD       ARG  91  15.899   2.566   2.725
  691   2HD   ARG  91          1HD       ARG  91  17.380   2.611   1.768
  692    HE   ARG  91           HE       ARG  91  15.287   3.594   0.127
  693   1HH1  ARG  91          2HH1      ARG  91  14.549   4.801   2.831
  694   2HH1  ARG  91          1HH1      ARG  91  15.385   6.315   2.759
  695   1HH2  ARG  91          1HH2      ARG  91  17.416   5.365   0.103
  696   2HH2  ARG  91          2HH2      ARG  91  17.013   6.636   1.207
  697    H    VAL  92           H        VAL  92  16.049   3.310  -2.528
  698    HA   VAL  92           HA       VAL  92  18.882   4.239  -2.682
  699    HB   VAL  92           HB       VAL  92  18.195   5.288  -4.944
  700   1HG1  VAL  92          1HG1      VAL  92  19.817   3.535  -4.904
  701   2HG1  VAL  92          2HG1      VAL  92  18.633   3.080  -6.130
  702   3HG1  VAL  92          3HG1      VAL  92  18.595   2.318  -4.539
  703   1HG2  VAL  92          1HG2      VAL  92  15.967   3.293  -4.496
  704   2HG2  VAL  92          2HG2      VAL  92  16.485   3.738  -6.121
  705   3HG2  VAL  92          3HG2      VAL  92  15.849   4.969  -5.032
  706    H    GLY  93           H        GLY  93  15.462   5.284  -3.087
  707   1HA   GLY  93          2HA       GLY  93  15.962   7.552  -1.284
  708   2HA   GLY  93          1HA       GLY  93  15.593   8.002  -2.949
  709    H    HIS  94           HN       HIS  94  14.301   5.642  -0.563
  710    HA   HIS  94           HA       HIS  94  11.553   6.428  -1.436
  711   1HB   HIS  94          2HB       HIS  94  12.585   3.923  -0.073
  712   2HB   HIS  94          1HB       HIS  94  10.873   4.263  -0.319
  713    HD1  HIS  94           HD1      HIS  94  13.950   3.163  -2.093
  714    HD2  HIS  94           HD2      HIS  94  10.057   4.266  -3.098
  715    HE1  HIS  94           HE1      HIS  94  13.600   2.449  -4.498