*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   19-JUN-03   1PQX              
*TITLE     SOLUTION STRUCTURE OF THE HYPOTHETICAL STAPHYLOCOCCUS                 
*TITLE    2 AUREUS PROTEIN SAV1430. NORTHEST STRUCUTRAL GENOMICS                 
*TITLE    3 CONSORTIUM TARGET ZR18                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: HYPOTHETICAL PROTEIN MW1320;                                
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 OTHER_DETAILS: ZR18                                                  
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS;                          
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 VARIANT: SUBSP. AUREUS MU50;                                         
*SOURCE   5 GENE: SAV1430;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21MGK;                                   
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PET21;                                
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: ZR18-21                                   
*KEYWDS    ZR18,NMR STRUCTURE, AUTOSTRUCTURE,SPINS,AUTOASSIGN,                   
*KEYWDS   2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, STRUCTURAL                 
*KEYWDS   3 GENOMICS, PROTEIN STRUCTURE INITIATIVE                               
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    M.C.BARAN, J.M.ARAMINI, R.XIAO, Y.J.HUANG, T.B.ACTON,                 
*AUTHOR   2 L.SHIH, G.T.MONTELIONE                                               
*REVDAT   2   28-SEP-04 1PQX    1       AUTHOR SENT UPDATED CONSTRAINTS         
*REVDAT   1   07-SEP-04 1PQX    0                                                
----------------------------------

!  -- Angle constraint file built by HYPER -- X-Plor | Cns format 
!  -- from data in file  ZR18.hyp
!  -- Version: 3.2 2002/04/18[Linux] (Compiled on: troberto.quifis.uv.es) 
assign (segid    A and resid   2 and name C   ) (segid    A and resid   3 and name N   )
       (segid    A and resid   3 and name CA  ) (segid    A and resid   3 and name C   )  1    -40.00    130.00   2 
assign (segid    A and resid   3 and name C   ) (segid    A and resid   4 and name N   )
       (segid    A and resid   4 and name CA  ) (segid    A and resid   4 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid   4 and name C   ) (segid    A and resid   5 and name N   )
       (segid    A and resid   5 and name CA  ) (segid    A and resid   5 and name C   )  1    -35.00    145.00   2 
assign (segid    A and resid   5 and name C   ) (segid    A and resid   6 and name N   )
       (segid    A and resid   6 and name CA  ) (segid    A and resid   6 and name C   )  1    -42.50    117.50   2 
assign (segid    A and resid   6 and name C   ) (segid    A and resid   7 and name N   )
       (segid    A and resid   7 and name CA  ) (segid    A and resid   7 and name C   )  1    -47.50    112.50   2 
assign (segid    A and resid   8 and name C   ) (segid    A and resid   9 and name N   )
       (segid    A and resid   9 and name CA  ) (segid    A and resid   9 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  10 and name C   ) (segid    A and resid  11 and name N   )
       (segid    A and resid  11 and name CA  ) (segid    A and resid  11 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  12 and name C   ) (segid    A and resid  13 and name N   )
       (segid    A and resid  13 and name CA  ) (segid    A and resid  13 and name C   )  1    -40.00    125.00   2 
assign (segid    A and resid  13 and name C   ) (segid    A and resid  14 and name N   )
       (segid    A and resid  14 and name CA  ) (segid    A and resid  14 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  14 and name N   ) (segid    A and resid  14 and name CA  )
       (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  14 and name C   ) (segid    A and resid  15 and name N   )
       (segid    A and resid  15 and name CA  ) (segid    A and resid  15 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  15 and name N   ) (segid    A and resid  15 and name CA  )
       (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  15 and name C   ) (segid    A and resid  16 and name N   )
       (segid    A and resid  16 and name CA  ) (segid    A and resid  16 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  16 and name N   ) (segid    A and resid  16 and name CA  )
       (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  16 and name C   ) (segid    A and resid  17 and name N   )
       (segid    A and resid  17 and name CA  ) (segid    A and resid  17 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  17 and name N   ) (segid    A and resid  17 and name CA  )
       (segid    A and resid  17 and name C   ) (segid    A and resid  18 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  17 and name C   ) (segid    A and resid  18 and name N   )
       (segid    A and resid  18 and name CA  ) (segid    A and resid  18 and name C   )  1    -42.50    122.50   2 
assign (segid    A and resid  18 and name C   ) (segid    A and resid  19 and name N   )
       (segid    A and resid  19 and name CA  ) (segid    A and resid  19 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  19 and name C   ) (segid    A and resid  20 and name N   )
       (segid    A and resid  20 and name CA  ) (segid    A and resid  20 and name C   )  1     60.00    135.00   2 
assign (segid    A and resid  20 and name C   ) (segid    A and resid  21 and name N   )
       (segid    A and resid  21 and name CA  ) (segid    A and resid  21 and name C   )  1    -42.50    122.50   2 
assign (segid    A and resid  21 and name C   ) (segid    A and resid  22 and name N   )
       (segid    A and resid  22 and name CA  ) (segid    A and resid  22 and name C   )  1    -42.50    122.50   2 
assign (segid    A and resid  22 and name C   ) (segid    A and resid  23 and name N   )
       (segid    A and resid  23 and name CA  ) (segid    A and resid  23 and name C   )  1    -37.50    142.50   2 
assign (segid    A and resid  23 and name C   ) (segid    A and resid  24 and name N   )
       (segid    A and resid  24 and name CA  ) (segid    A and resid  24 and name C   )  1    -37.50    142.50   2 
assign (segid    A and resid  25 and name C   ) (segid    A and resid  26 and name N   )
       (segid    A and resid  26 and name CA  ) (segid    A and resid  26 and name C   )  1    -42.50    117.50   2 
assign (segid    A and resid  26 and name C   ) (segid    A and resid  27 and name N   )
       (segid    A and resid  27 and name CA  ) (segid    A and resid  27 and name C   )  1    -40.00    140.00   2 
assign (segid    A and resid  27 and name C   ) (segid    A and resid  28 and name N   )
       (segid    A and resid  28 and name CA  ) (segid    A and resid  28 and name C   )  1    -37.50    132.50   2 
assign (segid    A and resid  28 and name C   ) (segid    A and resid  29 and name N   )
       (segid    A and resid  29 and name CA  ) (segid    A and resid  29 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  29 and name N   ) (segid    A and resid  29 and name CA  )
       (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  29 and name C   ) (segid    A and resid  30 and name N   )
       (segid    A and resid  30 and name CA  ) (segid    A and resid  30 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  30 and name N   ) (segid    A and resid  30 and name CA  )
       (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  30 and name C   ) (segid    A and resid  31 and name N   )
       (segid    A and resid  31 and name CA  ) (segid    A and resid  31 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  31 and name N   ) (segid    A and resid  31 and name CA  )
       (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  31 and name C   ) (segid    A and resid  32 and name N   )
       (segid    A and resid  32 and name CA  ) (segid    A and resid  32 and name C   )  1   -120.00     25.00   2 
assign (segid    A and resid  32 and name C   ) (segid    A and resid  33 and name N   )
       (segid    A and resid  33 and name CA  ) (segid    A and resid  33 and name C   )  1    -40.00    130.00   2 
assign (segid    A and resid  33 and name C   ) (segid    A and resid  34 and name N   )
       (segid    A and resid  34 and name CA  ) (segid    A and resid  34 and name C   )  1     60.00    140.00   2 
assign (segid    A and resid  34 and name C   ) (segid    A and resid  35 and name N   )
       (segid    A and resid  35 and name CA  ) (segid    A and resid  35 and name C   )  1    -37.50    132.50   2 
assign (segid    A and resid  39 and name C   ) (segid    A and resid  40 and name N   )
       (segid    A and resid  40 and name CA  ) (segid    A and resid  40 and name C   )  1     60.00    120.00   2 
assign (segid    A and resid  40 and name C   ) (segid    A and resid  41 and name N   )
       (segid    A and resid  41 and name CA  ) (segid    A and resid  41 and name C   )  1     60.00    125.00   2 
assign (segid    A and resid  42 and name C   ) (segid    A and resid  43 and name N   )
       (segid    A and resid  43 and name CA  ) (segid    A and resid  43 and name C   )  1    -62.50     12.50   2 
assign (segid    A and resid  43 and name N   ) (segid    A and resid  43 and name CA  )
       (segid    A and resid  43 and name C   ) (segid    A and resid  44 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  43 and name C   ) (segid    A and resid  44 and name N   )
       (segid    A and resid  44 and name CA  ) (segid    A and resid  44 and name C   )  1    -47.50     17.50   2 
assign (segid    A and resid  44 and name N   ) (segid    A and resid  44 and name CA  )
       (segid    A and resid  44 and name C   ) (segid    A and resid  45 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  44 and name C   ) (segid    A and resid  45 and name N   )
       (segid    A and resid  45 and name CA  ) (segid    A and resid  45 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  45 and name N   ) (segid    A and resid  45 and name CA  )
       (segid    A and resid  45 and name C   ) (segid    A and resid  46 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  45 and name C   ) (segid    A and resid  46 and name N   )
       (segid    A and resid  46 and name CA  ) (segid    A and resid  46 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  46 and name N   ) (segid    A and resid  46 and name CA  )
       (segid    A and resid  46 and name C   ) (segid    A and resid  47 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  46 and name C   ) (segid    A and resid  47 and name N   )
       (segid    A and resid  47 and name CA  ) (segid    A and resid  47 and name C   )  1    -85.00     15.00   2 
assign (segid    A and resid  47 and name N   ) (segid    A and resid  47 and name CA  )
       (segid    A and resid  47 and name C   ) (segid    A and resid  48 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  47 and name C   ) (segid    A and resid  48 and name N   )
       (segid    A and resid  48 and name CA  ) (segid    A and resid  48 and name C   )  1    -35.00    145.00   2 
assign (segid    A and resid  48 and name C   ) (segid    A and resid  49 and name N   )
       (segid    A and resid  49 and name CA  ) (segid    A and resid  49 and name C   )  1     60.00    135.00   2 
assign (segid    A and resid  50 and name C   ) (segid    A and resid  51 and name N   )
       (segid    A and resid  51 and name CA  ) (segid    A and resid  51 and name C   )  1    -40.00    140.00   2 
assign (segid    A and resid  51 and name C   ) (segid    A and resid  52 and name N   )
       (segid    A and resid  52 and name CA  ) (segid    A and resid  52 and name C   )  1    -42.50    117.50   2 
assign (segid    A and resid  52 and name C   ) (segid    A and resid  53 and name N   )
       (segid    A and resid  53 and name CA  ) (segid    A and resid  53 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  53 and name N   ) (segid    A and resid  53 and name CA  )
       (segid    A and resid  53 and name C   ) (segid    A and resid  54 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  53 and name C   ) (segid    A and resid  54 and name N   )
       (segid    A and resid  54 and name CA  ) (segid    A and resid  54 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  54 and name N   ) (segid    A and resid  54 and name CA  )
       (segid    A and resid  54 and name C   ) (segid    A and resid  55 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  54 and name C   ) (segid    A and resid  55 and name N   )
       (segid    A and resid  55 and name CA  ) (segid    A and resid  55 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  55 and name N   ) (segid    A and resid  55 and name CA  )
       (segid    A and resid  55 and name C   ) (segid    A and resid  56 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  55 and name C   ) (segid    A and resid  56 and name N   )
       (segid    A and resid  56 and name CA  ) (segid    A and resid  56 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  56 and name N   ) (segid    A and resid  56 and name CA  )
       (segid    A and resid  56 and name C   ) (segid    A and resid  57 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  56 and name C   ) (segid    A and resid  57 and name N   )
       (segid    A and resid  57 and name CA  ) (segid    A and resid  57 and name C   )  1    -40.00    135.00   2 
assign (segid    A and resid  57 and name C   ) (segid    A and resid  58 and name N   )
       (segid    A and resid  58 and name CA  ) (segid    A and resid  58 and name C   )  1    -40.00    140.00   2 
assign (segid    A and resid  58 and name C   ) (segid    A and resid  59 and name N   )
       (segid    A and resid  59 and name CA  ) (segid    A and resid  59 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  60 and name C   ) (segid    A and resid  61 and name N   )
       (segid    A and resid  61 and name CA  ) (segid    A and resid  61 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  61 and name N   ) (segid    A and resid  61 and name CA  )
       (segid    A and resid  61 and name C   ) (segid    A and resid  62 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  61 and name C   ) (segid    A and resid  62 and name N   )
       (segid    A and resid  62 and name CA  ) (segid    A and resid  62 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  62 and name N   ) (segid    A and resid  62 and name CA  )
       (segid    A and resid  62 and name C   ) (segid    A and resid  63 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  62 and name C   ) (segid    A and resid  63 and name N   )
       (segid    A and resid  63 and name CA  ) (segid    A and resid  63 and name C   )  1   -120.00     40.00   2 
assign (segid    A and resid  63 and name N   ) (segid    A and resid  63 and name CA  )
       (segid    A and resid  63 and name C   ) (segid    A and resid  64 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  63 and name C   ) (segid    A and resid  64 and name N   )
       (segid    A and resid  64 and name CA  ) (segid    A and resid  64 and name C   )  1   -125.00     55.00   2 
assign (segid    A and resid  64 and name N   ) (segid    A and resid  64 and name CA  )
       (segid    A and resid  64 and name C   ) (segid    A and resid  65 and name N   )  1    120.00     60.00   2 
assign (segid    A and resid  68 and name C   ) (segid    A and resid  69 and name N   )
       (segid    A and resid  69 and name CA  ) (segid    A and resid  69 and name C   )  1    -42.50    122.50   2 
assign (segid    A and resid  69 and name C   ) (segid    A and resid  70 and name N   )
       (segid    A and resid  70 and name CA  ) (segid    A and resid  70 and name C   )  1   -120.00     35.00   2 
assign (segid    A and resid  70 and name C   ) (segid    A and resid  71 and name N   )
       (segid    A and resid  71 and name CA  ) (segid    A and resid  71 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  71 and name N   ) (segid    A and resid  71 and name CA  )
       (segid    A and resid  71 and name C   ) (segid    A and resid  72 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  71 and name C   ) (segid    A and resid  72 and name N   )
       (segid    A and resid  72 and name CA  ) (segid    A and resid  72 and name C   )  1    -55.00     15.00   2 
assign (segid    A and resid  72 and name N   ) (segid    A and resid  72 and name CA  )
       (segid    A and resid  72 and name C   ) (segid    A and resid  73 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  72 and name C   ) (segid    A and resid  73 and name N   )
       (segid    A and resid  73 and name CA  ) (segid    A and resid  73 and name C   )  1    -80.00     20.00   2 
assign (segid    A and resid  73 and name N   ) (segid    A and resid  73 and name CA  )
       (segid    A and resid  73 and name C   ) (segid    A and resid  74 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  73 and name C   ) (segid    A and resid  74 and name N   )
       (segid    A and resid  74 and name CA  ) (segid    A and resid  74 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  74 and name N   ) (segid    A and resid  74 and name CA  )
       (segid    A and resid  74 and name C   ) (segid    A and resid  75 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  74 and name C   ) (segid    A and resid  75 and name N   )
       (segid    A and resid  75 and name CA  ) (segid    A and resid  75 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  75 and name N   ) (segid    A and resid  75 and name CA  )
       (segid    A and resid  75 and name C   ) (segid    A and resid  76 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  76 and name C   ) (segid    A and resid  77 and name N   )
       (segid    A and resid  77 and name CA  ) (segid    A and resid  77 and name C   )  1    -80.00     20.00   2 
assign (segid    A and resid  77 and name N   ) (segid    A and resid  77 and name CA  )
       (segid    A and resid  77 and name C   ) (segid    A and resid  78 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  77 and name C   ) (segid    A and resid  78 and name N   )
       (segid    A and resid  78 and name CA  ) (segid    A and resid  78 and name C   )  1    -65.00     35.00   2 
assign (segid    A and resid  78 and name N   ) (segid    A and resid  78 and name CA  )
       (segid    A and resid  78 and name C   ) (segid    A and resid  79 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  78 and name C   ) (segid    A and resid  79 and name N   )
       (segid    A and resid  79 and name CA  ) (segid    A and resid  79 and name C   )  1    -52.50     17.50   2 
assign (segid    A and resid  79 and name N   ) (segid    A and resid  79 and name CA  )
       (segid    A and resid  79 and name C   ) (segid    A and resid  80 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  79 and name C   ) (segid    A and resid  80 and name N   )
       (segid    A and resid  80 and name CA  ) (segid    A and resid  80 and name C   )  1    -52.50     17.50   2 
assign (segid    A and resid  80 and name N   ) (segid    A and resid  80 and name CA  )
       (segid    A and resid  80 and name C   ) (segid    A and resid  81 and name N   )  1    -35.00     40.00   2 
assign (segid    A and resid  80 and name C   ) (segid    A and resid  81 and name N   )
       (segid    A and resid  81 and name CA  ) (segid    A and resid  81 and name C   )  1     60.00    135.00   2 
assign (segid    A and resid  81 and name C   ) (segid    A and resid  82 and name N   )
       (segid    A and resid  82 and name CA  ) (segid    A and resid  82 and name C   )  1    -40.00    130.00   2 
assign (segid    A and resid  82 and name C   ) (segid    A and resid  83 and name N   )
       (segid    A and resid  83 and name CA  ) (segid    A and resid  83 and name C   )  1    -40.00    135.00   2 
assign (segid    A and resid  83 and name C   ) (segid    A and resid  84 and name N   )
       (segid    A and resid  84 and name CA  ) (segid    A and resid  84 and name C   )  1    -40.00    140.00   2 
assign (segid    A and resid  84 and name C   ) (segid    A and resid  85 and name N   )
       (segid    A and resid  85 and name CA  ) (segid    A and resid  85 and name C   )  1    -37.50    142.50   2 
assign (segid    A and resid  86 and name C   ) (segid    A and resid  87 and name N   )
       (segid    A and resid  87 and name CA  ) (segid    A and resid  87 and name C   )  1    -40.00    125.00   2 
!Manual Input
!
! ACO file produced by PDBStat
! Version:  3.32 *DEVEL* 2003-05-23 (vaio1.cabm.rutgers.edu)
!
 dihedral
   assign (resid   1 and name C   )   (resid   2 and name N   )
          (resid   2 and name CA  )   (resid   2 and name C   )   1.0   -123.61    60.40   2 
   assign (resid   2 and name N   )   (resid   2 and name CA  )
          (resid   2 and name C   )   (resid   3 and name N   )   1.0   -169.12   145.66   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
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   assign (resid   5 and name N   )   (resid   5 and name CA  )
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   assign (resid  14 and name N   )   (resid  14 and name CA  )
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   assign (resid  15 and name N   )   (resid  15 and name CA  )
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   assign (resid  15 and name C   )   (resid  16 and name N   )
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   assign (resid  16 and name N   )   (resid  16 and name CA  )
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   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0   -110.88    99.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
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   assign (resid  17 and name C   )   (resid  18 and name N   )
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   assign (resid  18 and name N   )   (resid  18 and name CA  )
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   assign (resid  21 and name C   )   (resid  22 and name N   )
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   assign (resid  22 and name N   )   (resid  22 and name CA  )
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   assign (resid  29 and name N   )   (resid  29 and name CA  )
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   assign (resid  29 and name C   )   (resid  30 and name N   )
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   assign (resid  30 and name N   )   (resid  30 and name CA  )
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   assign (resid  37 and name C   )   (resid  38 and name N   )
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   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0   -157.35   171.62   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
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   assign (resid  41 and name N   )   (resid  41 and name CA  )
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   assign (resid  42 and name C   )   (resid  43 and name N   )
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   assign (resid  43 and name N   )   (resid  43 and name CA  )
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   assign (resid  44 and name N   )   (resid  44 and name CA  )
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   assign (resid  44 and name C   )   (resid  45 and name N   )
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   assign (resid  45 and name N   )   (resid  45 and name CA  )
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   assign (resid  45 and name C   )   (resid  46 and name N   )
          (resid  46 and name CA  )   (resid  46 and name C   )   1.0    -64.39    29.76   2 
   assign (resid  46 and name N   )   (resid  46 and name CA  )
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   assign (resid  47 and name C   )   (resid  48 and name N   )
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   assign (resid  48 and name N   )   (resid  48 and name CA  )
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   assign (resid  50 and name C   )   (resid  51 and name N   )
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   assign (resid  51 and name N   )   (resid  51 and name CA  )
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   assign (resid  53 and name C   )   (resid  54 and name N   )
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   assign (resid  54 and name N   )   (resid  54 and name CA  )
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   assign (resid  54 and name C   )   (resid  55 and name N   )
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   assign (resid  55 and name N   )   (resid  55 and name CA  )
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   assign (resid  55 and name C   )   (resid  56 and name N   )
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   assign (resid  56 and name N   )   (resid  56 and name CA  )
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   assign (resid  56 and name C   )   (resid  57 and name N   )
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   assign (resid  57 and name N   )   (resid  57 and name CA  )
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   assign (resid  59 and name C   )   (resid  60 and name N   )
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   assign (resid  60 and name N   )   (resid  60 and name CA  )
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   assign (resid  60 and name C   )   (resid  61 and name N   )
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   assign (resid  61 and name N   )   (resid  61 and name CA  )
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   assign (resid  62 and name C   )   (resid  63 and name N   )
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   assign (resid  63 and name N   )   (resid  63 and name CA  )
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   assign (resid  65 and name C   )   (resid  66 and name N   )
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   assign (resid  66 and name N   )   (resid  66 and name CA  )
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   assign (resid  66 and name C   )   (resid  67 and name N   )
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   assign (resid  67 and name N   )   (resid  67 and name CA  )
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   assign (resid  67 and name C   )   (resid  68 and name N   )
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   assign (resid  68 and name N   )   (resid  68 and name CA  )
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   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name C   )   (resid  71 and name N   )   1.0   -168.32   145.39   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0    -66.99    32.68   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    -51.97    29.30   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -66.97    44.36   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    -53.08     6.67   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0    -67.55    21.20   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    -54.17    14.69   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0    -67.02    17.48   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    -48.65    15.03   2 
   assign (resid  76 and name N   )   (resid  76 and name CA  )
          (resid  76 and name C   )   (resid  77 and name N   )   1.0    -48.25    16.45   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -68.13    17.92   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    -55.42    13.96   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
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   assign (resid  78 and name N   )   (resid  78 and name CA  )
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   assign (resid  78 and name C   )   (resid  79 and name N   )
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   assign (resid  79 and name N   )   (resid  79 and name CA  )
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   assign (resid  79 and name C   )   (resid  80 and name N   )
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   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    -53.62    19.07   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -71.46    30.12   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    -52.53    22.12   2 
   assign (resid  85 and name C   )   (resid  86 and name N   )
          (resid  86 and name CA  )   (resid  86 and name C   )   1.0    -76.29    43.48   2 
   assign (resid  86 and name N   )   (resid  86 and name CA  )
          (resid  86 and name C   )   (resid  87 and name N   )   1.0   -154.03   157.42   2 
 end
!END Manual Input
! created by  NOESY_Assign Version 2.0b Copyright(C) 1995-2003

assign (resid 5    and name O     )(resid 18   and name N     )    2.80  0.4  0.5
assign (resid 5    and name O     )(resid 18   and name HN    )     1.8  0.3  0.5
assign (resid 13   and name O     )(resid 65   and name N     )    2.80  0.4  0.5
assign (resid 13   and name O     )(resid 65   and name HN    )     1.8  0.3  0.5
assign (resid 15   and name O     )(resid 63   and name N     )    2.80  0.4  0.5
assign (resid 15   and name O     )(resid 63   and name HN    )     1.8  0.3  0.5
assign (resid 17   and name O     )(resid 61   and name N     )    2.80  0.4  0.5
assign (resid 17   and name O     )(resid 61   and name HN    )     1.8  0.3  0.5
assign (resid 18   and name O     )(resid 4    and name N     )    2.80  0.4  0.5
assign (resid 18   and name O     )(resid 4    and name HN    )     1.8  0.3  0.5
assign (resid 29   and name O     )(resid 56   and name N     )    2.80  0.4  0.5
assign (resid 29   and name O     )(resid 56   and name HN    )     1.8  0.3  0.5
assign (resid 31   and name O     )(resid 54   and name N     )    2.80  0.4  0.5
assign (resid 31   and name O     )(resid 54   and name HN    )     1.8  0.3  0.5
assign (resid 39   and name O     )(resid 42   and name N     )    2.80  0.4  0.5
assign (resid 39   and name O     )(resid 42   and name HN    )     1.8  0.3  0.5
assign (resid 40   and name O     )(resid 43   and name N     )    2.80  0.4  0.5
assign (resid 40   and name O     )(resid 43   and name HN    )     1.8  0.3  0.5
assign (resid 42   and name O     )(resid 46   and name N     )    2.80  0.4  0.5
assign (resid 42   and name O     )(resid 46   and name HN    )     1.8  0.3  0.5
assign (resid 43   and name O     )(resid 47   and name N     )    2.80  0.4  0.5
assign (resid 43   and name O     )(resid 47   and name HN    )     1.8  0.3  0.5
assign (resid 45   and name O     )(resid 48   and name N     )    2.80  0.4  0.5
assign (resid 45   and name O     )(resid 48   and name HN    )     1.8  0.3  0.5
assign (resid 48   and name O     )(resid 51   and name N     )    2.80  0.4  0.5
assign (resid 48   and name O     )(resid 51   and name HN    )     1.8  0.3  0.5
assign (resid 50   and name O     )(resid 66   and name N     )    2.80  0.4  0.5
assign (resid 50   and name O     )(resid 66   and name HN    )     1.8  0.3  0.5
assign (resid 53   and name O     )(resid 64   and name N     )    2.80  0.4  0.5
assign (resid 53   and name O     )(resid 64   and name HN    )     1.8  0.3  0.5
assign (resid 54   and name O     )(resid 31   and name N     )    2.80  0.4  0.5
assign (resid 54   and name O     )(resid 31   and name HN    )     1.8  0.3  0.5
assign (resid 55   and name O     )(resid 62   and name N     )    2.80  0.4  0.5
assign (resid 55   and name O     )(resid 62   and name HN    )     1.8  0.3  0.5
assign (resid 56   and name O     )(resid 29   and name N     )    2.80  0.4  0.5
assign (resid 56   and name O     )(resid 29   and name HN    )     1.8  0.3  0.5
assign (resid 57   and name O     )(resid 60   and name N     )    2.80  0.4  0.5
assign (resid 57   and name O     )(resid 60   and name HN    )     1.8  0.3  0.5
assign (resid 60   and name O     )(resid 57   and name N     )    2.80  0.4  0.5
assign (resid 60   and name O     )(resid 57   and name HN    )     1.8  0.3  0.5
assign (resid 61   and name O     )(resid 17   and name N     )    2.80  0.4  0.5
assign (resid 61   and name O     )(resid 17   and name HN    )     1.8  0.3  0.5
assign (resid 62   and name O     )(resid 55   and name N     )    2.80  0.4  0.5
assign (resid 62   and name O     )(resid 55   and name HN    )     1.8  0.3  0.5
assign (resid 63   and name O     )(resid 15   and name N     )    2.80  0.4  0.5
assign (resid 63   and name O     )(resid 15   and name HN    )     1.8  0.3  0.5
assign (resid 64   and name O     )(resid 53   and name N     )    2.80  0.4  0.5
assign (resid 64   and name O     )(resid 53   and name HN    )     1.8  0.3  0.5
assign (resid 71   and name O     )(resid 75   and name N     )    2.80  0.4  0.5
assign (resid 71   and name O     )(resid 75   and name HN    )     1.8  0.3  0.5
assign (resid 75   and name O     )(resid 79   and name N     )    2.80  0.4  0.5
assign (resid 75   and name O     )(resid 79   and name HN    )     1.8  0.3  0.5
assign (resid 78   and name O     )(resid 81   and name N     )    2.80  0.4  0.5
assign (resid 78   and name O     )(resid 81   and name HN    )     1.8  0.3  0.5
! created by  NOESY_Assign Version 2.0b Copyright(C) 1995-2003

!M1
!assign (resid 1    and name HA    )(resid 1    and name HB2   )     4.0  2.2 1.0
!assign (resid 1    and name HA    )(resid 1    and name HB1   )     4.0  2.2 1.0
assign (resid 1    and name HA    )(resid 1    and name HG2   )     4.0  2.2 1.0
assign (resid 1    and name HA    )(resid 1    and name HG1   )     4.0  2.2 1.0
assign (resid 1    and name HA    )(resid 2    and name HN    )     3.0  1.2 0.5
assign (resid 1    and name HA    )(resid 20   and name HB#   )     4.0  2.2 2.0
assign (resid 1    and name HA    )(resid 26   and name HE#   )     4.0  2.2 2.0
!assign (resid 1    and name HB2   )(resid 1    and name HG#   )     4.0  2.2 2.0
!assign (resid 1    and name HB1   )(resid 1    and name HG#   )     4.0  2.2 2.0
assign (resid 1    and name HB#   )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 1    and name HG#   )(resid 2    and name HN    )     4.0  2.2 2.0
assign (resid 1    and name HG#   )(resid 19   and name HD2#  )     4.0  2.2 3.0
assign (resid 1    and name HG#   )(resid 20   and name HN    )     4.0  2.2 2.0
assign (resid 1    and name HG2   )(resid 26   and name HE#   )     4.0  2.2 2.0
assign (resid 1    and name HG1   )(resid 26   and name HE#   )     4.0  2.2 2.0
!K2
assign (resid 2    and name HN    )(resid 2    and name HA    )     4.0  2.2 1.0
assign (resid 2    and name HN    )(resid 20   and name HN    )     4.0  2.2 1.0
assign (resid 2    and name HA    )(resid 3    and name HN    )     2.5  0.7 0.4
!assign (resid 2    and name HB2   )(resid 2    and name HB1   )     3.0  1.2 0.5
!assign (resid 2    and name HB1   )(resid 2    and name HB2   )     3.0  1.2 0.5
!assign (resid 2    and name HB2   )(resid 2    and name HG#   )     4.0  2.2 2.0
!assign (resid 2    and name HB1   )(resid 2    and name HG#   )     4.0  2.2 2.0
assign (resid 2    and name HB#   )(resid 2    and name HD#   )     4.0  2.2 3.0
assign (resid 2    and name HB#   )(resid 2    and name HE#   )     4.0  2.2 3.0
assign (resid 2    and name HB#   )(resid 3    and name HN    )     4.0  2.2 2.0
assign (resid 2    and name HB#   )(resid 83   and name HG#   )     4.0  2.2 3.0
!assign (resid 2    and name HG2   )(resid 2    and name HD2   )     4.0  2.2 1.0
!assign (resid 2    and name HG2   )(resid 2    and name HD1   )     4.0  2.2 1.0
!assign (resid 2    and name HG1   )(resid 2    and name HD2   )     4.0  2.2 1.0
!assign (resid 2    and name HG1   )(resid 2    and name HD1   )     4.0  2.2 1.0
assign (resid 2    and name HG2   )(resid 2    and name HE#   )     4.0  2.2 2.0
assign (resid 2    and name HG1   )(resid 2    and name HE#   )     4.0  2.2 2.0
assign (resid 2    and name HG#   )(resid 82   and name HB#   )     4.0  2.2 3.0
!assign (resid 2    and name HD2   )(resid 2    and name HE#   )     4.0  2.2 2.0
!assign (resid 2    and name HD1   )(resid 2    and name HE#   )     4.0  2.2 2.0
assign (resid 2    and name HD#   )(resid 83   and name HB#   )     4.0  2.2 3.0
assign (resid 2    and name HE#   )(resid 4    and name HD1#  )     4.0  2.2 3.0
!I3
assign (resid 3    and name HN    )(resid 3    and name HA    )     4.0  2.2 1.0
assign (resid 3    and name HN    )(resid 3    and name HB    )     3.0  1.2 0.5
assign (resid 3    and name HN    )(resid 3    and name HG12  )     4.0  2.2 1.0
assign (resid 3    and name HN    )(resid 3    and name HG11  )     4.0  2.2 1.0
assign (resid 3    and name HN    )(resid 3    and name HG2#  )     4.0  2.2 2.0
assign (resid 3    and name HN    )(resid 3    and name HD1#  )     4.0  2.2 2.0
assign (resid 3    and name HN    )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 3    and name HN    )(resid 82   and name HB2   )     4.0  2.2 1.0
assign (resid 3    and name HN    )(resid 82   and name HB1   )     4.0  2.2 1.0
!assign (resid 3    and name HA    )(resid 3    and name HB    )     4.0  2.2 1.0
assign (resid 3    and name HA    )(resid 3    and name HG12  )     4.0  2.2 1.0
assign (resid 3    and name HA    )(resid 3    and name HG11  )     4.0  2.2 1.0
assign (resid 3    and name HA    )(resid 3    and name HG2#  )     4.0  2.2 1.6
assign (resid 3    and name HA    )(resid 3    and name HD1#  )     4.0  2.2 2.0
assign (resid 3    and name HA    )(resid 4    and name HN    )     3.0  1.2 0.5
assign (resid 3    and name HA    )(resid 4    and name HB    )     4.0  2.2 1.0
assign (resid 3    and name HA    )(resid 5    and name HN    )     4.0  2.2 1.0
assign (resid 3    and name HA    )(resid 17   and name HG2#  )     4.0  2.2 2.0
assign (resid 3    and name HA    )(resid 19   and name HD2#  )     4.0  2.2 2.0
!assign (resid 3    and name HB    )(resid 3    and name HG12  )     4.0  2.2 1.0
!assign (resid 3    and name HB    )(resid 3    and name HG11  )     4.0  2.2 1.0
!assign (resid 3    and name HB    )(resid 3    and name HG2#  )     4.0  2.2 2.0
assign (resid 3    and name HB    )(resid 3    and name HD1#  )     4.0  2.2 2.0
!assign (resid 3    and name HG12  )(resid 3    and name HG11  )     4.0  2.2 1.0
!assign (resid 3    and name HG11  )(resid 3    and name HG12  )     4.0  2.2 1.0
assign (resid 3    and name HG1#  )(resid 3    and name HG2#  )     4.0  2.2 3.0
!assign (resid 3    and name HG12  )(resid 3    and name HD1#  )     4.0  2.2 2.0
!assign (resid 3    and name HG11  )(resid 3    and name HD1#  )     4.0  2.2 2.0
assign (resid 3    and name HG1#  )(resid 4    and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HG1#  )(resid 4    and name HD1#  )     4.0  2.2 3.0
assign (resid 3    and name HG1#  )(resid 17   and name HG1#  )     4.0  2.2 3.0
assign (resid 3    and name HG1#  )(resid 17   and name HG2#  )     4.0  2.2 3.0
assign (resid 3    and name HG1#  )(resid 19   and name HD2#  )     4.0  2.2 3.0
assign (resid 3    and name HG1#  )(resid 82   and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HG1#  )(resid 82   and name HB2   )     4.0  2.2 2.0
assign (resid 3    and name HG1#  )(resid 82   and name HB1   )     4.0  2.2 2.0
assign (resid 3    and name HG1#  )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 3    and name HG2#  )(resid 3    and name HD1#  )     4.0  2.2 3.0
assign (resid 3    and name HG2#  )(resid 4    and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HG2#  )(resid 4    and name HA    )     4.0  2.2 2.0
assign (resid 3    and name HG2#  )(resid 4    and name HG1#  )     4.0  2.2 3.0
assign (resid 3    and name HG2#  )(resid 5    and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HG2#  )(resid 6    and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HG2#  )(resid 6    and name HG1#  )     4.0  2.2 3.0
assign (resid 3    and name HG2#  )(resid 18   and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 79   and name HA    )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 79   and name HG2   )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 79   and name HG1   )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 82   and name HN    )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 82   and name HB2   )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 82   and name HB1   )     4.0  2.2 2.0
assign (resid 3    and name HD1#  )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 3    and name HD1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 3    and name HD1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!I4
assign (resid 4    and name HN    )(resid 4    and name HA    )     4.0  2.2 1.0
assign (resid 4    and name HN    )(resid 4    and name HB    )     3.0  1.2 0.5
assign (resid 4    and name HN    )(resid 4    and name HG12  )     4.0  2.2 1.0
assign (resid 4    and name HN    )(resid 4    and name HG11  )     4.0  2.2 1.0
assign (resid 4    and name HN    )(resid 4    and name HG2#  )     4.0  2.2 2.0
assign (resid 4    and name HN    )(resid 4    and name HD1#  )     4.0  2.2 2.0
assign (resid 4    and name HN    )(resid 5    and name HN    )     3.0  1.2 0.5
assign (resid 4    and name HN    )(resid 18   and name HB    )     4.0  2.2 1.0
assign (resid 4    and name HN    )(resid 19   and name HA    )     4.0  2.2 1.0
assign (resid 4    and name HN    )(resid 19   and name HD2#  )     4.0  2.2 2.0
!assign (resid 4    and name HA    )(resid 4    and name HB    )     4.0  2.2 1.0
assign (resid 4    and name HA    )(resid 4    and name HG12  )     4.0  2.2 1.0
assign (resid 4    and name HA    )(resid 4    and name HG11  )     4.0  2.2 1.0
assign (resid 4    and name HA    )(resid 4    and name HG2#  )     4.0  2.2 1.6
assign (resid 4    and name HA    )(resid 4    and name HD1#  )     4.0  2.2 2.0
assign (resid 4    and name HA    )(resid 5    and name HN    )     4.0  2.2 1.0
!assign (resid 4    and name HB    )(resid 4    and name HG12  )     4.0  2.2 1.0
!assign (resid 4    and name HB    )(resid 4    and name HG11  )     4.0  2.2 1.0
!assign (resid 4    and name HB    )(resid 4    and name HG2#  )     4.0  2.2 2.0
assign (resid 4    and name HB    )(resid 4    and name HD1#  )     4.0  2.2 2.0
assign (resid 4    and name HB    )(resid 5    and name HN    )     4.0  2.2 1.0
assign (resid 4    and name HB    )(resid 5    and name HB#   )     4.0  2.2 2.0
assign (resid 4    and name HB    )(resid 18   and name HB    )     4.0  2.2 1.0
assign (resid 4    and name HB    )(resid 18   and name HG2#  )     4.0  2.2 2.0
!assign (resid 4    and name HG12  )(resid 4    and name HG11  )     4.0  2.2 1.0
!assign (resid 4    and name HG11  )(resid 4    and name HG12  )     4.0  2.2 1.0
assign (resid 4    and name HG1#  )(resid 4    and name HG2#  )     4.0  2.2 3.0
!assign (resid 4    and name HG12  )(resid 4    and name HD1#  )     4.0  2.2 2.0
!assign (resid 4    and name HG11  )(resid 4    and name HD1#  )     4.0  2.2 2.0
assign (resid 4    and name HG12  )(resid 5    and name HN    )     4.0  2.2 1.0
assign (resid 4    and name HG11  )(resid 5    and name HN    )     4.0  2.2 1.0
assign (resid 4    and name HG12  )(resid 18   and name HG2#  )     4.0  2.2 2.0
assign (resid 4    and name HG11  )(resid 18   and name HG2#  )     4.0  2.2 2.0
assign (resid 4    and name HG12  )(resid 20   and name HN    )     4.0  2.2 1.0
assign (resid 4    and name HG11  )(resid 20   and name HN    )     4.0  2.2 1.0
assign (resid 4    and name HG12  )(resid 20   and name HA    )     4.0  2.2 1.0
assign (resid 4    and name HG11  )(resid 20   and name HA    )     4.0  2.2 1.0
assign (resid 4    and name HG2#  )(resid 5    and name HN    )     4.0  2.2 2.0
assign (resid 4    and name HG2#  )(resid 5    and name HB#   )     4.0  2.2 3.0
assign (resid 4    and name HG2#  )(resid 18   and name HB    )     4.0  2.2 2.0
assign (resid 4    and name HG2#  )(resid 18   and name HG2#  )     4.0  2.2 3.0
assign (resid 4    and name HD1#  )(resid 18   and name HG2#  )     4.0  2.2 3.0
assign (resid 4    and name HD1#  )(resid 20   and name HN    )     4.0  2.2 2.0
assign (resid 4    and name HD1#  )(resid 20   and name HA    )     4.0  2.2 2.0
assign (resid 4    and name HD1#  )(resid 20   and name HB#   )     4.0  2.2 3.0
!S5
assign (resid 5    and name HN    )(resid 5    and name HA    )     3.0  1.2 0.5
assign (resid 5    and name HN    )(resid 5    and name HB#   )     4.0  2.2 2.0
assign (resid 5    and name HN    )(resid 17   and name HA    )     4.0  2.2 1.0
assign (resid 5    and name HN    )(resid 18   and name HN    )     4.0  2.2 1.0
assign (resid 5    and name HN    )(resid 18   and name HA    )     4.0  2.2 1.0
assign (resid 5    and name HN    )(resid 18   and name HB    )     3.0  1.2 0.5
assign (resid 5    and name HN    )(resid 18   and name HG2#  )     4.0  2.2 2.0
!assign (resid 5    and name HA    )(resid 5    and name HB#   )     4.0  2.2 2.0
assign (resid 5    and name HA    )(resid 6    and name HN    )     4.0  2.2 1.0
assign (resid 5    and name HB#   )(resid 6    and name HN    )     4.0  2.2 2.0
assign (resid 5    and name HB#   )(resid 18   and name HG2#  )     4.0  2.2 3.0
!I6
assign (resid 6    and name HN    )(resid 6    and name HA    )     3.0  1.2 0.5
assign (resid 6    and name HN    )(resid 6    and name HB    )     3.0  1.2 0.5
assign (resid 6    and name HN    )(resid 6    and name HG1#  )     4.0  2.2 2.0
assign (resid 6    and name HN    )(resid 6    and name HG2#  )     4.0  2.2 2.0
assign (resid 6    and name HN    )(resid 6    and name HD1#  )     4.0  2.2 2.0
assign (resid 6    and name HA    )(resid 7    and name HN    )     2.5  0.7 0.4
!assign (resid 6    and name HB    )(resid 6    and name HG12  )     4.0  2.2 1.0
!assign (resid 6    and name HB    )(resid 6    and name HG11  )     4.0  2.2 1.0
!assign (resid 6    and name HB    )(resid 6    and name HG2#  )     4.0  2.2 2.0
assign (resid 6    and name HB    )(resid 6    and name HD1#  )     4.0  2.2 2.0
assign (resid 6    and name HB    )(resid 7    and name HN    )     4.0  2.2 1.0
!assign (resid 6    and name HG12  )(resid 6    and name HG11  )     4.0  2.2 1.0
!assign (resid 6    and name HG11  )(resid 6    and name HG12  )     4.0  2.2 1.0
assign (resid 6    and name HG12  )(resid 6    and name HG2#  )     4.0  2.2 2.0
assign (resid 6    and name HG11  )(resid 6    and name HG2#  )     4.0  2.2 2.0
!assign (resid 6    and name HG12  )(resid 6    and name HD1#  )     4.0  2.2 2.0
!assign (resid 6    and name HG11  )(resid 6    and name HD1#  )     4.0  2.2 2.0
assign (resid 6    and name HG1#  )(resid 15   and name HB#   )     4.0  2.2 3.0
assign (resid 6    and name HG1#  )(resid 17   and name HG1#  )     4.0  2.2 3.0
assign (resid 6    and name HG2#  )(resid 7    and name HN    )     4.0  2.2 2.0
assign (resid 6    and name HG2#  )(resid 7    and name HB#   )     4.0  2.2 3.0
assign (resid 6    and name HG2#  )(resid 8    and name HN    )     4.0  2.2 2.0
assign (resid 6    and name HG2#  )(resid 15   and name HB#   )     4.0  2.2 3.0
assign (resid 6    and name HG2#  )(resid 15   and name HG2   )     4.0  2.2 2.0
assign (resid 6    and name HG2#  )(resid 15   and name HG1   )     4.0  2.2 2.0
assign (resid 6    and name HG2#  )(resid 15   and name HE#   )     4.0  2.2 3.0
assign (resid 6    and name HG2#  )(resid 16   and name HN    )     4.0  2.2 2.0
assign (resid 6    and name HD1#  )(resid 7    and name HN    )     4.0  2.2 2.0
!S7
assign (resid 7    and name HN    )(resid 7    and name HA    )     4.0  2.2 1.0
assign (resid 7    and name HN    )(resid 7    and name HB2   )     4.0  2.2 1.0
assign (resid 7    and name HN    )(resid 7    and name HB1   )     4.0  2.2 1.0
assign (resid 7    and name HN    )(resid 15   and name HB#   )     4.0  2.2 2.0
assign (resid 7    and name HN    )(resid 16   and name HN    )     4.0  2.2 1.0
assign (resid 7    and name HA    )(resid 8    and name HN    )     2.5  0.7 0.4
assign (resid 7    and name HB2   )(resid 8    and name HN    )     4.0  2.2 1.0
assign (resid 7    and name HB1   )(resid 8    and name HN    )     4.0  2.2 1.0
assign (resid 7    and name HB2   )(resid 16   and name HB#   )     4.0  2.2 2.0
assign (resid 7    and name HB1   )(resid 16   and name HB#   )     4.0  2.2 2.0
assign (resid 7    and name HB#   )(resid 16   and name HD#   )     4.0  2.2 3.0
!E8
assign (resid 8    and name HN    )(resid 8    and name HA    )     3.0  1.2 0.5
assign (resid 8    and name HN    )(resid 8    and name HB2   )     3.0  1.2 0.5
assign (resid 8    and name HN    )(resid 8    and name HB1   )     3.0  1.2 0.5
assign (resid 8    and name HN    )(resid 8    and name HG#   )     4.0  2.2 2.0
assign (resid 8    and name HN    )(resid 9    and name HG2#  )     4.0  2.2 2.0
assign (resid 8    and name HA    )(resid 9    and name HN    )     2.5  0.7 0.4
assign (resid 8    and name HB2   )(resid 9    and name HN    )     3.0  1.2 0.5
assign (resid 8    and name HB1   )(resid 9    and name HN    )     3.0  1.2 0.5
assign (resid 8    and name HG#   )(resid 9    and name HN    )     4.0  2.2 2.0
!T9
assign (resid 9    and name HN    )(resid 9    and name HA    )     4.0  2.2 1.0
assign (resid 9    and name HN    )(resid 9    and name HG2#  )     4.0  2.2 2.0
assign (resid 9    and name HN    )(resid 10   and name HA    )     4.0  2.2 1.0
assign (resid 9    and name HN    )(resid 10   and name HD2   )     4.0  2.2 1.0
assign (resid 9    and name HN    )(resid 10   and name HD1   )     4.0  2.2 1.0
!assign (resid 9    and name HB    )(resid 9    and name HG2#  )     4.0  2.2 2.0
assign (resid 9    and name HB    )(resid 11   and name HN    )     4.0  2.2 1.0
assign (resid 9    and name HG2#  )(resid 10   and name HA    )     4.0  2.2 2.0
assign (resid 9    and name HG2#  )(resid 10   and name HB#   )     4.0  2.2 3.0
assign (resid 9    and name HG2#  )(resid 10   and name HD#   )     4.0  2.2 3.0
assign (resid 9    and name HG2#  )(resid 11   and name HN    )     4.0  2.2 2.0
!P10
!assign (resid 10   and name HA    )(resid 10   and name HB#   )     4.0  2.2 2.0
assign (resid 10   and name HA    )(resid 11   and name HN    )     4.0  2.2 1.0
!assign (resid 10   and name HB2   )(resid 10   and name HB1   )     2.5  0.7 0.4
!assign (resid 10   and name HB1   )(resid 10   and name HB2   )     2.5  0.7 0.4
!assign (resid 10   and name HB#   )(resid 10   and name HG2   )     4.0  2.2 2.0
!assign (resid 10   and name HB#   )(resid 10   and name HG1   )     4.0  2.2 2.0
!assign (resid 10   and name HB#   )(resid 10   and name HD#   )     4.0  2.2 3.0
assign (resid 10   and name HB2   )(resid 11   and name HN    )     4.0  2.2 1.0
assign (resid 10   and name HB1   )(resid 11   and name HN    )     4.0  2.2 1.0
!assign (resid 10   and name HG2   )(resid 10   and name HD#   )     4.0  2.2 2.0
!assign (resid 10   and name HG1   )(resid 10   and name HD#   )     4.0  2.2 2.0
assign (resid 10   and name HG2   )(resid 11   and name HN    )     4.0  2.2 1.0
assign (resid 10   and name HG1   )(resid 11   and name HN    )     4.0  2.2 1.0
!assign (resid 10   and name HD2   )(resid 10   and name HD1   )     4.0  2.2 1.0
!assign (resid 10   and name HD1   )(resid 10   and name HD2   )     4.0  2.2 1.0
assign (resid 10   and name HD2   )(resid 11   and name HN    )     4.0  2.2 1.0
assign (resid 10   and name HD1   )(resid 11   and name HN    )     4.0  2.2 1.0
assign (resid 10   and name HD#   )(resid 11   and name HB#   )     4.0  2.2 3.0
!N11
assign (resid 11   and name HN    )(resid 11   and name HA    )     4.0  2.2 1.0
assign (resid 11   and name HN    )(resid 11   and name HB2   )     3.0  1.2 0.5
assign (resid 11   and name HN    )(resid 11   and name HB1   )     3.0  1.2 0.5
assign (resid 11   and name HB2   )(resid 11   and name HD21  )     4.0  2.2 1.0
assign (resid 11   and name HB1   )(resid 11   and name HD21  )     4.0  2.2 1.0
!assign (resid 11   and name HD21  )(resid 11   and name HD22  )     4.0  2.2 1.0
!assign (resid 11   and name HD22  )(resid 11   and name HD21  )     4.0  2.2 1.0
!H12
assign (resid 12   and name HA    )(resid 14   and name HN    )     4.0  2.2 1.0
assign (resid 12   and name HA    )(resid 71   and name HE1   )     4.0  2.2 1.0
assign (resid 12   and name HB#   )(resid 12   and name HD2   )     4.0  2.2 2.0
assign (resid 12   and name HD2   )(resid 71   and name HE1   )     4.0  2.2 1.0
!N13
assign (resid 13   and name HN    )(resid 13   and name HA    )     4.0  2.2 1.0
assign (resid 13   and name HN    )(resid 13   and name HB2   )     4.0  2.2 1.0
assign (resid 13   and name HN    )(resid 13   and name HB1   )     4.0  2.2 1.0
assign (resid 13   and name HN    )(resid 14   and name HN    )     3.0  1.2 0.5
assign (resid 13   and name HA    )(resid 14   and name HN    )     4.0  2.2 1.0
assign (resid 13   and name HA    )(resid 65   and name HN    )     4.0  2.2 1.0
assign (resid 13   and name HA    )(resid 71   and name HE1   )     4.0  2.2 1.0
!assign (resid 13   and name HB2   )(resid 13   and name HB1   )     2.5  0.7 0.4
!assign (resid 13   and name HB1   )(resid 13   and name HB2   )     2.5  0.7 0.4
assign (resid 13   and name HB2   )(resid 13   and name HD21  )     4.0  2.2 1.0
assign (resid 13   and name HB2   )(resid 13   and name HD22  )     4.0  2.2 1.0
assign (resid 13   and name HB1   )(resid 13   and name HD21  )     4.0  2.2 1.0
assign (resid 13   and name HB1   )(resid 13   and name HD22  )     4.0  2.2 1.0
assign (resid 13   and name HB#   )(resid 14   and name HN    )     4.0  2.2 2.0
assign (resid 13   and name HB2   )(resid 65   and name HN    )     4.0  2.2 1.0
assign (resid 13   and name HB1   )(resid 65   and name HN    )     4.0  2.2 1.0
!assign (resid 13   and name HD21  )(resid 13   and name HD22  )     4.0  2.2 1.0
!assign (resid 13   and name HD22  )(resid 13   and name HD21  )     4.0  2.2 1.0
assign (resid 13   and name HD21  )(resid 67   and name HA    )     4.0  2.2 1.0
assign (resid 13   and name HD22  )(resid 67   and name HA    )     4.0  2.2 1.0
assign (resid 13   and name HD21  )(resid 67   and name HB#   )     4.0  2.2 2.0
assign (resid 13   and name HD22  )(resid 67   and name HB#   )     4.0  2.2 2.0
!T14
assign (resid 14   and name HN    )(resid 14   and name HA    )     4.0  2.2 1.0
assign (resid 14   and name HN    )(resid 14   and name HB    )     4.0  2.2 1.0
assign (resid 14   and name HN    )(resid 71   and name HZ2   )     4.0  2.2 1.0
!assign (resid 14   and name HA    )(resid 14   and name HB    )     4.0  2.2 1.0
assign (resid 14   and name HA    )(resid 14   and name HG2#  )     4.0  2.2 1.6
assign (resid 14   and name HA    )(resid 15   and name HN    )     3.0  1.2 0.5
assign (resid 14   and name HA    )(resid 15   and name HB#   )     4.0  2.2 2.0
assign (resid 14   and name HA    )(resid 64   and name HA    )     4.0  2.2 1.0
assign (resid 14   and name HA    )(resid 65   and name HN    )     4.0  2.2 1.0
assign (resid 14   and name HA    )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 14   and name HA    )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 14   and name HB    )(resid 14   and name HG2#  )     4.0  2.2 2.0
assign (resid 14   and name HB    )(resid 64   and name HB2   )     3.0  1.2 0.5
assign (resid 14   and name HB    )(resid 64   and name HB1   )     3.0  1.2 0.5
assign (resid 14   and name HG2#  )(resid 15   and name HN    )     4.0  2.2 2.0
assign (resid 14   and name HG2#  )(resid 62   and name HA    )     4.0  2.2 2.0
assign (resid 14   and name HG2#  )(resid 62   and name HB#   )     4.0  2.2 3.0
assign (resid 14   and name HG2#  )(resid 63   and name HN    )     4.0  2.2 2.0
assign (resid 14   and name HG2#  )(resid 64   and name HA    )     4.0  2.2 2.0
assign (resid 14   and name HG2#  )(resid 64   and name HB2   )     4.0  2.2 2.0
assign (resid 14   and name HG2#  )(resid 64   and name HB1   )     4.0  2.2 2.0
!M15
assign (resid 15   and name HN    )(resid 15   and name HA    )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 15   and name HB2   )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 15   and name HB1   )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 63   and name HN    )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 63   and name HB    )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 15   and name HN    )(resid 71   and name HH2   )     4.0  2.2 1.0
assign (resid 15   and name HA    )(resid 16   and name HN    )     2.5  0.7 0.4
!assign (resid 15   and name HB2   )(resid 15   and name HB1   )     3.0  1.2 0.5
!assign (resid 15   and name HB1   )(resid 15   and name HB2   )     3.0  1.2 0.5
!assign (resid 15   and name HB#   )(resid 15   and name HG2   )     4.0  2.2 2.0
!assign (resid 15   and name HB#   )(resid 15   and name HG1   )     4.0  2.2 2.0
assign (resid 15   and name HB2   )(resid 16   and name HN    )     4.0  2.2 1.0
assign (resid 15   and name HB1   )(resid 16   and name HN    )     4.0  2.2 1.0
assign (resid 15   and name HB#   )(resid 63   and name HB    )     4.0  2.2 2.0
assign (resid 15   and name HB#   )(resid 71   and name HZ2   )     4.0  2.2 2.0
assign (resid 15   and name HB#   )(resid 71   and name HH2   )     4.0  2.2 2.0
assign (resid 15   and name HG2   )(resid 16   and name HN    )     4.0  2.2 1.0
assign (resid 15   and name HG1   )(resid 16   and name HN    )     4.0  2.2 1.0
assign (resid 15   and name HG#   )(resid 63   and name HB    )     4.0  2.2 2.0
assign (resid 15   and name HG2   )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 15   and name HG1   )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 15   and name HE#   )(resid 63   and name HB    )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 71   and name HB#   )     4.0  2.2 3.0
assign (resid 15   and name HE#   )(resid 71   and name HD1   )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 71   and name HE1   )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 71   and name HZ2   )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 71   and name HE3   )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 75   and name HG    )     4.0  2.2 2.0
assign (resid 15   and name HE#   )(resid 75   and name HD1#  )     4.0  2.2 3.0
!K16
assign (resid 16   and name HN    )(resid 16   and name HA    )     4.0  2.2 1.0
assign (resid 16   and name HN    )(resid 16   and name HB2   )     4.0  2.2 1.0
assign (resid 16   and name HN    )(resid 16   and name HB1   )     4.0  2.2 1.0
assign (resid 16   and name HN    )(resid 16   and name HG2   )     4.0  2.2 1.0
assign (resid 16   and name HN    )(resid 16   and name HG1   )     4.0  2.2 1.0
assign (resid 16   and name HN    )(resid 17   and name HN    )     4.0  2.2 1.0
!assign (resid 16   and name HA    )(resid 16   and name HB2   )     4.0  2.2 1.0
!assign (resid 16   and name HA    )(resid 16   and name HB1   )     4.0  2.2 1.0
assign (resid 16   and name HA    )(resid 16   and name HG#   )     4.0  2.2 2.0
assign (resid 16   and name HA    )(resid 17   and name HN    )     4.0  2.2 1.0
assign (resid 16   and name HA    )(resid 61   and name HN    )     4.0  2.2 1.0
assign (resid 16   and name HA    )(resid 62   and name HN    )     4.0  2.2 1.0
assign (resid 16   and name HA    )(resid 63   and name HN    )     4.0  2.2 1.0
!assign (resid 16   and name HB2   )(resid 16   and name HB1   )     2.5  0.7 0.4
!assign (resid 16   and name HB1   )(resid 16   and name HB2   )     2.5  0.7 0.4
!assign (resid 16   and name HB2   )(resid 16   and name HG2   )     4.0  2.2 1.0
!assign (resid 16   and name HB2   )(resid 16   and name HG1   )     4.0  2.2 1.0
!assign (resid 16   and name HB1   )(resid 16   and name HG2   )     4.0  2.2 1.0
!assign (resid 16   and name HB1   )(resid 16   and name HG1   )     4.0  2.2 1.0
assign (resid 16   and name HB2   )(resid 16   and name HD#   )     4.0  2.2 2.0
assign (resid 16   and name HB1   )(resid 16   and name HD#   )     4.0  2.2 2.0
!assign (resid 16   and name HG2   )(resid 16   and name HD#   )     4.0  2.2 2.0
!assign (resid 16   and name HG1   )(resid 16   and name HD#   )     4.0  2.2 2.0
assign (resid 16   and name HG2   )(resid 16   and name HE2   )     4.0  2.2 1.0
assign (resid 16   and name HG2   )(resid 16   and name HE1   )     4.0  2.2 1.0
assign (resid 16   and name HG1   )(resid 16   and name HE2   )     4.0  2.2 1.0
assign (resid 16   and name HG1   )(resid 16   and name HE1   )     4.0  2.2 1.0
assign (resid 16   and name HG#   )(resid 17   and name HN    )     4.0  2.2 2.0
assign (resid 16   and name HG2   )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 16   and name HG1   )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 16   and name HG2   )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 16   and name HG1   )(resid 60   and name HD#   )     4.0  2.2 3.0
!assign (resid 16   and name HD#   )(resid 16   and name HE2   )     4.0  2.2 2.0
!assign (resid 16   and name HD#   )(resid 16   and name HE1   )     4.0  2.2 2.0
assign (resid 16   and name HD#   )(resid 60   and name HD#   )     4.0  2.2 4.0
!assign (resid 16   and name HE2   )(resid 16   and name HE1   )     4.0  2.2 1.0
!assign (resid 16   and name HE1   )(resid 16   and name HE2   )     4.0  2.2 1.0
assign (resid 16   and name HE2   )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 16   and name HE1   )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 16   and name HE2   )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 16   and name HE1   )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 16   and name HE#   )(resid 60   and name HE#   )     4.0  2.2 4.0
!I17
assign (resid 17   and name HN    )(resid 17   and name HA    )     4.0  2.2 1.0
assign (resid 17   and name HN    )(resid 17   and name HB    )     3.0  1.2 0.5
assign (resid 17   and name HN    )(resid 17   and name HG12  )     4.0  2.2 1.0
assign (resid 17   and name HN    )(resid 17   and name HG11  )     4.0  2.2 1.0
assign (resid 17   and name HN    )(resid 17   and name HD1#  )     4.0  2.2 2.0
assign (resid 17   and name HN    )(resid 18   and name HN    )     4.0  2.2 1.0
assign (resid 17   and name HN    )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 17   and name HN    )(resid 61   and name HN    )     4.0  2.2 1.0
assign (resid 17   and name HN    )(resid 61   and name HG1#  )     4.0  2.2 2.0
assign (resid 17   and name HN    )(resid 62   and name HA    )     4.0  2.2 1.0
assign (resid 17   and name HA    )(resid 18   and name HN    )     3.0  1.2 0.5
assign (resid 17   and name HA    )(resid 61   and name HN    )     4.0  2.2 1.0
!assign (resid 17   and name HB    )(resid 17   and name HG12  )     4.0  2.2 1.0
!assign (resid 17   and name HB    )(resid 17   and name HG11  )     4.0  2.2 1.0
!assign (resid 17   and name HB    )(resid 17   and name HG2#  )     4.0  2.2 2.0
assign (resid 17   and name HB    )(resid 17   and name HD1#  )     4.0  2.2 2.0
assign (resid 17   and name HB    )(resid 61   and name HB    )     4.0  2.2 1.0
assign (resid 17   and name HB    )(resid 61   and name HG1#  )     4.0  2.2 2.0
assign (resid 17   and name HB    )(resid 63   and name HG2#  )     4.0  2.2 2.0
!assign (resid 17   and name HG12  )(resid 17   and name HG11  )     4.0  2.2 1.0
!assign (resid 17   and name HG11  )(resid 17   and name HG12  )     4.0  2.2 1.0
assign (resid 17   and name HG1#  )(resid 17   and name HG2#  )     4.0  2.2 3.0
!assign (resid 17   and name HG12  )(resid 17   and name HD1#  )     4.0  2.2 2.0
!assign (resid 17   and name HG11  )(resid 17   and name HD1#  )     4.0  2.2 2.0
assign (resid 17   and name HG12  )(resid 18   and name HN    )     4.0  2.2 1.0
assign (resid 17   and name HG11  )(resid 18   and name HN    )     4.0  2.2 1.0
assign (resid 17   and name HG12  )(resid 61   and name HB    )     4.0  2.2 1.0
assign (resid 17   and name HG11  )(resid 61   and name HB    )     4.0  2.2 1.0
assign (resid 17   and name HG12  )(resid 63   and name HG2#  )     4.0  2.2 2.0
assign (resid 17   and name HG11  )(resid 63   and name HG2#  )     4.0  2.2 2.0
assign (resid 17   and name HG2#  )(resid 18   and name HN    )     4.0  2.2 2.0
assign (resid 17   and name HG2#  )(resid 19   and name HD2#  )     4.0  2.2 3.0
assign (resid 17   and name HD1#  )(resid 61   and name HB    )     4.0  2.2 2.0
assign (resid 17   and name HD1#  )(resid 61   and name HG2#  )     4.0  2.2 3.0
assign (resid 17   and name HD1#  )(resid 63   and name HB    )     4.0  2.2 2.0
assign (resid 17   and name HD1#  )(resid 63   and name HG2#  )     4.0  2.2 3.0
assign (resid 17   and name HD1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
!T18
assign (resid 18   and name HN    )(resid 18   and name HA    )     3.0  1.2 0.5
assign (resid 18   and name HN    )(resid 18   and name HB    )     3.0  1.2 0.5
assign (resid 18   and name HN    )(resid 18   and name HG2#  )     4.0  2.2 2.0
assign (resid 18   and name HN    )(resid 19   and name HN    )     4.0  2.2 1.0
assign (resid 18   and name HN    )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 18   and name HA    )(resid 19   and name HN    )     3.0  1.2 0.5
assign (resid 18   and name HA    )(resid 61   and name HN    )     4.0  2.2 1.0
!assign (resid 18   and name HB    )(resid 18   and name HG2#  )     4.0  2.2 2.0
assign (resid 18   and name HB    )(resid 19   and name HN    )     4.0  2.2 1.0
assign (resid 18   and name HG2#  )(resid 19   and name HN    )     4.0  2.2 2.0
assign (resid 18   and name HG2#  )(resid 59   and name HB#   )     4.0  2.2 3.0
assign (resid 18   and name HG2#  )(resid 60   and name HB#   )     4.0  2.2 3.0
!L19
assign (resid 19   and name HN    )(resid 19   and name HA    )     4.0  2.2 1.0
assign (resid 19   and name HN    )(resid 19   and name HB2   )     4.0  2.2 1.0
assign (resid 19   and name HN    )(resid 19   and name HB1   )     4.0  2.2 1.0
assign (resid 19   and name HN    )(resid 19   and name HG    )     4.0  2.2 1.0
assign (resid 19   and name HN    )(resid 19   and name HD1#  )     4.0  2.2 2.0
assign (resid 19   and name HN    )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 19   and name HN    )(resid 59   and name HB#   )     4.0  2.2 2.0
assign (resid 19   and name HN    )(resid 60   and name HA    )     4.0  2.2 1.0
assign (resid 19   and name HN    )(resid 60   and name HB#   )     4.0  2.2 2.0
assign (resid 19   and name HA    )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 19   and name HA    )(resid 20   and name HN    )     3.0  1.2 0.5
!assign (resid 19   and name HB2   )(resid 19   and name HB1   )     3.0  1.2 0.5
!assign (resid 19   and name HB1   )(resid 19   and name HB2   )     3.0  1.2 0.5
!assign (resid 19   and name HB#   )(resid 19   and name HG    )     4.0  2.2 2.0
assign (resid 19   and name HB2   )(resid 19   and name HD1#  )     4.0  2.2 2.0
assign (resid 19   and name HB2   )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 19   and name HB1   )(resid 19   and name HD1#  )     4.0  2.2 2.0
assign (resid 19   and name HB1   )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 19   and name HB2   )(resid 20   and name HN    )     4.0  2.2 1.0
assign (resid 19   and name HB1   )(resid 20   and name HN    )     4.0  2.2 1.0
assign (resid 19   and name HB2   )(resid 21   and name HN    )     4.0  2.2 1.0
assign (resid 19   and name HB1   )(resid 21   and name HN    )     4.0  2.2 1.0
!assign (resid 19   and name HG    )(resid 19   and name HD1#  )     4.0  2.2 2.0
!assign (resid 19   and name HG    )(resid 19   and name HD2#  )     4.0  2.2 2.0
assign (resid 19   and name HG    )(resid 60   and name HA    )     4.0  2.2 1.0
!assign (resid 19   and name HD1#  )(resid 19   and name HD2#  )     4.0  2.2 3.0
assign (resid 19   and name HD1#  )(resid 20   and name HN    )     4.0  2.2 2.0
assign (resid 19   and name HD2#  )(resid 20   and name HN    )     4.0  2.2 2.0
assign (resid 19   and name HD1#  )(resid 21   and name HN    )     4.0  2.2 2.0
assign (resid 19   and name HD2#  )(resid 21   and name HN    )     4.0  2.2 2.0
assign (resid 19   and name HD2#  )(resid 26   and name HE#   )     4.0  2.2 3.0
assign (resid 19   and name HD1#  )(resid 60   and name HA    )     4.0  2.2 2.0
assign (resid 19   and name HD2#  )(resid 61   and name HN    )     4.0  2.2 2.0
assign (resid 19   and name HD1#  )(resid 61   and name HG1#  )     4.0  2.2 3.0
assign (resid 19   and name HD2#  )(resid 61   and name HG1#  )     4.0  2.2 3.0
assign (resid 19   and name HD1#  )(resid 61   and name HD1#  )     4.0  2.2 3.0
assign (resid 19   and name HD2#  )(resid 61   and name HD1#  )     4.0  2.2 3.0
assign (resid 19   and name HD2#  )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 19   and name HD2#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 19   and name HD2#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!S20
assign (resid 20   and name HN    )(resid 20   and name HA    )     4.0  2.2 1.0
assign (resid 20   and name HN    )(resid 20   and name HB2   )     4.0  2.2 1.0
assign (resid 20   and name HN    )(resid 20   and name HB1   )     4.0  2.2 1.0
assign (resid 20   and name HN    )(resid 21   and name HN    )     3.0  1.2 0.5
assign (resid 20   and name HN    )(resid 21   and name HA    )     4.0  2.2 1.0
!assign (resid 20   and name HA    )(resid 20   and name HB2   )     4.0  2.2 1.0
!assign (resid 20   and name HA    )(resid 20   and name HB1   )     4.0  2.2 1.0
assign (resid 20   and name HA    )(resid 21   and name HN    )     4.0  2.2 1.0
assign (resid 20   and name HB#   )(resid 21   and name HN    )     4.0  2.2 2.0
!E21
assign (resid 21   and name HN    )(resid 21   and name HA    )     3.0  1.2 0.5
assign (resid 21   and name HN    )(resid 21   and name HB2   )     4.0  2.2 1.0
assign (resid 21   and name HN    )(resid 21   and name HB1   )     4.0  2.2 1.0
assign (resid 21   and name HN    )(resid 21   and name HG#   )     4.0  2.2 2.0
assign (resid 21   and name HN    )(resid 26   and name HE#   )     4.0  2.2 2.0
assign (resid 21   and name HA    )(resid 22   and name HN    )     2.5  0.7 0.4
!assign (resid 21   and name HB2   )(resid 21   and name HB1   )     2.5  0.7 0.4
!assign (resid 21   and name HB1   )(resid 21   and name HB2   )     2.5  0.7 0.4
!assign (resid 21   and name HB2   )(resid 21   and name HG#   )     4.0  2.2 2.0
!assign (resid 21   and name HB1   )(resid 21   and name HG#   )     4.0  2.2 2.0
assign (resid 21   and name HB2   )(resid 22   and name HN    )     4.0  2.2 1.0
assign (resid 21   and name HB1   )(resid 22   and name HN    )     4.0  2.2 1.0
assign (resid 21   and name HB#   )(resid 59   and name HB#   )     4.0  2.2 3.0
!assign (resid 21   and name HG2   )(resid 21   and name HG1   )     4.0  2.2 1.0
!assign (resid 21   and name HG1   )(resid 21   and name HG2   )     4.0  2.2 1.0
assign (resid 21   and name HG#   )(resid 22   and name HN    )     4.0  2.2 2.0
!S22
assign (resid 22   and name HN    )(resid 22   and name HA    )     2.5  0.7 0.4
assign (resid 22   and name HN    )(resid 22   and name HB#   )     3.0  1.2 1.5
assign (resid 22   and name HA    )(resid 23   and name HN    )     2.5  0.7 0.4
assign (resid 22   and name HB#   )(resid 23   and name HN    )     4.0  2.2 2.0
assign (resid 22   and name HB#   )(resid 59   and name HB2   )     4.0  2.2 2.0
assign (resid 22   and name HB#   )(resid 59   and name HB1   )     4.0  2.2 2.0
!R23
assign (resid 23   and name HN    )(resid 23   and name HA    )     4.0  2.2 1.0
assign (resid 23   and name HN    )(resid 23   and name HB2   )     4.0  2.2 1.0
assign (resid 23   and name HN    )(resid 23   and name HB1   )     4.0  2.2 1.0
assign (resid 23   and name HN    )(resid 23   and name HG2   )     4.0  2.2 1.0
assign (resid 23   and name HN    )(resid 23   and name HG1   )     4.0  2.2 1.0
assign (resid 23   and name HN    )(resid 23   and name HD#   )     4.0  2.2 2.0
!assign (resid 23   and name HA    )(resid 23   and name HB2   )     4.0  2.2 1.0
!assign (resid 23   and name HA    )(resid 23   and name HB1   )     4.0  2.2 1.0
assign (resid 23   and name HA    )(resid 23   and name HG#   )     4.0  2.2 2.0
assign (resid 23   and name HA    )(resid 24   and name HN    )     3.0  1.2 0.5
!assign (resid 23   and name HB2   )(resid 23   and name HB1   )     3.0  1.2 0.5
!assign (resid 23   and name HB1   )(resid 23   and name HB2   )     3.0  1.2 0.5
!assign (resid 23   and name HB#   )(resid 23   and name HG2   )     4.0  2.2 2.0
!assign (resid 23   and name HB#   )(resid 23   and name HG1   )     4.0  2.2 2.0
assign (resid 23   and name HB2   )(resid 23   and name HD#   )     4.0  2.2 2.0
assign (resid 23   and name HB1   )(resid 23   and name HD#   )     4.0  2.2 2.0
assign (resid 23   and name HB2   )(resid 24   and name HN    )     4.0  2.2 1.0
assign (resid 23   and name HB1   )(resid 24   and name HN    )     4.0  2.2 1.0
assign (resid 23   and name HB#   )(resid 25   and name HN    )     4.0  2.2 2.0
!assign (resid 23   and name HG2   )(resid 23   and name HG1   )     4.0  2.2 1.0
!assign (resid 23   and name HG1   )(resid 23   and name HG2   )     4.0  2.2 1.0
!assign (resid 23   and name HG2   )(resid 23   and name HD#   )     4.0  2.2 2.0
!assign (resid 23   and name HG1   )(resid 23   and name HD#   )     4.0  2.2 2.0
assign (resid 23   and name HG#   )(resid 24   and name HN    )     4.0  2.2 2.0
assign (resid 23   and name HG#   )(resid 24   and name HB#   )     4.0  2.2 3.0
!E24
assign (resid 24   and name HN    )(resid 24   and name HA    )     3.0  1.2 0.5
assign (resid 24   and name HN    )(resid 24   and name HB#   )     3.0  1.2 1.5
assign (resid 24   and name HN    )(resid 24   and name HG#   )     4.0  2.2 2.0
!assign (resid 24   and name HA    )(resid 24   and name HB#   )     3.0  1.2 1.5
assign (resid 24   and name HA    )(resid 24   and name HG#   )     4.0  2.2 2.0
assign (resid 24   and name HA    )(resid 25   and name HN    )     3.0  1.2 0.5
!assign (resid 24   and name HB#   )(resid 24   and name HG#   )     4.0  2.2 3.0
assign (resid 24   and name HB#   )(resid 25   and name HN    )     4.0  2.2 2.0
assign (resid 24   and name HG#   )(resid 25   and name HN    )     4.0  2.2 2.0
assign (resid 24   and name HG#   )(resid 25   and name HA#   )     4.0  2.2 2.6
!G25
assign (resid 25   and name HN    )(resid 25   and name HA#   )     4.0  2.2 1.6
assign (resid 25   and name HN    )(resid 26   and name HN    )     4.0  2.2 1.0
assign (resid 25   and name HA#   )(resid 26   and name HN    )     4.0  2.2 1.6
assign (resid 25   and name HA#   )(resid 27   and name HN    )     4.0  2.2 2.0
!M26
assign (resid 26   and name HN    )(resid 26   and name HA    )     3.0  1.2 0.5
assign (resid 26   and name HN    )(resid 26   and name HB2   )     4.0  2.2 1.0
assign (resid 26   and name HN    )(resid 26   and name HB1   )     4.0  2.2 1.0
assign (resid 26   and name HN    )(resid 26   and name HG#   )     4.0  2.2 2.0
assign (resid 26   and name HN    )(resid 27   and name HN    )     4.0  2.2 1.0
assign (resid 26   and name HN    )(resid 59   and name HB#   )     4.0  2.2 2.0
!assign (resid 26   and name HB2   )(resid 26   and name HG#   )     4.0  2.2 2.0
!assign (resid 26   and name HB1   )(resid 26   and name HG#   )     4.0  2.2 2.0
assign (resid 26   and name HB#   )(resid 27   and name HN    )     4.0  2.2 2.0
assign (resid 26   and name HG#   )(resid 59   and name HB#   )     4.0  2.2 3.0
!T27
assign (resid 27   and name HN    )(resid 27   and name HA    )     4.0  2.2 1.0
assign (resid 27   and name HN    )(resid 27   and name HB    )     4.0  2.2 1.0
assign (resid 27   and name HN    )(resid 27   and name HG2#  )     4.0  2.2 2.0
assign (resid 27   and name HA    )(resid 27   and name HG2#  )     4.0  2.2 1.6
assign (resid 27   and name HA    )(resid 28   and name HN    )     3.0  1.2 0.5
!assign (resid 27   and name HB    )(resid 27   and name HG2#  )     4.0  2.2 2.0
assign (resid 27   and name HB    )(resid 28   and name HN    )     3.0  1.2 0.5
assign (resid 27   and name HG2#  )(resid 28   and name HN    )     4.0  2.2 2.0
!S28
assign (resid 28   and name HN    )(resid 28   and name HA    )     4.0  2.2 1.0
assign (resid 28   and name HN    )(resid 28   and name HB2   )     4.0  2.2 1.0
assign (resid 28   and name HN    )(resid 28   and name HB1   )     4.0  2.2 1.0
assign (resid 28   and name HA    )(resid 29   and name HN    )     2.5  0.7 0.4
assign (resid 28   and name HA    )(resid 56   and name HN    )     4.0  2.2 1.0
assign (resid 28   and name HB2   )(resid 29   and name HN    )     4.0  2.2 1.0
assign (resid 28   and name HB1   )(resid 29   and name HN    )     4.0  2.2 1.0
assign (resid 28   and name HB2   )(resid 55   and name HE#   )     4.0  2.2 3.0
assign (resid 28   and name HB1   )(resid 55   and name HE#   )     4.0  2.2 3.0
assign (resid 28   and name HB2   )(resid 57   and name HB    )     4.0  2.2 1.0
assign (resid 28   and name HB1   )(resid 57   and name HB    )     4.0  2.2 1.0
assign (resid 28   and name HB2   )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 28   and name HB2   )(resid 57   and name HG2#  )     4.0  2.2 2.0
assign (resid 28   and name HB1   )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 28   and name HB1   )(resid 57   and name HG2#  )     4.0  2.2 2.0
!D29
assign (resid 29   and name HN    )(resid 29   and name HA    )     3.0  1.2 0.5
assign (resid 29   and name HN    )(resid 29   and name HB2   )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 29   and name HB1   )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 56   and name HN    )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 56   and name HB2   )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 56   and name HB1   )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 57   and name HB    )     4.0  2.2 1.0
assign (resid 29   and name HN    )(resid 57   and name HG2#  )     4.0  2.2 2.0
assign (resid 29   and name HA    )(resid 30   and name HN    )     2.5  0.7 0.4
assign (resid 29   and name HA    )(resid 56   and name HN    )     4.0  2.2 1.0
!assign (resid 29   and name HB2   )(resid 29   and name HB1   )     2.5  0.7 0.4
!assign (resid 29   and name HB1   )(resid 29   and name HB2   )     2.5  0.7 0.4
assign (resid 29   and name HB2   )(resid 30   and name HN    )     4.0  2.2 1.0
assign (resid 29   and name HB1   )(resid 30   and name HN    )     4.0  2.2 1.0
assign (resid 29   and name HB#   )(resid 31   and name HD#   )     4.0  2.2 4.0
assign (resid 29   and name HB2   )(resid 31   and name HE#   )     4.0  2.2 3.0
assign (resid 29   and name HB1   )(resid 31   and name HE#   )     4.0  2.2 3.0
assign (resid 29   and name HB2   )(resid 56   and name HN    )     4.0  2.2 1.0
assign (resid 29   and name HB1   )(resid 56   and name HN    )     4.0  2.2 1.0
assign (resid 29   and name HB#   )(resid 56   and name HB#   )     4.0  2.2 3.0
!T30
assign (resid 30   and name HN    )(resid 30   and name HA    )     4.0  2.2 1.0
assign (resid 30   and name HN    )(resid 30   and name HB    )     3.0  1.2 0.5
assign (resid 30   and name HN    )(resid 30   and name HG2#  )     4.0  2.2 2.0
assign (resid 30   and name HN    )(resid 31   and name HN    )     4.0  2.2 1.0
assign (resid 30   and name HA    )(resid 30   and name HG2#  )     4.0  2.2 1.6
assign (resid 30   and name HA    )(resid 31   and name HN    )     2.5  0.7 0.4
assign (resid 30   and name HA    )(resid 55   and name HA    )     4.0  2.2 1.0
assign (resid 30   and name HA    )(resid 56   and name HN    )     4.0  2.2 1.0
!assign (resid 30   and name HB    )(resid 30   and name HG2#  )     4.0  2.2 2.0
assign (resid 30   and name HG2#  )(resid 31   and name HN    )     4.0  2.2 2.0
assign (resid 30   and name HG2#  )(resid 55   and name HA    )     4.0  2.2 2.0
assign (resid 30   and name HG2#  )(resid 55   and name HB#   )     4.0  2.2 3.0
assign (resid 30   and name HG2#  )(resid 55   and name HD#   )     4.0  2.2 4.0
assign (resid 30   and name HG2#  )(resid 56   and name HN    )     4.0  2.2 2.0
!Y31
assign (resid 31   and name HN    )(resid 31   and name HA    )     4.0  2.2 1.0
assign (resid 31   and name HN    )(resid 31   and name HB2   )     4.0  2.2 1.0
assign (resid 31   and name HN    )(resid 31   and name HB1   )     4.0  2.2 1.0
assign (resid 31   and name HN    )(resid 31   and name HD#   )     4.0  2.2 3.0
assign (resid 31   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 31   and name HN    )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HN    )(resid 54   and name HB    )     4.0  2.2 1.0
assign (resid 31   and name HN    )(resid 55   and name HA    )     4.0  2.2 1.0
!assign (resid 31   and name HA    )(resid 31   and name HB2   )     4.0  2.2 1.0
!assign (resid 31   and name HA    )(resid 31   and name HB1   )     4.0  2.2 1.0
assign (resid 31   and name HA    )(resid 31   and name HD#   )     4.0  2.2 2.0
assign (resid 31   and name HA    )(resid 32   and name HN    )     3.0  1.2 0.5
assign (resid 31   and name HA    )(resid 32   and name HG2#  )     4.0  2.2 2.0
assign (resid 31   and name HA    )(resid 33   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HB2   )(resid 31   and name HD#   )     4.0  2.2 3.0
assign (resid 31   and name HB1   )(resid 31   and name HD#   )     4.0  2.2 3.0
assign (resid 31   and name HB#   )(resid 31   and name HE#   )     4.0  2.2 4.0
assign (resid 31   and name HB2   )(resid 32   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HB1   )(resid 32   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HB#   )(resid 34   and name HG1#  )     4.0  2.2 3.0
assign (resid 31   and name HB#   )(resid 34   and name HG2#  )     4.0  2.2 3.0
assign (resid 31   and name HB#   )(resid 38   and name HE21  )     4.0  2.2 2.0
assign (resid 31   and name HB#   )(resid 42   and name HG2#  )     4.0  2.2 3.0
assign (resid 31   and name HB2   )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 31   and name HB1   )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 31   and name HB2   )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HB1   )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 31   and name HB2   )(resid 54   and name HB    )     4.0  2.2 1.0
assign (resid 31   and name HB1   )(resid 54   and name HB    )     4.0  2.2 1.0
assign (resid 31   and name HB#   )(resid 54   and name HG2#  )     4.0  2.2 3.0
assign (resid 31   and name HB#   )(resid 54   and name HD1#  )     4.0  2.2 3.0
!assign (resid 31   and name HD#   )(resid 31   and name HE#   )     4.0  2.2 5.0
assign (resid 31   and name HD#   )(resid 35   and name HN    )     4.0  2.2 3.0
assign (resid 31   and name HD#   )(resid 38   and name HB#   )     4.0  2.2 4.0
assign (resid 31   and name HD#   )(resid 38   and name HG#   )     4.0  2.2 4.0
assign (resid 31   and name HD#   )(resid 42   and name HG2#  )     4.0  2.2 4.0
assign (resid 31   and name HD#   )(resid 42   and name HD1#  )     4.0  2.2 4.0
assign (resid 31   and name HD#   )(resid 54   and name HB    )     4.0  2.2 3.0
assign (resid 31   and name HD#   )(resid 54   and name HG2#  )     4.0  2.2 4.0
assign (resid 31   and name HD#   )(resid 54   and name HD1#  )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 36   and name HB#   )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 38   and name HG#   )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 42   and name HG1#  )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 42   and name HG2#  )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 42   and name HD1#  )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 54   and name HG2#  )     4.0  2.2 4.0
assign (resid 31   and name HE#   )(resid 56   and name HN    )     4.0  2.2 3.0
assign (resid 31   and name HE#   )(resid 56   and name HB2   )     4.0  2.2 3.0
assign (resid 31   and name HE#   )(resid 56   and name HB1   )     4.0  2.2 3.0
assign (resid 31   and name HE#   )(resid 61   and name HG2#  )     4.0  2.2 4.0
!T32
assign (resid 32   and name HN    )(resid 32   and name HA    )     4.0  2.2 1.0
assign (resid 32   and name HN    )(resid 32   and name HB    )     4.0  2.2 1.0
assign (resid 32   and name HN    )(resid 32   and name HG2#  )     4.0  2.2 2.0
assign (resid 32   and name HN    )(resid 33   and name HN    )     2.5  0.7 0.4
assign (resid 32   and name HN    )(resid 33   and name HA    )     4.0  2.2 1.0
assign (resid 32   and name HN    )(resid 33   and name HG#   )     4.0  2.2 2.0
assign (resid 32   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 32   and name HA    )(resid 33   and name HN    )     4.0  2.2 1.0
assign (resid 32   and name HA    )(resid 53   and name HB#   )     4.0  2.2 2.0
!assign (resid 32   and name HB    )(resid 32   and name HG2#  )     4.0  2.2 2.0
assign (resid 32   and name HB    )(resid 33   and name HN    )     4.0  2.2 1.0
assign (resid 32   and name HG2#  )(resid 33   and name HN    )     4.0  2.2 2.0
assign (resid 32   and name HG2#  )(resid 53   and name HB2   )     4.0  2.2 2.0
assign (resid 32   and name HG2#  )(resid 53   and name HB1   )     4.0  2.2 2.0
assign (resid 32   and name HG2#  )(resid 54   and name HN    )     4.0  2.2 2.0
!K33
assign (resid 33   and name HN    )(resid 33   and name HA    )     3.0  1.2 0.5
assign (resid 33   and name HN    )(resid 33   and name HB#   )     4.0  2.2 2.0
assign (resid 33   and name HN    )(resid 33   and name HG#   )     4.0  2.2 2.0
assign (resid 33   and name HN    )(resid 33   and name HD#   )     4.0  2.2 2.0
assign (resid 33   and name HN    )(resid 34   and name HG2#  )     4.0  2.2 2.0
assign (resid 33   and name HN    )(resid 46   and name HB#   )     4.0  2.2 2.0
assign (resid 33   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 33   and name HA    )(resid 34   and name HN    )     2.5  0.7 0.4
!assign (resid 33   and name HB2   )(resid 33   and name HG#   )     4.0  2.2 2.0
!assign (resid 33   and name HB1   )(resid 33   and name HG#   )     4.0  2.2 2.0
assign (resid 33   and name HB#   )(resid 33   and name HD#   )     4.0  2.2 3.0
assign (resid 33   and name HB#   )(resid 33   and name HE#   )     4.0  2.2 3.0
!assign (resid 33   and name HG#   )(resid 33   and name HD#   )     4.0  2.2 3.0
assign (resid 33   and name HG#   )(resid 33   and name HE#   )     4.0  2.2 3.0
!assign (resid 33   and name HD#   )(resid 33   and name HE#   )     4.0  2.2 3.0
!V34
assign (resid 34   and name HN    )(resid 34   and name HA    )     3.0  1.2 0.5
assign (resid 34   and name HN    )(resid 34   and name HB    )     3.0  1.2 0.5
assign (resid 34   and name HN    )(resid 34   and name HG1#  )     4.0  2.2 2.0
assign (resid 34   and name HN    )(resid 34   and name HG2#  )     4.0  2.2 2.0
assign (resid 34   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
!assign (resid 34   and name HA    )(resid 34   and name HB    )     4.0  2.2 1.0
assign (resid 34   and name HA    )(resid 34   and name HG1#  )     4.0  2.2 2.0
assign (resid 34   and name HA    )(resid 34   and name HG2#  )     4.0  2.2 2.0
assign (resid 34   and name HA    )(resid 35   and name HN    )     3.0  1.2 0.5
assign (resid 34   and name HA    )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 34   and name HA    )(resid 38   and name HE22  )     4.0  2.2 1.0
assign (resid 34   and name HA    )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 34   and name HA    )(resid 46   and name HD1#  )     4.0  2.2 2.0
!assign (resid 34   and name HB    )(resid 34   and name HG1#  )     4.0  2.2 2.0
!assign (resid 34   and name HB    )(resid 34   and name HG2#  )     4.0  2.2 2.0
assign (resid 34   and name HB    )(resid 35   and name HN    )     4.0  2.2 1.0
!assign (resid 34   and name HG1#  )(resid 34   and name HG2#  )     4.0  2.2 3.0
assign (resid 34   and name HG1#  )(resid 35   and name HN    )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 35   and name HN    )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 43   and name HA    )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 43   and name HA    )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 43   and name HB2   )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 43   and name HB1   )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 43   and name HB2   )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 43   and name HB1   )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 43   and name HD21  )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 43   and name HD22  )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 46   and name HN    )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 46   and name HB2   )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 46   and name HB1   )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 46   and name HD1#  )     4.0  2.2 3.0
assign (resid 34   and name HG2#  )(resid 47   and name HN    )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 47   and name HA    )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 47   and name HD2   )     4.0  2.2 2.0
assign (resid 34   and name HG2#  )(resid 47   and name HD1   )     4.0  2.2 2.0
assign (resid 34   and name HG1#  )(resid 47   and name HE#   )     4.0  2.2 3.0
assign (resid 34   and name HG2#  )(resid 47   and name HE#   )     4.0  2.2 3.0
!D35
assign (resid 35   and name HN    )(resid 35   and name HA    )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 35   and name HB2   )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 35   and name HB1   )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 38   and name HB#   )     4.0  2.2 2.0
assign (resid 35   and name HN    )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 38   and name HE22  )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 35   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
!assign (resid 35   and name HB2   )(resid 35   and name HB1   )     2.5  0.7 0.4
!assign (resid 35   and name HB1   )(resid 35   and name HB2   )     2.5  0.7 0.4
assign (resid 35   and name HB#   )(resid 36   and name HN    )     4.0  2.2 2.0
assign (resid 35   and name HB#   )(resid 37   and name HN    )     4.0  2.2 2.0
assign (resid 35   and name HB#   )(resid 38   and name HE22  )     4.0  2.2 2.0
!D36
assign (resid 36   and name HN    )(resid 36   and name HA    )     4.0  2.2 1.0
!assign (resid 36   and name HA    )(resid 36   and name HB#   )     3.0  1.2 1.5
assign (resid 36   and name HA    )(resid 37   and name HN    )     4.0  2.2 1.0
assign (resid 36   and name HB#   )(resid 37   and name HN    )     4.0  2.2 2.0
!S37
assign (resid 37   and name HN    )(resid 37   and name HA    )     4.0  2.2 1.0
assign (resid 37   and name HN    )(resid 37   and name HB2   )     4.0  2.2 1.0
assign (resid 37   and name HN    )(resid 37   and name HB1   )     4.0  2.2 1.0
assign (resid 37   and name HN    )(resid 38   and name HN    )     3.0  1.2 0.5
assign (resid 37   and name HN    )(resid 38   and name HB#   )     4.0  2.2 2.0
assign (resid 37   and name HN    )(resid 38   and name HG#   )     4.0  2.2 2.0
!assign (resid 37   and name HA    )(resid 37   and name HB2   )     4.0  2.2 1.0
!assign (resid 37   and name HA    )(resid 37   and name HB1   )     4.0  2.2 1.0
assign (resid 37   and name HA    )(resid 38   and name HN    )     4.0  2.2 1.0
assign (resid 37   and name HB#   )(resid 38   and name HN    )     4.0  2.2 2.0
!Q38
assign (resid 38   and name HN    )(resid 38   and name HA    )     4.0  2.2 1.0
assign (resid 38   and name HN    )(resid 38   and name HB2   )     4.0  2.2 1.0
assign (resid 38   and name HN    )(resid 38   and name HB1   )     4.0  2.2 1.0
assign (resid 38   and name HN    )(resid 38   and name HG#   )     4.0  2.2 2.0
assign (resid 38   and name HN    )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 38   and name HN    )(resid 39   and name HD2   )     4.0  2.2 1.0
assign (resid 38   and name HN    )(resid 39   and name HD1   )     4.0  2.2 1.0
assign (resid 38   and name HA    )(resid 39   and name HD#   )     4.0  2.2 2.0
!assign (resid 38   and name HB2   )(resid 38   and name HB1   )     4.0  2.2 1.0
!assign (resid 38   and name HB1   )(resid 38   and name HB2   )     4.0  2.2 1.0
!assign (resid 38   and name HB2   )(resid 38   and name HG#   )     4.0  2.2 2.0
!assign (resid 38   and name HB1   )(resid 38   and name HG#   )     4.0  2.2 2.0
assign (resid 38   and name HB2   )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 38   and name HE22  )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 38   and name HE22  )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 39   and name HD2   )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 39   and name HD1   )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 39   and name HD2   )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 39   and name HD1   )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 42   and name HB    )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 42   and name HB    )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 38   and name HB1   )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 38   and name HB2   )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 38   and name HB2   )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 38   and name HB1   )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 38   and name HG#   )(resid 38   and name HE21  )     4.0  2.2 2.0
assign (resid 38   and name HG#   )(resid 42   and name HG2#  )     4.0  2.2 3.0
assign (resid 38   and name HG#   )(resid 43   and name HD22  )     4.0  2.2 2.0
!assign (resid 38   and name HE21  )(resid 38   and name HE22  )     4.0  2.2 1.0
!assign (resid 38   and name HE22  )(resid 38   and name HE21  )     4.0  2.2 1.0
assign (resid 38   and name HE21  )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 38   and name HE22  )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 38   and name HE21  )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 38   and name HE21  )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 38   and name HE22  )(resid 46   and name HD1#  )     4.0  2.2 2.0
!P39
!assign (resid 39   and name HA    )(resid 39   and name HB2   )     4.0  2.2 1.0
!assign (resid 39   and name HA    )(resid 39   and name HB1   )     4.0  2.2 1.0
assign (resid 39   and name HA    )(resid 40   and name HN    )     2.5  0.7 0.4
assign (resid 39   and name HA    )(resid 40   and name HB#   )     4.0  2.2 2.0
assign (resid 39   and name HA    )(resid 41   and name HN    )     4.0  2.2 1.0
!assign (resid 39   and name HB2   )(resid 39   and name HB1   )     4.0  2.2 1.0
!assign (resid 39   and name HB1   )(resid 39   and name HB2   )     4.0  2.2 1.0
!assign (resid 39   and name HB2   )(resid 39   and name HG2   )     4.0  2.2 1.0
!assign (resid 39   and name HB2   )(resid 39   and name HG1   )     4.0  2.2 1.0
!assign (resid 39   and name HB1   )(resid 39   and name HG2   )     4.0  2.2 1.0
!assign (resid 39   and name HB1   )(resid 39   and name HG1   )     4.0  2.2 1.0
!assign (resid 39   and name HB2   )(resid 39   and name HD#   )     4.0  2.2 2.0
!assign (resid 39   and name HB1   )(resid 39   and name HD#   )     4.0  2.2 2.0
assign (resid 39   and name HB2   )(resid 40   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB1   )(resid 40   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB2   )(resid 41   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB1   )(resid 41   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB2   )(resid 41   and name HB#   )     4.0  2.2 2.0
assign (resid 39   and name HB1   )(resid 41   and name HB#   )     4.0  2.2 2.0
assign (resid 39   and name HB2   )(resid 41   and name HD#   )     4.0  2.2 3.0
assign (resid 39   and name HB1   )(resid 41   and name HD#   )     4.0  2.2 3.0
assign (resid 39   and name HB2   )(resid 42   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB1   )(resid 42   and name HN    )     4.0  2.2 1.0
assign (resid 39   and name HB#   )(resid 42   and name HB    )     4.0  2.2 2.0
assign (resid 39   and name HB2   )(resid 42   and name HG1#  )     4.0  2.2 2.0
assign (resid 39   and name HB1   )(resid 42   and name HG1#  )     4.0  2.2 2.0
assign (resid 39   and name HB#   )(resid 42   and name HG2#  )     4.0  2.2 3.0
assign (resid 39   and name HB#   )(resid 42   and name HD1#  )     4.0  2.2 3.0
assign (resid 39   and name HB2   )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 39   and name HB1   )(resid 81   and name HG1#  )     4.0  2.2 2.0
!assign (resid 39   and name HG2   )(resid 39   and name HD2   )     4.0  2.2 1.0
!assign (resid 39   and name HG2   )(resid 39   and name HD1   )     4.0  2.2 1.0
!assign (resid 39   and name HG1   )(resid 39   and name HD2   )     4.0  2.2 1.0
!assign (resid 39   and name HG1   )(resid 39   and name HD1   )     4.0  2.2 1.0
assign (resid 39   and name HG#   )(resid 42   and name HG12  )     4.0  2.2 2.0
assign (resid 39   and name HG#   )(resid 42   and name HG11  )     4.0  2.2 2.0
assign (resid 39   and name HG#   )(resid 42   and name HD1#  )     4.0  2.2 3.0
!assign (resid 39   and name HD2   )(resid 39   and name HD1   )     4.0  2.2 1.0
!assign (resid 39   and name HD1   )(resid 39   and name HD2   )     4.0  2.2 1.0
assign (resid 39   and name HD2   )(resid 42   and name HB    )     4.0  2.2 1.0
assign (resid 39   and name HD1   )(resid 42   and name HB    )     4.0  2.2 1.0
assign (resid 39   and name HD2   )(resid 42   and name HG12  )     4.0  2.2 1.0
assign (resid 39   and name HD2   )(resid 42   and name HG11  )     4.0  2.2 1.0
assign (resid 39   and name HD1   )(resid 42   and name HG12  )     4.0  2.2 1.0
assign (resid 39   and name HD1   )(resid 42   and name HG11  )     4.0  2.2 1.0
assign (resid 39   and name HD2   )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 39   and name HD1   )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 39   and name HD#   )(resid 42   and name HD1#  )     4.0  2.2 3.0
assign (resid 39   and name HD#   )(resid 81   and name HG1#  )     4.0  2.2 3.0
!A40
assign (resid 40   and name HN    )(resid 40   and name HA    )     4.0  2.2 1.0
assign (resid 40   and name HN    )(resid 40   and name HB#   )     4.0  2.2 1.6
assign (resid 40   and name HN    )(resid 41   and name HN    )     4.0  2.2 1.0
!assign (resid 40   and name HA    )(resid 40   and name HB#   )     4.0  2.2 1.2
assign (resid 40   and name HA    )(resid 41   and name HN    )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 43   and name HN    )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 43   and name HB2   )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 43   and name HB1   )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 40   and name HA    )(resid 44   and name HN    )     4.0  2.2 1.0
assign (resid 40   and name HB#   )(resid 41   and name HN    )     4.0  2.2 2.0
assign (resid 40   and name HB#   )(resid 41   and name HB#   )     4.0  2.2 3.0
assign (resid 40   and name HB#   )(resid 41   and name HD#   )     4.0  2.2 4.0
assign (resid 40   and name HB#   )(resid 44   and name HN    )     4.0  2.2 2.0
!F41
assign (resid 41   and name HN    )(resid 41   and name HA    )     3.0  1.2 0.5
assign (resid 41   and name HN    )(resid 41   and name HB2   )     4.0  2.2 1.0
assign (resid 41   and name HN    )(resid 41   and name HB1   )     4.0  2.2 1.0
assign (resid 41   and name HN    )(resid 41   and name HD#   )     4.0  2.2 3.0
assign (resid 41   and name HN    )(resid 42   and name HN    )     4.0  2.2 1.0
assign (resid 41   and name HN    )(resid 81   and name HG1#  )     4.0  2.2 2.0
!assign (resid 41   and name HA    )(resid 41   and name HB#   )     4.0  2.2 2.0
assign (resid 41   and name HA    )(resid 41   and name HD#   )     4.0  2.2 2.0
assign (resid 41   and name HA    )(resid 42   and name HN    )     4.0  2.2 1.0
assign (resid 41   and name HA    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 41   and name HB2   )(resid 41   and name HD#   )     4.0  2.2 3.0
assign (resid 41   and name HB1   )(resid 41   and name HD#   )     4.0  2.2 3.0
assign (resid 41   and name HB#   )(resid 42   and name HN    )     4.0  2.2 2.0
assign (resid 41   and name HB#   )(resid 81   and name HG1#  )     4.0  2.2 3.0
assign (resid 41   and name HD#   )(resid 42   and name HG1#  )     4.0  2.2 4.0
assign (resid 41   and name HD#   )(resid 81   and name HG1#  )     4.0  2.2 4.0
assign (resid 41   and name HD#   )(resid 84   and name HD1#  )     4.0  2.2 4.0
!assign (resid 41   and name HE#   )(resid 41   and name HZ    )     4.0  2.2 3.0
assign (resid 41   and name HE#   )(resid 84   and name HD1#  )     4.0  2.2 4.0
assign (resid 41   and name HE#   )(resid 84   and name HD2#  )     4.0  2.2 4.0
assign (resid 41   and name HZ    )(resid 84   and name HD1#  )     4.0  2.2 2.0
!I42
assign (resid 42   and name HN    )(resid 42   and name HA    )     4.0  2.2 1.0
assign (resid 42   and name HN    )(resid 42   and name HB    )     3.0  1.2 0.5
assign (resid 42   and name HN    )(resid 42   and name HG12  )     4.0  2.2 1.0
assign (resid 42   and name HN    )(resid 42   and name HG11  )     4.0  2.2 1.0
assign (resid 42   and name HN    )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 42   and name HN    )(resid 42   and name HD1#  )     4.0  2.2 2.0
assign (resid 42   and name HN    )(resid 43   and name HN    )     3.0  1.2 0.5
!assign (resid 42   and name HA    )(resid 42   and name HB    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 42   and name HG12  )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 42   and name HG11  )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 42   and name HG2#  )     4.0  2.2 1.6
assign (resid 42   and name HA    )(resid 42   and name HD1#  )     4.0  2.2 2.0
assign (resid 42   and name HA    )(resid 43   and name HN    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 43   and name HA    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 45   and name HN    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 45   and name HB    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 45   and name HD1#  )     4.0  2.2 2.0
assign (resid 42   and name HA    )(resid 46   and name HN    )     4.0  2.2 1.0
assign (resid 42   and name HA    )(resid 54   and name HD1#  )     4.0  2.2 2.0
!assign (resid 42   and name HB    )(resid 42   and name HG12  )     4.0  2.2 1.0
!assign (resid 42   and name HB    )(resid 42   and name HG11  )     4.0  2.2 1.0
!assign (resid 42   and name HB    )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 42   and name HB    )(resid 42   and name HD1#  )     4.0  2.2 2.0
assign (resid 42   and name HB    )(resid 43   and name HN    )     4.0  2.2 1.0
!assign (resid 42   and name HG12  )(resid 42   and name HG11  )     4.0  2.2 1.0
!assign (resid 42   and name HG11  )(resid 42   and name HG12  )     4.0  2.2 1.0
assign (resid 42   and name HG12  )(resid 42   and name HG2#  )     4.0  2.2 2.0
assign (resid 42   and name HG11  )(resid 42   and name HG2#  )     4.0  2.2 2.0
!assign (resid 42   and name HG12  )(resid 42   and name HD1#  )     4.0  2.2 2.0
!assign (resid 42   and name HG11  )(resid 42   and name HD1#  )     4.0  2.2 2.0
assign (resid 42   and name HG1#  )(resid 43   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HG1#  )(resid 45   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HG1#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HG1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 42   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HG2#  )(resid 43   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 43   and name HA    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 43   and name HD22  )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 44   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 45   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 45   and name HB    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 46   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 46   and name HG    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 46   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HG2#  )(resid 54   and name HB    )     4.0  2.2 2.0
assign (resid 42   and name HG2#  )(resid 54   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HG2#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HG2#  )(resid 61   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 43   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HD1#  )(resid 45   and name HB    )     4.0  2.2 2.0
assign (resid 42   and name HD1#  )(resid 45   and name HG1#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 46   and name HN    )     4.0  2.2 2.0
assign (resid 42   and name HD1#  )(resid 54   and name HG1#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 54   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 61   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 61   and name HD1#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 63   and name HG2#  )     4.0  2.2 3.0
assign (resid 42   and name HD1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 42   and name HD1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!N43
assign (resid 43   and name HN    )(resid 43   and name HA    )     4.0  2.2 1.0
assign (resid 43   and name HN    )(resid 43   and name HB2   )     3.0  1.2 0.5
assign (resid 43   and name HN    )(resid 43   and name HB1   )     3.0  1.2 0.5
assign (resid 43   and name HN    )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 43   and name HN    )(resid 44   and name HN    )     3.0  1.2 0.5
!assign (resid 43   and name HA    )(resid 43   and name HB2   )     4.0  2.2 1.0
!assign (resid 43   and name HA    )(resid 43   and name HB1   )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 44   and name HN    )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 46   and name HN    )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 46   and name HB2   )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 46   and name HB1   )     4.0  2.2 1.0
assign (resid 43   and name HA    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 43   and name HA    )(resid 47   and name HN    )     4.0  2.2 1.0
assign (resid 43   and name HB2   )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 43   and name HB2   )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 43   and name HB1   )(resid 43   and name HD21  )     4.0  2.2 1.0
assign (resid 43   and name HB1   )(resid 43   and name HD22  )     4.0  2.2 1.0
assign (resid 43   and name HB#   )(resid 44   and name HA    )     4.0  2.2 2.0
assign (resid 43   and name HB#   )(resid 47   and name HD2   )     4.0  2.2 2.0
assign (resid 43   and name HB#   )(resid 47   and name HD1   )     4.0  2.2 2.0
!assign (resid 43   and name HD21  )(resid 43   and name HD22  )     4.0  2.2 1.0
!assign (resid 43   and name HD22  )(resid 43   and name HD21  )     4.0  2.2 1.0
!D44
assign (resid 44   and name HN    )(resid 44   and name HA    )     4.0  2.2 1.0
assign (resid 44   and name HN    )(resid 45   and name HN    )     3.0  1.2 0.5
assign (resid 44   and name HN    )(resid 45   and name HG1#  )     4.0  2.2 2.0
assign (resid 44   and name HN    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 44   and name HN    )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 44   and name HA    )(resid 45   and name HN    )     4.0  2.2 1.0
assign (resid 44   and name HA    )(resid 47   and name HN    )     4.0  2.2 1.0
assign (resid 44   and name HA    )(resid 47   and name HB#   )     3.0  1.2 1.5
assign (resid 44   and name HA    )(resid 47   and name HG#   )     4.0  2.2 2.0
assign (resid 44   and name HA    )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 44   and name HB#   )(resid 81   and name HG1#  )     4.0  2.2 3.0
!I45
assign (resid 45   and name HN    )(resid 45   and name HA    )     4.0  2.2 1.0
assign (resid 45   and name HN    )(resid 45   and name HB    )     3.0  1.2 0.5
assign (resid 45   and name HN    )(resid 45   and name HG12  )     4.0  2.2 1.0
assign (resid 45   and name HN    )(resid 45   and name HG11  )     4.0  2.2 1.0
assign (resid 45   and name HN    )(resid 45   and name HG2#  )     4.0  2.2 2.0
assign (resid 45   and name HN    )(resid 45   and name HD1#  )     4.0  2.2 2.0
assign (resid 45   and name HN    )(resid 46   and name HN    )     3.0  1.2 0.5
assign (resid 45   and name HN    )(resid 46   and name HG    )     4.0  2.2 1.0
assign (resid 45   and name HN    )(resid 54   and name HD1#  )     4.0  2.2 2.0
assign (resid 45   and name HN    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 45   and name HN    )(resid 81   and name HG2#  )     4.0  2.2 2.0
!assign (resid 45   and name HA    )(resid 45   and name HB    )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 45   and name HG12  )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 45   and name HG11  )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 45   and name HG2#  )     4.0  2.2 1.6
assign (resid 45   and name HA    )(resid 45   and name HD1#  )     4.0  2.2 2.0
assign (resid 45   and name HA    )(resid 46   and name HN    )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 47   and name HN    )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 48   and name HB    )     4.0  2.2 1.0
assign (resid 45   and name HA    )(resid 48   and name HG2#  )     4.0  2.2 2.0
!assign (resid 45   and name HB    )(resid 45   and name HG1#  )     4.0  2.2 2.0
!assign (resid 45   and name HB    )(resid 45   and name HG2#  )     4.0  2.2 2.0
assign (resid 45   and name HB    )(resid 45   and name HD1#  )     4.0  2.2 2.0
assign (resid 45   and name HB    )(resid 46   and name HN    )     4.0  2.2 1.0
assign (resid 45   and name HB    )(resid 54   and name HD1#  )     4.0  2.2 2.0
!assign (resid 45   and name HG12  )(resid 45   and name HG11  )     4.0  2.2 1.0
!assign (resid 45   and name HG11  )(resid 45   and name HG12  )     4.0  2.2 1.0
assign (resid 45   and name HG12  )(resid 45   and name HG2#  )     4.0  2.2 2.0
assign (resid 45   and name HG11  )(resid 45   and name HG2#  )     4.0  2.2 2.0
!assign (resid 45   and name HG1#  )(resid 45   and name HD1#  )     4.0  2.2 3.0
assign (resid 45   and name HG1#  )(resid 48   and name HG2#  )     4.0  2.2 3.0
assign (resid 45   and name HG1#  )(resid 77   and name HB#   )     4.0  2.2 3.0
assign (resid 45   and name HG12  )(resid 78   and name HA    )     4.0  2.2 1.0
assign (resid 45   and name HG11  )(resid 78   and name HA    )     4.0  2.2 1.0
assign (resid 45   and name HG1#  )(resid 78   and name HG1#  )     4.0  2.2 3.0
assign (resid 45   and name HG12  )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 45   and name HG12  )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 45   and name HG11  )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 45   and name HD1#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 46   and name HN    )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 46   and name HA    )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 46   and name HG    )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 46   and name HD2#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 48   and name HB    )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 51   and name HB    )     4.0  2.2 2.0
assign (resid 45   and name HG2#  )(resid 51   and name HG2#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 54   and name HG1#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 63   and name HG1#  )     4.0  2.2 3.0
assign (resid 45   and name HG2#  )(resid 78   and name HG2#  )     4.0  2.2 3.0
assign (resid 45   and name HD1#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 45   and name HD1#  )(resid 78   and name HA    )     4.0  2.2 2.0
assign (resid 45   and name HD1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 45   and name HD1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!L46
assign (resid 46   and name HN    )(resid 46   and name HA    )     4.0  2.2 1.0
assign (resid 46   and name HN    )(resid 46   and name HB2   )     4.0  2.2 1.0
assign (resid 46   and name HN    )(resid 46   and name HB1   )     4.0  2.2 1.0
assign (resid 46   and name HN    )(resid 46   and name HG    )     4.0  2.2 1.0
assign (resid 46   and name HN    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 46   and name HN    )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 46   and name HN    )(resid 47   and name HN    )     3.0  1.2 0.5
assign (resid 46   and name HN    )(resid 54   and name HD1#  )     4.0  2.2 2.0
!assign (resid 46   and name HA    )(resid 46   and name HB2   )     4.0  2.2 1.0
!assign (resid 46   and name HA    )(resid 46   and name HB1   )     4.0  2.2 1.0
assign (resid 46   and name HA    )(resid 46   and name HG    )     4.0  2.2 1.0
assign (resid 46   and name HA    )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 46   and name HA    )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 46   and name HA    )(resid 47   and name HN    )     4.0  2.2 1.0
assign (resid 46   and name HA    )(resid 51   and name HB    )     4.0  2.2 1.0
assign (resid 46   and name HA    )(resid 51   and name HG1#  )     4.0  2.2 2.0
assign (resid 46   and name HA    )(resid 54   and name HD1#  )     4.0  2.2 2.0
!assign (resid 46   and name HB2   )(resid 46   and name HB1   )     2.5  0.7 0.4
!assign (resid 46   and name HB1   )(resid 46   and name HB2   )     2.5  0.7 0.4
!assign (resid 46   and name HB2   )(resid 46   and name HG    )     4.0  2.2 1.0
!assign (resid 46   and name HB1   )(resid 46   and name HG    )     4.0  2.2 1.0
assign (resid 46   and name HB2   )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 46   and name HB2   )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 46   and name HB1   )(resid 46   and name HD1#  )     4.0  2.2 2.0
assign (resid 46   and name HB1   )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 46   and name HB#   )(resid 47   and name HN    )     4.0  2.2 2.0
assign (resid 46   and name HB#   )(resid 47   and name HG#   )     4.0  2.2 3.0
assign (resid 46   and name HB#   )(resid 47   and name HD#   )     4.0  2.2 3.0
assign (resid 46   and name HB#   )(resid 51   and name HG1#  )     4.0  2.2 3.0
!assign (resid 46   and name HG    )(resid 46   and name HD1#  )     4.0  2.2 2.0
!assign (resid 46   and name HG    )(resid 46   and name HD2#  )     4.0  2.2 2.0
assign (resid 46   and name HG    )(resid 54   and name HD1#  )     4.0  2.2 2.0
assign (resid 46   and name HD2#  )(resid 51   and name HG1#  )     4.0  2.2 3.0
assign (resid 46   and name HD2#  )(resid 53   and name HN    )     4.0  2.2 2.0
assign (resid 46   and name HD2#  )(resid 54   and name HN    )     4.0  2.2 2.0
assign (resid 46   and name HD2#  )(resid 54   and name HB    )     4.0  2.2 2.0
assign (resid 46   and name HD2#  )(resid 54   and name HG12  )     4.0  2.2 2.0
assign (resid 46   and name HD2#  )(resid 54   and name HG11  )     4.0  2.2 2.0
assign (resid 46   and name HD1#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
assign (resid 46   and name HD2#  )(resid 54   and name HD1#  )     4.0  2.2 3.0
!K47
assign (resid 47   and name HN    )(resid 47   and name HA    )     3.0  1.2 0.5
assign (resid 47   and name HN    )(resid 47   and name HB2   )     4.0  2.2 1.0
assign (resid 47   and name HN    )(resid 47   and name HB1   )     4.0  2.2 1.0
assign (resid 47   and name HN    )(resid 47   and name HG2   )     4.0  2.2 1.0
assign (resid 47   and name HN    )(resid 47   and name HG1   )     4.0  2.2 1.0
assign (resid 47   and name HN    )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 47   and name HN    )(resid 48   and name HN    )     3.0  1.2 0.5
assign (resid 47   and name HN    )(resid 48   and name HG2#  )     4.0  2.2 2.0
!assign (resid 47   and name HA    )(resid 47   and name HB2   )     4.0  2.2 1.0
!assign (resid 47   and name HA    )(resid 47   and name HB1   )     4.0  2.2 1.0
assign (resid 47   and name HA    )(resid 47   and name HG2   )     4.0  2.2 1.0
assign (resid 47   and name HA    )(resid 47   and name HG1   )     4.0  2.2 1.0
assign (resid 47   and name HA    )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 47   and name HA    )(resid 48   and name HN    )     4.0  2.2 1.0
!assign (resid 47   and name HB2   )(resid 47   and name HB1   )     4.0  2.2 1.0
!assign (resid 47   and name HB1   )(resid 47   and name HB2   )     4.0  2.2 1.0
!assign (resid 47   and name HB2   )(resid 47   and name HG2   )     4.0  2.2 1.0
!assign (resid 47   and name HB2   )(resid 47   and name HG1   )     4.0  2.2 1.0
!assign (resid 47   and name HB1   )(resid 47   and name HG2   )     4.0  2.2 1.0
!assign (resid 47   and name HB1   )(resid 47   and name HG1   )     4.0  2.2 1.0
assign (resid 47   and name HB2   )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 47   and name HB1   )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 47   and name HB#   )(resid 47   and name HE#   )     4.0  2.2 3.0
assign (resid 47   and name HB2   )(resid 48   and name HN    )     4.0  2.2 1.0
assign (resid 47   and name HB1   )(resid 48   and name HN    )     4.0  2.2 1.0
assign (resid 47   and name HB#   )(resid 48   and name HA    )     4.0  2.2 2.0
!assign (resid 47   and name HG2   )(resid 47   and name HG1   )     4.0  2.2 1.0
!assign (resid 47   and name HG1   )(resid 47   and name HG2   )     4.0  2.2 1.0
!assign (resid 47   and name HG2   )(resid 47   and name HD#   )     4.0  2.2 2.0
!assign (resid 47   and name HG1   )(resid 47   and name HD#   )     4.0  2.2 2.0
assign (resid 47   and name HG2   )(resid 47   and name HE#   )     4.0  2.2 2.0
assign (resid 47   and name HG1   )(resid 47   and name HE#   )     4.0  2.2 2.0
!assign (resid 47   and name HD2   )(resid 47   and name HE#   )     4.0  2.2 2.0
!assign (resid 47   and name HD1   )(resid 47   and name HE#   )     4.0  2.2 2.0
!V48
assign (resid 48   and name HN    )(resid 48   and name HA    )     3.0  1.2 0.5
assign (resid 48   and name HN    )(resid 48   and name HB    )     3.0  1.2 0.5
assign (resid 48   and name HN    )(resid 48   and name HG2#  )     4.0  2.2 2.0
assign (resid 48   and name HN    )(resid 49   and name HN    )     4.0  2.2 1.0
assign (resid 48   and name HN    )(resid 51   and name HG2#  )     4.0  2.2 2.0
!assign (resid 48   and name HA    )(resid 48   and name HB    )     4.0  2.2 1.0
assign (resid 48   and name HA    )(resid 48   and name HG1#  )     4.0  2.2 2.0
assign (resid 48   and name HA    )(resid 48   and name HG2#  )     4.0  2.2 2.0
assign (resid 48   and name HA    )(resid 49   and name HN    )     2.5  0.7 0.4
assign (resid 48   and name HA    )(resid 49   and name HA    )     4.0  2.2 1.0
assign (resid 48   and name HA    )(resid 49   and name HB#   )     4.0  2.2 2.0
assign (resid 48   and name HA    )(resid 49   and name HG#   )     4.0  2.2 2.0
!assign (resid 48   and name HB    )(resid 48   and name HG1#  )     4.0  2.2 2.0
!assign (resid 48   and name HB    )(resid 48   and name HG2#  )     4.0  2.2 2.0
assign (resid 48   and name HB    )(resid 49   and name HN    )     4.0  2.2 1.0
assign (resid 48   and name HB    )(resid 51   and name HG1#  )     4.0  2.2 2.0
assign (resid 48   and name HB    )(resid 51   and name HG2#  )     4.0  2.2 2.0
!assign (resid 48   and name HG1#  )(resid 48   and name HG2#  )     4.0  2.2 3.0
assign (resid 48   and name HG1#  )(resid 49   and name HN    )     4.0  2.2 2.0
assign (resid 48   and name HG2#  )(resid 49   and name HN    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 49   and name HA    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 50   and name HN    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 51   and name HN    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 51   and name HG2#  )     4.0  2.2 3.0
assign (resid 48   and name HG1#  )(resid 74   and name HA    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 74   and name HG2#  )     4.0  2.2 3.0
assign (resid 48   and name HG1#  )(resid 77   and name HN    )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 77   and name HB2   )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 77   and name HB1   )     4.0  2.2 2.0
assign (resid 48   and name HG2#  )(resid 77   and name HB2   )     4.0  2.2 2.0
assign (resid 48   and name HG2#  )(resid 77   and name HB1   )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 77   and name HG2   )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 77   and name HG1   )     4.0  2.2 2.0
assign (resid 48   and name HG2#  )(resid 77   and name HG2   )     4.0  2.2 2.0
assign (resid 48   and name HG2#  )(resid 77   and name HG1   )     4.0  2.2 2.0
assign (resid 48   and name HG1#  )(resid 77   and name HD#   )     4.0  2.2 3.0
assign (resid 48   and name HG2#  )(resid 77   and name HD#   )     4.0  2.2 3.0
assign (resid 48   and name HG1#  )(resid 77   and name HE#   )     4.0  2.2 3.0
assign (resid 48   and name HG1#  )(resid 78   and name HN    )     4.0  2.2 2.0
!E49
assign (resid 49   and name HN    )(resid 49   and name HA    )     3.0  1.2 0.5
assign (resid 49   and name HN    )(resid 49   and name HB#   )     3.0  1.2 1.5
assign (resid 49   and name HN    )(resid 49   and name HG#   )     4.0  2.2 2.0
!assign (resid 49   and name HA    )(resid 49   and name HB2   )     4.0  2.2 1.0
!assign (resid 49   and name HA    )(resid 49   and name HB1   )     4.0  2.2 1.0
assign (resid 49   and name HA    )(resid 49   and name HG#   )     4.0  2.2 2.0
assign (resid 49   and name HA    )(resid 50   and name HN    )     2.5  0.7 0.4
assign (resid 49   and name HA    )(resid 50   and name HA#   )     4.0  2.2 1.6
assign (resid 49   and name HA    )(resid 51   and name HN    )     4.0  2.2 1.0
!assign (resid 49   and name HB#   )(resid 49   and name HG#   )     4.0  2.2 3.0
assign (resid 49   and name HB#   )(resid 50   and name HN    )     4.0  2.2 2.0
assign (resid 49   and name HG#   )(resid 50   and name HN    )     4.0  2.2 2.0
!G50
assign (resid 50   and name HN    )(resid 50   and name HA2   )     4.0  2.2 1.0
assign (resid 50   and name HN    )(resid 50   and name HA1   )     4.0  2.2 1.0
assign (resid 50   and name HN    )(resid 51   and name HN    )     3.0  1.2 0.5
assign (resid 50   and name HN    )(resid 51   and name HG2#  )     4.0  2.2 2.0
assign (resid 50   and name HN    )(resid 69   and name HB#   )     4.0  2.2 2.0
!assign (resid 50   and name HA2   )(resid 50   and name HA1   )     2.5  0.7 0.4
!assign (resid 50   and name HA1   )(resid 50   and name HA2   )     2.5  0.7 0.4
assign (resid 50   and name HA2   )(resid 51   and name HN    )     4.0  2.2 1.0
assign (resid 50   and name HA1   )(resid 51   and name HN    )     4.0  2.2 1.0
assign (resid 50   and name HA#   )(resid 66   and name HN    )     4.0  2.2 2.0
assign (resid 50   and name HA#   )(resid 66   and name HB#   )     4.0  2.2 3.0
assign (resid 50   and name HA#   )(resid 66   and name HG2   )     4.0  2.2 2.0
assign (resid 50   and name HA#   )(resid 66   and name HG1   )     4.0  2.2 2.0
assign (resid 50   and name HA2   )(resid 69   and name HB#   )     4.0  2.2 2.0
assign (resid 50   and name HA1   )(resid 69   and name HB#   )     4.0  2.2 2.0
assign (resid 50   and name HA2   )(resid 74   and name HG2#  )     4.0  2.2 2.0
assign (resid 50   and name HA1   )(resid 74   and name HG2#  )     4.0  2.2 2.0
!V51
assign (resid 51   and name HN    )(resid 51   and name HA    )     4.0  2.2 1.0
assign (resid 51   and name HN    )(resid 51   and name HB    )     3.0  1.2 0.5
assign (resid 51   and name HN    )(resid 51   and name HG2#  )     4.0  2.2 2.0
assign (resid 51   and name HN    )(resid 74   and name HG2#  )     4.0  2.2 2.0
!assign (resid 51   and name HA    )(resid 51   and name HB    )     4.0  2.2 1.0
assign (resid 51   and name HA    )(resid 51   and name HG1#  )     4.0  2.2 2.0
assign (resid 51   and name HA    )(resid 51   and name HG2#  )     4.0  2.2 2.0
assign (resid 51   and name HA    )(resid 52   and name HN    )     3.0  1.2 0.5
assign (resid 51   and name HA    )(resid 65   and name HA    )     4.0  2.2 1.0
assign (resid 51   and name HA    )(resid 66   and name HN    )     4.0  2.2 1.0
!assign (resid 51   and name HB    )(resid 51   and name HG1#  )     4.0  2.2 2.0
!assign (resid 51   and name HB    )(resid 51   and name HG2#  )     4.0  2.2 2.0
assign (resid 51   and name HB    )(resid 52   and name HN    )     4.0  2.2 1.0
!assign (resid 51   and name HG1#  )(resid 51   and name HG2#  )     4.0  2.2 3.0
assign (resid 51   and name HG1#  )(resid 52   and name HN    )     4.0  2.2 2.0
assign (resid 51   and name HG2#  )(resid 52   and name HN    )     4.0  2.2 2.0
assign (resid 51   and name HG1#  )(resid 53   and name HN    )     4.0  2.2 2.0
assign (resid 51   and name HG1#  )(resid 63   and name HG1#  )     4.0  2.2 3.0
assign (resid 51   and name HG2#  )(resid 63   and name HG1#  )     4.0  2.2 3.0
assign (resid 51   and name HG1#  )(resid 64   and name HN    )     4.0  2.2 2.0
assign (resid 51   and name HG1#  )(resid 65   and name HA    )     4.0  2.2 2.0
assign (resid 51   and name HG2#  )(resid 74   and name HG2#  )     4.0  2.2 3.0
!K52
assign (resid 52   and name HN    )(resid 52   and name HA    )     4.0  2.2 1.0
assign (resid 52   and name HN    )(resid 52   and name HB2   )     4.0  2.2 1.0
assign (resid 52   and name HN    )(resid 52   and name HB1   )     4.0  2.2 1.0
assign (resid 52   and name HN    )(resid 53   and name HN    )     3.0  1.2 0.5
assign (resid 52   and name HN    )(resid 64   and name HB#   )     4.0  2.2 2.0
assign (resid 52   and name HN    )(resid 65   and name HA    )     4.0  2.2 1.0
assign (resid 52   and name HN    )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 52   and name HA    )(resid 53   and name HN    )     4.0  2.2 1.0
!assign (resid 52   and name HB2   )(resid 52   and name HB1   )     3.0  1.2 0.5
!assign (resid 52   and name HB1   )(resid 52   and name HB2   )     3.0  1.2 0.5
!assign (resid 52   and name HB#   )(resid 52   and name HG#   )     4.0  2.2 3.0
assign (resid 52   and name HB#   )(resid 52   and name HD#   )     4.0  2.2 3.0
assign (resid 52   and name HB2   )(resid 52   and name HE#   )     4.0  2.2 2.0
assign (resid 52   and name HB1   )(resid 52   and name HE#   )     4.0  2.2 2.0
assign (resid 52   and name HB2   )(resid 53   and name HN    )     4.0  2.2 1.0
assign (resid 52   and name HB1   )(resid 53   and name HN    )     4.0  2.2 1.0
assign (resid 52   and name HB#   )(resid 64   and name HB2   )     4.0  2.2 2.0
assign (resid 52   and name HB#   )(resid 64   and name HB1   )     4.0  2.2 2.0
assign (resid 52   and name HB#   )(resid 66   and name HG#   )     4.0  2.2 3.0
!assign (resid 52   and name HG#   )(resid 52   and name HD#   )     4.0  2.2 3.0
assign (resid 52   and name HG2   )(resid 52   and name HE#   )     4.0  2.2 2.0
assign (resid 52   and name HG1   )(resid 52   and name HE#   )     4.0  2.2 2.0
!assign (resid 52   and name HD#   )(resid 52   and name HE#   )     4.0  2.2 3.0
assign (resid 52   and name HE#   )(resid 64   and name HB#   )     4.0  2.2 3.0
assign (resid 52   and name HE#   )(resid 66   and name HB#   )     4.0  2.2 3.0
!S53
assign (resid 53   and name HN    )(resid 53   and name HA    )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 53   and name HB2   )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 53   and name HB1   )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 63   and name HG1#  )     4.0  2.2 2.0
assign (resid 53   and name HN    )(resid 64   and name HN    )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 64   and name HB2   )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 64   and name HB1   )     4.0  2.2 1.0
assign (resid 53   and name HN    )(resid 65   and name HA    )     4.0  2.2 1.0
assign (resid 53   and name HA    )(resid 54   and name HN    )     2.5  0.7 0.4
assign (resid 53   and name HB2   )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 53   and name HB1   )(resid 54   and name HN    )     4.0  2.2 1.0
assign (resid 53   and name HB#   )(resid 64   and name HB#   )     4.0  2.2 3.0
!I54
assign (resid 54   and name HN    )(resid 54   and name HA    )     4.0  2.2 1.0
assign (resid 54   and name HN    )(resid 54   and name HB    )     4.0  2.2 1.0
assign (resid 54   and name HN    )(resid 54   and name HG1#  )     4.0  2.2 2.0
assign (resid 54   and name HN    )(resid 54   and name HG2#  )     4.0  2.2 2.0
assign (resid 54   and name HN    )(resid 54   and name HD1#  )     4.0  2.2 2.0
assign (resid 54   and name HN    )(resid 55   and name HN    )     4.0  2.2 1.0
assign (resid 54   and name HA    )(resid 54   and name HG2#  )     4.0  2.2 1.6
assign (resid 54   and name HA    )(resid 55   and name HN    )     2.5  0.7 0.4
assign (resid 54   and name HA    )(resid 64   and name HN    )     4.0  2.2 1.0
!assign (resid 54   and name HB    )(resid 54   and name HG1#  )     4.0  2.2 2.0
!assign (resid 54   and name HB    )(resid 54   and name HG2#  )     4.0  2.2 2.0
assign (resid 54   and name HB    )(resid 54   and name HD1#  )     4.0  2.2 2.0
assign (resid 54   and name HB    )(resid 55   and name HN    )     4.0  2.2 1.0
!assign (resid 54   and name HG12  )(resid 54   and name HG11  )     4.0  2.2 1.0
!assign (resid 54   and name HG11  )(resid 54   and name HG12  )     4.0  2.2 1.0
assign (resid 54   and name HG12  )(resid 54   and name HG2#  )     4.0  2.2 2.0
assign (resid 54   and name HG11  )(resid 54   and name HG2#  )     4.0  2.2 2.0
!assign (resid 54   and name HG12  )(resid 54   and name HD1#  )     4.0  2.2 2.0
!assign (resid 54   and name HG11  )(resid 54   and name HD1#  )     4.0  2.2 2.0
assign (resid 54   and name HG1#  )(resid 55   and name HN    )     4.0  2.2 2.0
assign (resid 54   and name HG1#  )(resid 61   and name HG2#  )     4.0  2.2 3.0
assign (resid 54   and name HG1#  )(resid 63   and name HG1#  )     4.0  2.2 3.0
assign (resid 54   and name HG1#  )(resid 63   and name HG2#  )     4.0  2.2 3.0
assign (resid 54   and name HG2#  )(resid 55   and name HN    )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 55   and name HA    )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 56   and name HN    )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 56   and name HB2   )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 56   and name HB1   )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 61   and name HA    )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 61   and name HB    )     4.0  2.2 2.0
assign (resid 54   and name HG2#  )(resid 62   and name HN    )     4.0  2.2 2.0
!F55
assign (resid 55   and name HN    )(resid 55   and name HA    )     4.0  2.2 1.0
assign (resid 55   and name HN    )(resid 55   and name HB2   )     4.0  2.2 1.0
assign (resid 55   and name HN    )(resid 55   and name HB1   )     4.0  2.2 1.0
assign (resid 55   and name HN    )(resid 56   and name HN    )     4.0  2.2 1.0
assign (resid 55   and name HN    )(resid 62   and name HN    )     4.0  2.2 1.0
assign (resid 55   and name HN    )(resid 62   and name HB#   )     4.0  2.2 2.0
assign (resid 55   and name HN    )(resid 63   and name HA    )     4.0  2.2 1.0
!assign (resid 55   and name HA    )(resid 55   and name HB2   )     4.0  2.2 1.0
!assign (resid 55   and name HA    )(resid 55   and name HB1   )     4.0  2.2 1.0
assign (resid 55   and name HA    )(resid 55   and name HD#   )     4.0  2.2 2.0
assign (resid 55   and name HA    )(resid 56   and name HN    )     3.0  1.2 0.5
assign (resid 55   and name HB2   )(resid 55   and name HD#   )     4.0  2.2 3.0
assign (resid 55   and name HB1   )(resid 55   and name HD#   )     4.0  2.2 3.0
assign (resid 55   and name HB#   )(resid 56   and name HN    )     4.0  2.2 2.0
assign (resid 55   and name HB#   )(resid 62   and name HN    )     4.0  2.2 2.0
assign (resid 55   and name HB2   )(resid 62   and name HB#   )     4.0  2.2 2.0
assign (resid 55   and name HB1   )(resid 62   and name HB#   )     4.0  2.2 2.0
!assign (resid 55   and name HD#   )(resid 55   and name HE#   )     4.0  2.2 5.0
assign (resid 55   and name HD#   )(resid 56   and name HN    )     4.0  2.2 3.0
assign (resid 55   and name HD#   )(resid 57   and name HG1#  )     4.0  2.2 4.0
assign (resid 55   and name HD#   )(resid 62   and name HB#   )     4.0  2.2 4.0
!assign (resid 55   and name HE#   )(resid 55   and name HZ    )     4.0  2.2 3.0
assign (resid 55   and name HE#   )(resid 57   and name HB    )     4.0  2.2 3.0
assign (resid 55   and name HE#   )(resid 57   and name HG1#  )     4.0  2.2 4.0
assign (resid 55   and name HE#   )(resid 57   and name HG2#  )     4.0  2.2 4.0
assign (resid 55   and name HE#   )(resid 60   and name HZ    )     4.0  2.2 3.0
assign (resid 55   and name HZ    )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 55   and name HZ    )(resid 57   and name HG2#  )     4.0  2.2 2.0
!H56
assign (resid 56   and name HN    )(resid 56   and name HA    )     4.0  2.2 1.0
assign (resid 56   and name HN    )(resid 56   and name HB2   )     4.0  2.2 1.0
assign (resid 56   and name HN    )(resid 56   and name HB1   )     4.0  2.2 1.0
assign (resid 56   and name HN    )(resid 61   and name HG2#  )     4.0  2.2 2.0
!assign (resid 56   and name HA    )(resid 56   and name HB2   )     4.0  2.2 1.0
!assign (resid 56   and name HA    )(resid 56   and name HB1   )     4.0  2.2 1.0
assign (resid 56   and name HA    )(resid 56   and name HD2   )     4.0  2.2 1.0
assign (resid 56   and name HA    )(resid 57   and name HN    )     3.0  1.2 0.5
assign (resid 56   and name HA    )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 56   and name HA    )(resid 61   and name HA    )     4.0  2.2 1.0
assign (resid 56   and name HA    )(resid 61   and name HG2#  )     4.0  2.2 2.0
!assign (resid 56   and name HB2   )(resid 56   and name HB1   )     2.5  0.7 0.4
!assign (resid 56   and name HB1   )(resid 56   and name HB2   )     2.5  0.7 0.4
assign (resid 56   and name HB#   )(resid 56   and name HD2   )     4.0  2.2 2.0
assign (resid 56   and name HB#   )(resid 57   and name HN    )     4.0  2.2 2.0
assign (resid 56   and name HB2   )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 56   and name HB1   )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 56   and name HD2   )(resid 57   and name HN    )     4.0  2.2 1.0
assign (resid 56   and name HD2   )(resid 57   and name HA    )     4.0  2.2 1.0
assign (resid 56   and name HD2   )(resid 60   and name HN    )     4.0  2.2 1.0
assign (resid 56   and name HD2   )(resid 61   and name HA    )     4.0  2.2 1.0
assign (resid 56   and name HD2   )(resid 61   and name HG1#  )     4.0  2.2 2.0
assign (resid 56   and name HD2   )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 56   and name HD2   )(resid 61   and name HD1#  )     4.0  2.2 2.0
!V57
assign (resid 57   and name HN    )(resid 57   and name HA    )     4.0  2.2 1.0
assign (resid 57   and name HN    )(resid 57   and name HB    )     4.0  2.2 1.0
assign (resid 57   and name HN    )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 57   and name HN    )(resid 57   and name HG2#  )     4.0  2.2 2.0
assign (resid 57   and name HN    )(resid 60   and name HN    )     4.0  2.2 1.0
assign (resid 57   and name HN    )(resid 61   and name HA    )     4.0  2.2 1.0
assign (resid 57   and name HN    )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 57   and name HN    )(resid 62   and name HN    )     4.0  2.2 1.0
!assign (resid 57   and name HA    )(resid 57   and name HB    )     3.0  1.2 0.5
assign (resid 57   and name HA    )(resid 57   and name HG1#  )     4.0  2.2 2.0
assign (resid 57   and name HA    )(resid 57   and name HG2#  )     4.0  2.2 2.0
assign (resid 57   and name HA    )(resid 58   and name HN    )     3.0  1.2 0.5
!assign (resid 57   and name HB    )(resid 57   and name HG1#  )     4.0  2.2 2.0
!assign (resid 57   and name HB    )(resid 57   and name HG2#  )     4.0  2.2 2.0
assign (resid 57   and name HB    )(resid 58   and name HN    )     4.0  2.2 1.0
assign (resid 57   and name HB    )(resid 60   and name HZ    )     4.0  2.2 1.0
!assign (resid 57   and name HG1#  )(resid 57   and name HG2#  )     4.0  2.2 3.0
assign (resid 57   and name HG1#  )(resid 58   and name HN    )     4.0  2.2 2.0
assign (resid 57   and name HG2#  )(resid 58   and name HN    )     4.0  2.2 2.0
assign (resid 57   and name HG1#  )(resid 58   and name HB#   )     4.0  2.2 3.0
assign (resid 57   and name HG1#  )(resid 58   and name HG#   )     4.0  2.2 3.0
assign (resid 57   and name HG2#  )(resid 58   and name HG#   )     4.0  2.2 3.0
assign (resid 57   and name HG1#  )(resid 60   and name HN    )     4.0  2.2 2.0
assign (resid 57   and name HG1#  )(resid 60   and name HD#   )     4.0  2.2 4.0
assign (resid 57   and name HG1#  )(resid 60   and name HE#   )     4.0  2.2 4.0
assign (resid 57   and name HG1#  )(resid 60   and name HZ    )     4.0  2.2 2.0
assign (resid 57   and name HG2#  )(resid 60   and name HZ    )     4.0  2.2 2.0
!M58
assign (resid 58   and name HN    )(resid 58   and name HA    )     3.0  1.2 0.5
assign (resid 58   and name HN    )(resid 58   and name HB#   )     4.0  2.2 2.0
assign (resid 58   and name HN    )(resid 58   and name HG#   )     4.0  2.2 2.0
!assign (resid 58   and name HA    )(resid 58   and name HB2   )     4.0  2.2 1.0
!assign (resid 58   and name HA    )(resid 58   and name HB1   )     4.0  2.2 1.0
assign (resid 58   and name HA    )(resid 58   and name HG#   )     4.0  2.2 2.0
assign (resid 58   and name HA    )(resid 59   and name HN    )     4.0  2.2 1.0
!assign (resid 58   and name HB2   )(resid 58   and name HG#   )     4.0  2.2 2.0
!assign (resid 58   and name HB1   )(resid 58   and name HG#   )     4.0  2.2 2.0
assign (resid 58   and name HB#   )(resid 59   and name HN    )     3.0  1.2 1.5
assign (resid 58   and name HB#   )(resid 60   and name HN    )     4.0  2.2 2.0
assign (resid 58   and name HB#   )(resid 60   and name HD#   )     4.0  2.2 4.0
assign (resid 58   and name HB#   )(resid 60   and name HE#   )     4.0  2.2 4.0
assign (resid 58   and name HG#   )(resid 59   and name HB2   )     4.0  2.2 2.0
assign (resid 58   and name HG#   )(resid 59   and name HB1   )     4.0  2.2 2.0
!D59
assign (resid 59   and name HN    )(resid 59   and name HA    )     4.0  2.2 1.0
assign (resid 59   and name HN    )(resid 59   and name HB2   )     4.0  2.2 1.0
assign (resid 59   and name HN    )(resid 59   and name HB1   )     4.0  2.2 1.0
assign (resid 59   and name HN    )(resid 60   and name HN    )     4.0  2.2 1.0
assign (resid 59   and name HN    )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 59   and name HN    )(resid 60   and name HE#   )     4.0  2.2 3.0
assign (resid 59   and name HA    )(resid 60   and name HN    )     4.0  2.2 1.0
!assign (resid 59   and name HB2   )(resid 59   and name HB1   )     2.5  0.7 0.4
!assign (resid 59   and name HB1   )(resid 59   and name HB2   )     2.5  0.7 0.4
assign (resid 59   and name HB#   )(resid 60   and name HN    )     4.0  2.2 2.0
!F60
assign (resid 60   and name HN    )(resid 60   and name HA    )     4.0  2.2 1.0
assign (resid 60   and name HN    )(resid 60   and name HB2   )     4.0  2.2 1.0
assign (resid 60   and name HN    )(resid 60   and name HB1   )     4.0  2.2 1.0
assign (resid 60   and name HN    )(resid 60   and name HD#   )     4.0  2.2 3.0
!assign (resid 60   and name HA    )(resid 60   and name HB2   )     4.0  2.2 1.0
!assign (resid 60   and name HA    )(resid 60   and name HB1   )     4.0  2.2 1.0
assign (resid 60   and name HA    )(resid 60   and name HD#   )     4.0  2.2 2.0
assign (resid 60   and name HA    )(resid 61   and name HN    )     3.0  1.2 0.5
assign (resid 60   and name HA    )(resid 61   and name HG1#  )     4.0  2.2 2.0
assign (resid 60   and name HB2   )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 60   and name HB1   )(resid 60   and name HD#   )     4.0  2.2 3.0
assign (resid 60   and name HB2   )(resid 61   and name HN    )     4.0  2.2 1.0
assign (resid 60   and name HB1   )(resid 61   and name HN    )     4.0  2.2 1.0
!assign (resid 60   and name HD#   )(resid 60   and name HE#   )     4.0  2.2 5.0
assign (resid 60   and name HD#   )(resid 61   and name HN    )     4.0  2.2 3.0
assign (resid 60   and name HD#   )(resid 61   and name HA    )     4.0  2.2 3.0
assign (resid 60   and name HD#   )(resid 61   and name HG1#  )     4.0  2.2 4.0
assign (resid 60   and name HD#   )(resid 61   and name HG2#  )     4.0  2.2 4.0
assign (resid 60   and name HD#   )(resid 62   and name HN    )     4.0  2.2 3.0
assign (resid 60   and name HD#   )(resid 62   and name HB#   )     4.0  2.2 4.0
!assign (resid 60   and name HE#   )(resid 60   and name HZ    )     4.0  2.2 3.0
assign (resid 60   and name HE#   )(resid 62   and name HB#   )     4.0  2.2 4.0
!I61
assign (resid 61   and name HN    )(resid 61   and name HA    )     4.0  2.2 1.0
assign (resid 61   and name HN    )(resid 61   and name HB    )     4.0  2.2 1.0
assign (resid 61   and name HN    )(resid 61   and name HG12  )     4.0  2.2 1.0
assign (resid 61   and name HN    )(resid 61   and name HG11  )     4.0  2.2 1.0
assign (resid 61   and name HN    )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 61   and name HN    )(resid 61   and name HD1#  )     4.0  2.2 2.0
assign (resid 61   and name HN    )(resid 62   and name HN    )     4.0  2.2 1.0
!assign (resid 61   and name HA    )(resid 61   and name HB    )     4.0  2.2 1.0
assign (resid 61   and name HA    )(resid 61   and name HG2#  )     4.0  2.2 1.6
assign (resid 61   and name HA    )(resid 62   and name HN    )     3.0  1.2 0.5
!assign (resid 61   and name HB    )(resid 61   and name HG12  )     4.0  2.2 1.0
!assign (resid 61   and name HB    )(resid 61   and name HG11  )     4.0  2.2 1.0
!assign (resid 61   and name HB    )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 61   and name HB    )(resid 61   and name HD1#  )     4.0  2.2 2.0
assign (resid 61   and name HB    )(resid 62   and name HN    )     4.0  2.2 1.0
assign (resid 61   and name HB    )(resid 63   and name HG2#  )     4.0  2.2 2.0
!assign (resid 61   and name HG12  )(resid 61   and name HG11  )     4.0  2.2 1.0
!assign (resid 61   and name HG11  )(resid 61   and name HG12  )     4.0  2.2 1.0
assign (resid 61   and name HG12  )(resid 61   and name HG2#  )     4.0  2.2 2.0
assign (resid 61   and name HG11  )(resid 61   and name HG2#  )     4.0  2.2 2.0
!assign (resid 61   and name HG12  )(resid 61   and name HD1#  )     4.0  2.2 2.0
!assign (resid 61   and name HG11  )(resid 61   and name HD1#  )     4.0  2.2 2.0
assign (resid 61   and name HG1#  )(resid 62   and name HN    )     4.0  2.2 2.0
assign (resid 61   and name HG2#  )(resid 62   and name HN    )     4.0  2.2 2.0
assign (resid 61   and name HG2#  )(resid 63   and name HG2#  )     4.0  2.2 3.0
assign (resid 61   and name HD1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 61   and name HD1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!S62
assign (resid 62   and name HN    )(resid 62   and name HA    )     4.0  2.2 1.0
assign (resid 62   and name HN    )(resid 62   and name HB#   )     3.0  1.2 1.5
assign (resid 62   and name HN    )(resid 63   and name HG2#  )     4.0  2.2 2.0
!assign (resid 62   and name HA    )(resid 62   and name HB#   )     3.0  1.2 1.5
assign (resid 62   and name HA    )(resid 63   and name HN    )     3.0  1.2 0.5
assign (resid 62   and name HA    )(resid 63   and name HG2#  )     4.0  2.2 2.0
assign (resid 62   and name HB#   )(resid 63   and name HN    )     4.0  2.2 2.0
!V63
assign (resid 63   and name HN    )(resid 63   and name HA    )     4.0  2.2 1.0
assign (resid 63   and name HN    )(resid 63   and name HB    )     3.0  1.2 0.5
assign (resid 63   and name HN    )(resid 63   and name HG2#  )     4.0  2.2 2.0
!assign (resid 63   and name HB    )(resid 63   and name HG1#  )     4.0  2.2 2.0
!assign (resid 63   and name HB    )(resid 63   and name HG2#  )     4.0  2.2 2.0
assign (resid 63   and name HB    )(resid 64   and name HN    )     4.0  2.2 1.0
assign (resid 63   and name HB    )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 63   and name HB    )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 63   and name HG1#  )(resid 63   and name HG2#  )     4.0  2.2 3.0
assign (resid 63   and name HG1#  )(resid 64   and name HN    )     4.0  2.2 2.0
assign (resid 63   and name HG1#  )(resid 64   and name HA    )     4.0  2.2 2.0
assign (resid 63   and name HG1#  )(resid 71   and name HZ2   )     4.0  2.2 2.0
assign (resid 63   and name HG1#  )(resid 71   and name HH2   )     4.0  2.2 2.0
assign (resid 63   and name HG1#  )(resid 71   and name HZ3   )     4.0  2.2 2.0
!D64
assign (resid 64   and name HN    )(resid 64   and name HA    )     4.0  2.2 1.0
assign (resid 64   and name HN    )(resid 64   and name HB2   )     4.0  2.2 1.0
assign (resid 64   and name HN    )(resid 64   and name HB1   )     4.0  2.2 1.0
!assign (resid 64   and name HA    )(resid 64   and name HB2   )     4.0  2.2 1.0
!assign (resid 64   and name HA    )(resid 64   and name HB1   )     4.0  2.2 1.0
assign (resid 64   and name HA    )(resid 65   and name HN    )     3.0  1.2 0.5
assign (resid 64   and name HA    )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 64   and name HA    )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 64   and name HB2   )(resid 64   and name HB1   )     2.5  0.7 0.4
!assign (resid 64   and name HB1   )(resid 64   and name HB2   )     2.5  0.7 0.4
assign (resid 64   and name HB2   )(resid 65   and name HN    )     4.0  2.2 1.0
assign (resid 64   and name HB1   )(resid 65   and name HN    )     4.0  2.2 1.0
!K65
assign (resid 65   and name HN    )(resid 65   and name HA    )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HB2   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HB1   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HG2   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HG1   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HD2   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 65   and name HD1   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 65   and name HN    )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 65   and name HA    )(resid 65   and name HB2   )     4.0  2.2 1.0
!assign (resid 65   and name HA    )(resid 65   and name HB1   )     4.0  2.2 1.0
assign (resid 65   and name HA    )(resid 65   and name HG2   )     4.0  2.2 1.0
assign (resid 65   and name HA    )(resid 65   and name HG1   )     4.0  2.2 1.0
assign (resid 65   and name HA    )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HA    )(resid 69   and name HB#   )     4.0  2.2 2.0
!assign (resid 65   and name HB2   )(resid 65   and name HB1   )     3.0  1.2 0.5
!assign (resid 65   and name HB1   )(resid 65   and name HB2   )     3.0  1.2 0.5
!assign (resid 65   and name HB2   )(resid 65   and name HG#   )     4.0  2.2 2.0
!assign (resid 65   and name HB1   )(resid 65   and name HG#   )     4.0  2.2 2.0
assign (resid 65   and name HB2   )(resid 65   and name HD2   )     4.0  2.2 1.0
assign (resid 65   and name HB2   )(resid 65   and name HD1   )     4.0  2.2 1.0
assign (resid 65   and name HB1   )(resid 65   and name HD2   )     4.0  2.2 1.0
assign (resid 65   and name HB1   )(resid 65   and name HD1   )     4.0  2.2 1.0
assign (resid 65   and name HB2   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HB1   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HB#   )(resid 69   and name HB#   )     4.0  2.2 3.0
assign (resid 65   and name HB#   )(resid 71   and name HZ2   )     4.0  2.2 2.0
assign (resid 65   and name HB#   )(resid 71   and name HH2   )     4.0  2.2 2.0
!assign (resid 65   and name HG2   )(resid 65   and name HD#   )     4.0  2.2 2.0
!assign (resid 65   and name HG1   )(resid 65   and name HD#   )     4.0  2.2 2.0
assign (resid 65   and name HG2   )(resid 65   and name HE#   )     4.0  2.2 2.0
assign (resid 65   and name HG1   )(resid 65   and name HE#   )     4.0  2.2 2.0
assign (resid 65   and name HG2   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HG1   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HG#   )(resid 66   and name HA    )     4.0  2.2 2.0
assign (resid 65   and name HG2   )(resid 71   and name HE1   )     4.0  2.2 1.0
assign (resid 65   and name HG1   )(resid 71   and name HE1   )     4.0  2.2 1.0
assign (resid 65   and name HG2   )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 65   and name HG1   )(resid 71   and name HZ2   )     4.0  2.2 1.0
assign (resid 65   and name HG#   )(resid 71   and name HH2   )     4.0  2.2 2.0
!assign (resid 65   and name HD2   )(resid 65   and name HE#   )     4.0  2.2 2.0
!assign (resid 65   and name HD1   )(resid 65   and name HE#   )     4.0  2.2 2.0
assign (resid 65   and name HD2   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HD1   )(resid 66   and name HN    )     4.0  2.2 1.0
assign (resid 65   and name HD#   )(resid 69   and name HN    )     4.0  2.2 2.0
assign (resid 65   and name HD2   )(resid 69   and name HB#   )     4.0  2.2 2.0
assign (resid 65   and name HD1   )(resid 69   and name HB#   )     4.0  2.2 2.0
assign (resid 65   and name HD#   )(resid 71   and name HN    )     4.0  2.2 2.0
assign (resid 65   and name HD#   )(resid 71   and name HE1   )     4.0  2.2 2.0
assign (resid 65   and name HE#   )(resid 71   and name HN    )     4.0  2.2 2.0
assign (resid 65   and name HE#   )(resid 71   and name HD1   )     4.0  2.2 2.0
assign (resid 65   and name HE#   )(resid 71   and name HE1   )     4.0  2.2 2.0
assign (resid 65   and name HE#   )(resid 71   and name HZ2   )     4.0  2.2 2.0
!E66
assign (resid 66   and name HN    )(resid 66   and name HA    )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 66   and name HB2   )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 66   and name HB1   )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 66   and name HG2   )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 66   and name HG1   )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 67   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HN    )(resid 69   and name HB#   )     4.0  2.2 2.0
!assign (resid 66   and name HA    )(resid 66   and name HB2   )     4.0  2.2 1.0
!assign (resid 66   and name HA    )(resid 66   and name HB1   )     4.0  2.2 1.0
assign (resid 66   and name HA    )(resid 66   and name HG2   )     4.0  2.2 1.0
assign (resid 66   and name HA    )(resid 66   and name HG1   )     4.0  2.2 1.0
assign (resid 66   and name HA    )(resid 67   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HA    )(resid 67   and name HB#   )     4.0  2.2 2.0
!assign (resid 66   and name HB2   )(resid 66   and name HB1   )     2.5  0.7 0.4
!assign (resid 66   and name HB1   )(resid 66   and name HB2   )     2.5  0.7 0.4
!assign (resid 66   and name HB2   )(resid 66   and name HG2   )     4.0  2.2 1.0
!assign (resid 66   and name HB2   )(resid 66   and name HG1   )     4.0  2.2 1.0
!assign (resid 66   and name HB1   )(resid 66   and name HG2   )     4.0  2.2 1.0
!assign (resid 66   and name HB1   )(resid 66   and name HG1   )     4.0  2.2 1.0
assign (resid 66   and name HB#   )(resid 67   and name HN    )     4.0  2.2 2.0
assign (resid 66   and name HB#   )(resid 67   and name HB#   )     4.0  2.2 3.0
assign (resid 66   and name HB2   )(resid 68   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HB1   )(resid 68   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HB2   )(resid 69   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HB1   )(resid 69   and name HN    )     4.0  2.2 1.0
assign (resid 66   and name HB2   )(resid 69   and name HB#   )     4.0  2.2 2.0
assign (resid 66   and name HB1   )(resid 69   and name HB#   )     4.0  2.2 2.0
!assign (resid 66   and name HG2   )(resid 66   and name HG1   )     4.0  2.2 1.0
!assign (resid 66   and name HG1   )(resid 66   and name HG2   )     4.0  2.2 1.0
assign (resid 66   and name HG#   )(resid 69   and name HB#   )     4.0  2.2 3.0
!N67
assign (resid 67   and name HN    )(resid 67   and name HA    )     4.0  2.2 1.0
assign (resid 67   and name HN    )(resid 67   and name HB#   )     4.0  2.2 2.0
assign (resid 67   and name HN    )(resid 68   and name HN    )     4.0  2.2 1.0
!assign (resid 67   and name HA    )(resid 67   and name HB#   )     4.0  2.2 2.0
assign (resid 67   and name HA    )(resid 68   and name HN    )     4.0  2.2 1.0
assign (resid 67   and name HB#   )(resid 67   and name HD21  )     4.0  2.2 2.0
assign (resid 67   and name HB#   )(resid 67   and name HD22  )     4.0  2.2 2.0
assign (resid 67   and name HB#   )(resid 68   and name HN    )     3.0  1.2 1.5
!assign (resid 67   and name HD21  )(resid 67   and name HD22  )     4.0  2.2 1.0
!assign (resid 67   and name HD22  )(resid 67   and name HD21  )     4.0  2.2 1.0
!D68
assign (resid 68   and name HN    )(resid 68   and name HA    )     3.0  1.2 0.5
assign (resid 68   and name HN    )(resid 68   and name HB#   )     3.0  1.2 1.5
assign (resid 68   and name HN    )(resid 69   and name HN    )     3.0  1.2 0.5
!assign (resid 68   and name HA    )(resid 68   and name HB#   )     4.0  2.2 2.0
assign (resid 68   and name HB#   )(resid 69   and name HN    )     4.0  2.2 2.0
!A69
assign (resid 69   and name HN    )(resid 69   and name HA    )     4.0  2.2 1.0
assign (resid 69   and name HN    )(resid 69   and name HB#   )     4.0  2.2 1.6
!assign (resid 69   and name HA    )(resid 69   and name HB#   )     4.0  2.2 1.2
assign (resid 69   and name HA    )(resid 70   and name HN    )     4.0  2.2 1.0
assign (resid 69   and name HB#   )(resid 70   and name HN    )     4.0  2.2 2.0
assign (resid 69   and name HB#   )(resid 74   and name HG2#  )     4.0  2.2 3.0
!N70
assign (resid 70   and name HN    )(resid 70   and name HA    )     4.0  2.2 1.0
assign (resid 70   and name HN    )(resid 70   and name HB2   )     4.0  2.2 1.0
assign (resid 70   and name HN    )(resid 70   and name HB1   )     4.0  2.2 1.0
assign (resid 70   and name HN    )(resid 74   and name HG2#  )     4.0  2.2 2.0
!assign (resid 70   and name HA    )(resid 70   and name HB2   )     4.0  2.2 1.0
!assign (resid 70   and name HA    )(resid 70   and name HB1   )     4.0  2.2 1.0
assign (resid 70   and name HA    )(resid 71   and name HN    )     3.0  1.2 0.5
assign (resid 70   and name HB2   )(resid 70   and name HD21  )     4.0  2.2 1.0
assign (resid 70   and name HB1   )(resid 70   and name HD21  )     4.0  2.2 1.0
assign (resid 70   and name HB1   )(resid 70   and name HD22  )     4.0  2.2 1.0
assign (resid 70   and name HB2   )(resid 71   and name HN    )     4.0  2.2 1.0
assign (resid 70   and name HB1   )(resid 71   and name HN    )     4.0  2.2 1.0
assign (resid 70   and name HB2   )(resid 72   and name HN    )     4.0  2.2 1.0
assign (resid 70   and name HB1   )(resid 72   and name HN    )     4.0  2.2 1.0
assign (resid 70   and name HB2   )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 70   and name HB1   )(resid 73   and name HN    )     4.0  2.2 1.0
!assign (resid 70   and name HD21  )(resid 70   and name HD22  )     4.0  2.2 1.0
!assign (resid 70   and name HD22  )(resid 70   and name HD21  )     4.0  2.2 1.0
!W71
assign (resid 71   and name HN    )(resid 71   and name HA    )     4.0  2.2 1.0
assign (resid 71   and name HN    )(resid 71   and name HB#   )     4.0  2.2 2.0
assign (resid 71   and name HN    )(resid 71   and name HD1   )     4.0  2.2 1.0
assign (resid 71   and name HN    )(resid 72   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HN    )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HA    )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HA    )(resid 74   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HA    )(resid 75   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HB2   )(resid 71   and name HD1   )     4.0  2.2 1.0
assign (resid 71   and name HB1   )(resid 71   and name HD1   )     4.0  2.2 1.0
assign (resid 71   and name HB#   )(resid 71   and name HE1   )     4.0  2.2 2.0
assign (resid 71   and name HB#   )(resid 71   and name HE3   )     4.0  2.2 2.0
assign (resid 71   and name HB#   )(resid 72   and name HN    )     4.0  2.2 2.0
assign (resid 71   and name HB#   )(resid 75   and name HB#   )     4.0  2.2 3.0
assign (resid 71   and name HB#   )(resid 75   and name HD1#  )     4.0  2.2 3.0
!assign (resid 71   and name HD1   )(resid 71   and name HE1   )     4.0  2.2 1.0
!assign (resid 71   and name HE1   )(resid 71   and name HZ2   )     4.0  2.2 1.0
!assign (resid 71   and name HE1   )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 71   and name HZ2   )(resid 71   and name HH2   )     4.0  2.2 1.0
!assign (resid 71   and name HZ2   )(resid 71   and name HZ3   )     4.0  2.2 1.0
!assign (resid 71   and name HH2   )(resid 71   and name HZ3   )     4.0  2.2 1.0
assign (resid 71   and name HH2   )(resid 74   and name HG1#  )     4.0  2.2 2.0
!assign (resid 71   and name HZ3   )(resid 71   and name HE3   )     4.0  2.2 1.0
assign (resid 71   and name HZ3   )(resid 74   and name HB    )     4.0  2.2 1.0
assign (resid 71   and name HZ3   )(resid 74   and name HG1#  )     4.0  2.2 2.0
assign (resid 71   and name HZ3   )(resid 78   and name HG2#  )     4.0  2.2 2.0
!assign (resid 71   and name HE3   )(resid 71   and name HZ3   )     4.0  2.2 1.0
assign (resid 71   and name HE3   )(resid 74   and name HB    )     4.0  2.2 1.0
assign (resid 71   and name HE3   )(resid 74   and name HG1#  )     4.0  2.2 2.0
assign (resid 71   and name HE3   )(resid 75   and name HN    )     4.0  2.2 1.0
assign (resid 71   and name HE3   )(resid 75   and name HB#   )     4.0  2.2 2.0
assign (resid 71   and name HE3   )(resid 75   and name HG    )     4.0  2.2 1.0
assign (resid 71   and name HE3   )(resid 75   and name HD1#  )     4.0  2.2 2.0
!E72
assign (resid 72   and name HN    )(resid 72   and name HA    )     4.0  2.2 1.0
assign (resid 72   and name HN    )(resid 72   and name HB2   )     4.0  2.2 1.0
assign (resid 72   and name HN    )(resid 72   and name HB1   )     4.0  2.2 1.0
assign (resid 72   and name HN    )(resid 72   and name HG#   )     4.0  2.2 2.0
assign (resid 72   and name HN    )(resid 73   and name HN    )     3.0  1.2 0.5
!assign (resid 72   and name HA    )(resid 72   and name HB2   )     4.0  2.2 1.0
!assign (resid 72   and name HA    )(resid 72   and name HB1   )     4.0  2.2 1.0
assign (resid 72   and name HA    )(resid 72   and name HG#   )     4.0  2.2 2.0
assign (resid 72   and name HA    )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 72   and name HA    )(resid 74   and name HN    )     4.0  2.2 1.0
assign (resid 72   and name HA    )(resid 75   and name HB#   )     4.0  2.2 2.0
!assign (resid 72   and name HB2   )(resid 72   and name HG#   )     4.0  2.2 2.0
!assign (resid 72   and name HB1   )(resid 72   and name HG#   )     4.0  2.2 2.0
assign (resid 72   and name HB2   )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 72   and name HB1   )(resid 73   and name HN    )     4.0  2.2 1.0
assign (resid 72   and name HG#   )(resid 73   and name HN    )     4.0  2.2 2.0
assign (resid 72   and name HG#   )(resid 75   and name HB#   )     4.0  2.2 3.0
!T73
assign (resid 73   and name HN    )(resid 73   and name HA    )     4.0  2.2 1.0
assign (resid 73   and name HN    )(resid 73   and name HB    )     4.0  2.2 1.0
assign (resid 73   and name HN    )(resid 73   and name HG2#  )     4.0  2.2 2.0
assign (resid 73   and name HN    )(resid 74   and name HN    )     2.5  0.7 0.4
assign (resid 73   and name HN    )(resid 74   and name HA    )     4.0  2.2 1.0
assign (resid 73   and name HN    )(resid 74   and name HB    )     4.0  2.2 1.0
assign (resid 73   and name HN    )(resid 74   and name HG1#  )     4.0  2.2 2.0
assign (resid 73   and name HN    )(resid 74   and name HG2#  )     4.0  2.2 2.0
assign (resid 73   and name HN    )(resid 75   and name HN    )     4.0  2.2 1.0
!assign (resid 73   and name HA    )(resid 73   and name HB    )     3.0  1.2 0.5
assign (resid 73   and name HA    )(resid 73   and name HG2#  )     4.0  2.2 1.6
assign (resid 73   and name HA    )(resid 74   and name HN    )     4.0  2.2 1.0
!assign (resid 73   and name HB    )(resid 73   and name HG2#  )     4.0  2.2 2.0
assign (resid 73   and name HB    )(resid 74   and name HN    )     4.0  2.2 1.0
assign (resid 73   and name HG2#  )(resid 74   and name HN    )     4.0  2.2 2.0
assign (resid 73   and name HG2#  )(resid 74   and name HA    )     4.0  2.2 2.0
assign (resid 73   and name HG2#  )(resid 74   and name HG1#  )     4.0  2.2 3.0
assign (resid 73   and name HG2#  )(resid 77   and name HD#   )     4.0  2.2 3.0
assign (resid 73   and name HG2#  )(resid 77   and name HE#   )     4.0  2.2 3.0
!V74
assign (resid 74   and name HN    )(resid 74   and name HA    )     3.0  1.2 0.5
assign (resid 74   and name HN    )(resid 74   and name HB    )     3.0  1.2 0.5
assign (resid 74   and name HN    )(resid 74   and name HG1#  )     4.0  2.2 2.0
assign (resid 74   and name HN    )(resid 74   and name HG2#  )     4.0  2.2 2.0
assign (resid 74   and name HN    )(resid 75   and name HN    )     3.0  1.2 0.5
assign (resid 74   and name HN    )(resid 76   and name HD#   )     4.0  2.2 2.0
!assign (resid 74   and name HA    )(resid 74   and name HB    )     4.0  2.2 1.0
assign (resid 74   and name HA    )(resid 74   and name HG1#  )     4.0  2.2 2.0
assign (resid 74   and name HA    )(resid 74   and name HG2#  )     4.0  2.2 2.0
assign (resid 74   and name HA    )(resid 75   and name HN    )     4.0  2.2 1.0
assign (resid 74   and name HA    )(resid 77   and name HN    )     4.0  2.2 1.0
assign (resid 74   and name HA    )(resid 77   and name HB#   )     4.0  2.2 2.0
assign (resid 74   and name HA    )(resid 77   and name HD2   )     4.0  2.2 1.0
assign (resid 74   and name HA    )(resid 77   and name HD1   )     4.0  2.2 1.0
!assign (resid 74   and name HB    )(resid 74   and name HG1#  )     4.0  2.2 2.0
!assign (resid 74   and name HB    )(resid 74   and name HG2#  )     4.0  2.2 2.0
assign (resid 74   and name HB    )(resid 75   and name HN    )     4.0  2.2 1.0
assign (resid 74   and name HG1#  )(resid 75   and name HN    )     4.0  2.2 2.0
assign (resid 74   and name HG2#  )(resid 75   and name HN    )     4.0  2.2 2.0
assign (resid 74   and name HG1#  )(resid 77   and name HN    )     4.0  2.2 2.0
assign (resid 74   and name HG2#  )(resid 77   and name HN    )     4.0  2.2 2.0
assign (resid 74   and name HG2#  )(resid 77   and name HD#   )     4.0  2.2 3.0
assign (resid 74   and name HG1#  )(resid 78   and name HN    )     4.0  2.2 2.0
assign (resid 74   and name HG1#  )(resid 78   and name HG2#  )     4.0  2.2 3.0
!L75
assign (resid 75   and name HN    )(resid 75   and name HA    )     3.0  1.2 0.5
assign (resid 75   and name HN    )(resid 75   and name HB#   )     3.0  1.2 1.5
assign (resid 75   and name HN    )(resid 75   and name HG    )     4.0  2.2 1.0
assign (resid 75   and name HN    )(resid 75   and name HD1#  )     4.0  2.2 2.0
assign (resid 75   and name HN    )(resid 76   and name HD2   )     4.0  2.2 1.0
assign (resid 75   and name HN    )(resid 76   and name HD1   )     4.0  2.2 1.0
assign (resid 75   and name HN    )(resid 77   and name HN    )     4.0  2.2 1.0
!assign (resid 75   and name HA    )(resid 75   and name HB#   )     4.0  2.2 2.0
assign (resid 75   and name HA    )(resid 75   and name HG    )     4.0  2.2 1.0
assign (resid 75   and name HA    )(resid 75   and name HD1#  )     4.0  2.2 2.0
assign (resid 75   and name HA    )(resid 78   and name HB    )     4.0  2.2 1.0
assign (resid 75   and name HA    )(resid 78   and name HG1#  )     4.0  2.2 2.0
assign (resid 75   and name HA    )(resid 78   and name HG2#  )     4.0  2.2 2.0
assign (resid 75   and name HA    )(resid 79   and name HN    )     4.0  2.2 1.0
!assign (resid 75   and name HB#   )(resid 75   and name HG    )     4.0  2.2 2.0
assign (resid 75   and name HB#   )(resid 75   and name HD1#  )     4.0  2.2 3.0
assign (resid 75   and name HB#   )(resid 75   and name HD2#  )     4.0  2.2 3.0
assign (resid 75   and name HB#   )(resid 76   and name HD2   )     4.0  2.2 2.0
assign (resid 75   and name HB#   )(resid 76   and name HD1   )     4.0  2.2 2.0
!assign (resid 75   and name HG    )(resid 75   and name HD1#  )     4.0  2.2 2.0
!assign (resid 75   and name HG    )(resid 75   and name HD2#  )     4.0  2.2 2.0
assign (resid 75   and name HG    )(resid 76   and name HD#   )     4.0  2.2 2.0
assign (resid 75   and name HD1#  )(resid 76   and name HD#   )     4.0  2.2 3.0
assign (resid 75   and name HD2#  )(resid 76   and name HD#   )     4.0  2.2 3.0
assign (resid 75   and name HD1#  )(resid 78   and name HB    )     4.0  2.2 2.0
assign (resid 75   and name HD2#  )(resid 78   and name HB    )     4.0  2.2 2.0
!P76
!assign (resid 76   and name HA    )(resid 76   and name HB#   )     4.0  2.2 2.0
assign (resid 76   and name HA    )(resid 77   and name HN    )     4.0  2.2 1.0
assign (resid 76   and name HA    )(resid 79   and name HN    )     4.0  2.2 1.0
assign (resid 76   and name HA    )(resid 80   and name HN    )     4.0  2.2 1.0
!assign (resid 76   and name HB2   )(resid 76   and name HB1   )     3.0  1.2 0.5
!assign (resid 76   and name HB1   )(resid 76   and name HB2   )     3.0  1.2 0.5
!assign (resid 76   and name HB2   )(resid 76   and name HG2   )     4.0  2.2 1.0
!assign (resid 76   and name HB2   )(resid 76   and name HG1   )     4.0  2.2 1.0
!assign (resid 76   and name HB1   )(resid 76   and name HG2   )     4.0  2.2 1.0
!assign (resid 76   and name HB1   )(resid 76   and name HG1   )     4.0  2.2 1.0
!assign (resid 76   and name HB2   )(resid 76   and name HD2   )     4.0  2.2 1.0
!assign (resid 76   and name HB2   )(resid 76   and name HD1   )     4.0  2.2 1.0
!assign (resid 76   and name HB1   )(resid 76   and name HD2   )     4.0  2.2 1.0
!assign (resid 76   and name HB1   )(resid 76   and name HD1   )     4.0  2.2 1.0
assign (resid 76   and name HB2   )(resid 77   and name HN    )     4.0  2.2 1.0
assign (resid 76   and name HB1   )(resid 77   and name HN    )     4.0  2.2 1.0
!assign (resid 76   and name HG2   )(resid 76   and name HD2   )     4.0  2.2 1.0
!assign (resid 76   and name HG2   )(resid 76   and name HD1   )     4.0  2.2 1.0
!assign (resid 76   and name HG1   )(resid 76   and name HD2   )     4.0  2.2 1.0
!assign (resid 76   and name HG1   )(resid 76   and name HD1   )     4.0  2.2 1.0
assign (resid 76   and name HG#   )(resid 77   and name HN    )     4.0  2.2 2.0
assign (resid 76   and name HG#   )(resid 77   and name HD#   )     4.0  2.2 3.0
!assign (resid 76   and name HD2   )(resid 76   and name HD1   )     4.0  2.2 1.0
!assign (resid 76   and name HD1   )(resid 76   and name HD2   )     4.0  2.2 1.0
assign (resid 76   and name HD2   )(resid 77   and name HN    )     4.0  2.2 1.0
assign (resid 76   and name HD1   )(resid 77   and name HN    )     4.0  2.2 1.0
!K77
assign (resid 77   and name HN    )(resid 77   and name HA    )     3.0  1.2 0.5
assign (resid 77   and name HN    )(resid 77   and name HB2   )     4.0  2.2 1.0
assign (resid 77   and name HN    )(resid 77   and name HB1   )     4.0  2.2 1.0
assign (resid 77   and name HN    )(resid 77   and name HG2   )     4.0  2.2 1.0
assign (resid 77   and name HN    )(resid 77   and name HG1   )     4.0  2.2 1.0
assign (resid 77   and name HN    )(resid 77   and name HD#   )     4.0  2.2 2.0
assign (resid 77   and name HN    )(resid 78   and name HN    )     3.0  1.2 0.5
assign (resid 77   and name HN    )(resid 78   and name HG2#  )     4.0  2.2 2.0
assign (resid 77   and name HN    )(resid 79   and name HN    )     4.0  2.2 1.0
!assign (resid 77   and name HA    )(resid 77   and name HB#   )     4.0  2.2 2.0
assign (resid 77   and name HA    )(resid 77   and name HG2   )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 77   and name HG1   )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 77   and name HD2   )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 77   and name HD1   )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 78   and name HN    )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 80   and name HN    )     4.0  2.2 1.0
assign (resid 77   and name HA    )(resid 80   and name HB#   )     4.0  2.2 2.0
!assign (resid 77   and name HB2   )(resid 77   and name HB1   )     2.5  0.7 0.4
!assign (resid 77   and name HB1   )(resid 77   and name HB2   )     2.5  0.7 0.4
!assign (resid 77   and name HB2   )(resid 77   and name HG2   )     4.0  2.2 1.0
!assign (resid 77   and name HB2   )(resid 77   and name HG1   )     4.0  2.2 1.0
!assign (resid 77   and name HB1   )(resid 77   and name HG2   )     4.0  2.2 1.0
!assign (resid 77   and name HB1   )(resid 77   and name HG1   )     4.0  2.2 1.0
assign (resid 77   and name HB#   )(resid 77   and name HD2   )     4.0  2.2 2.0
assign (resid 77   and name HB#   )(resid 77   and name HD1   )     4.0  2.2 2.0
assign (resid 77   and name HB2   )(resid 78   and name HN    )     4.0  2.2 1.0
assign (resid 77   and name HB1   )(resid 78   and name HN    )     4.0  2.2 1.0
assign (resid 77   and name HB#   )(resid 78   and name HA    )     4.0  2.2 2.0
assign (resid 77   and name HB#   )(resid 78   and name HG2#  )     4.0  2.2 3.0
!assign (resid 77   and name HG2   )(resid 77   and name HG1   )     4.0  2.2 1.0
!assign (resid 77   and name HG1   )(resid 77   and name HG2   )     4.0  2.2 1.0
!assign (resid 77   and name HG#   )(resid 77   and name HD2   )     4.0  2.2 2.0
!assign (resid 77   and name HG#   )(resid 77   and name HD1   )     4.0  2.2 2.0
assign (resid 77   and name HG2   )(resid 77   and name HE#   )     4.0  2.2 2.0
assign (resid 77   and name HG1   )(resid 77   and name HE#   )     4.0  2.2 2.0
!assign (resid 77   and name HD#   )(resid 77   and name HE#   )     4.0  2.2 3.0
!V78
assign (resid 78   and name HN    )(resid 78   and name HA    )     4.0  2.2 1.0
assign (resid 78   and name HN    )(resid 78   and name HB    )     3.0  1.2 0.5
assign (resid 78   and name HN    )(resid 78   and name HG1#  )     4.0  2.2 2.0
assign (resid 78   and name HN    )(resid 78   and name HG2#  )     4.0  2.2 2.0
assign (resid 78   and name HN    )(resid 79   and name HN    )     3.0  1.2 0.5
!assign (resid 78   and name HA    )(resid 78   and name HB    )     4.0  2.2 1.0
assign (resid 78   and name HA    )(resid 78   and name HG1#  )     4.0  2.2 2.0
assign (resid 78   and name HA    )(resid 78   and name HG2#  )     4.0  2.2 2.0
assign (resid 78   and name HA    )(resid 79   and name HN    )     4.0  2.2 1.0
assign (resid 78   and name HA    )(resid 81   and name HN    )     4.0  2.2 1.0
assign (resid 78   and name HA    )(resid 81   and name HB    )     4.0  2.2 1.0
assign (resid 78   and name HA    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 78   and name HA    )(resid 81   and name HG2#  )     4.0  2.2 2.0
!assign (resid 78   and name HB    )(resid 78   and name HG1#  )     4.0  2.2 2.0
!assign (resid 78   and name HB    )(resid 78   and name HG2#  )     4.0  2.2 2.0
assign (resid 78   and name HB    )(resid 79   and name HN    )     3.0  1.2 0.5
assign (resid 78   and name HG1#  )(resid 79   and name HN    )     4.0  2.2 2.0
assign (resid 78   and name HG2#  )(resid 79   and name HN    )     4.0  2.2 2.0
assign (resid 78   and name HG1#  )(resid 79   and name HA    )     4.0  2.2 2.0
assign (resid 78   and name HG1#  )(resid 81   and name HB    )     4.0  2.2 2.0
assign (resid 78   and name HG1#  )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 78   and name HG1#  )(resid 82   and name HE#   )     4.0  2.2 4.0
assign (resid 78   and name HG1#  )(resid 82   and name HZ    )     4.0  2.2 2.0
!E79
assign (resid 79   and name HN    )(resid 79   and name HA    )     4.0  2.2 1.0
assign (resid 79   and name HN    )(resid 79   and name HB#   )     3.0  1.2 1.5
assign (resid 79   and name HN    )(resid 79   and name HG#   )     4.0  2.2 2.0
assign (resid 79   and name HN    )(resid 80   and name HN    )     3.0  1.2 0.5
assign (resid 79   and name HN    )(resid 80   and name HB#   )     4.0  2.2 2.0
!assign (resid 79   and name HA    )(resid 79   and name HB#   )     3.0  1.2 1.5
assign (resid 79   and name HA    )(resid 79   and name HG2   )     4.0  2.2 1.0
assign (resid 79   and name HA    )(resid 79   and name HG1   )     4.0  2.2 1.0
assign (resid 79   and name HA    )(resid 80   and name HN    )     4.0  2.2 1.0
assign (resid 79   and name HA    )(resid 82   and name HN    )     4.0  2.2 1.0
assign (resid 79   and name HA    )(resid 82   and name HD#   )     4.0  2.2 3.0
!assign (resid 79   and name HB#   )(resid 79   and name HG#   )     4.0  2.2 3.0
assign (resid 79   and name HB#   )(resid 80   and name HN    )     3.0  1.2 1.5
!assign (resid 79   and name HG2   )(resid 79   and name HG1   )     4.0  2.2 1.0
!assign (resid 79   and name HG1   )(resid 79   and name HG2   )     4.0  2.2 1.0
assign (resid 79   and name HG#   )(resid 82   and name HD#   )     4.0  2.2 4.0
assign (resid 79   and name HG#   )(resid 83   and name HB2   )     4.0  2.2 2.0
assign (resid 79   and name HG#   )(resid 83   and name HB1   )     4.0  2.2 2.0
assign (resid 79   and name HG#   )(resid 83   and name HG#   )     4.0  2.2 3.0
!A80
assign (resid 80   and name HN    )(resid 80   and name HA    )     4.0  2.2 1.0
assign (resid 80   and name HN    )(resid 80   and name HB#   )     4.0  2.2 1.6
assign (resid 80   and name HN    )(resid 81   and name HN    )     3.0  1.2 0.5
!assign (resid 80   and name HA    )(resid 80   and name HB#   )     4.0  2.2 1.2
assign (resid 80   and name HA    )(resid 81   and name HN    )     4.0  2.2 1.0
assign (resid 80   and name HA    )(resid 83   and name HB2   )     4.0  2.2 1.0
assign (resid 80   and name HA    )(resid 83   and name HB1   )     4.0  2.2 1.0
assign (resid 80   and name HA    )(resid 83   and name HG#   )     4.0  2.2 2.0
assign (resid 80   and name HB#   )(resid 81   and name HN    )     4.0  2.2 2.0
assign (resid 80   and name HB#   )(resid 81   and name HA    )     4.0  2.2 2.0
assign (resid 80   and name HB#   )(resid 83   and name HN    )     4.0  2.2 2.0
!V81
assign (resid 81   and name HN    )(resid 81   and name HA    )     3.0  1.2 0.5
assign (resid 81   and name HN    )(resid 81   and name HB    )     3.0  1.2 0.5
assign (resid 81   and name HN    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 81   and name HN    )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 81   and name HN    )(resid 82   and name HN    )     3.0  1.2 0.5
!assign (resid 81   and name HA    )(resid 81   and name HB    )     3.0  1.2 0.5
assign (resid 81   and name HA    )(resid 81   and name HG1#  )     4.0  2.2 2.0
assign (resid 81   and name HA    )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 81   and name HA    )(resid 82   and name HN    )     4.0  2.2 1.0
assign (resid 81   and name HA    )(resid 84   and name HG    )     4.0  2.2 1.0
assign (resid 81   and name HA    )(resid 84   and name HD1#  )     4.0  2.2 2.0
assign (resid 81   and name HA    )(resid 84   and name HD2#  )     4.0  2.2 2.0
!assign (resid 81   and name HB    )(resid 81   and name HG1#  )     4.0  2.2 2.0
!assign (resid 81   and name HB    )(resid 81   and name HG2#  )     4.0  2.2 2.0
assign (resid 81   and name HB    )(resid 82   and name HN    )     4.0  2.2 1.0
assign (resid 81   and name HB    )(resid 82   and name HD#   )     4.0  2.2 3.0
assign (resid 81   and name HB    )(resid 82   and name HE#   )     4.0  2.2 3.0
!assign (resid 81   and name HG1#  )(resid 81   and name HG2#  )     4.0  2.2 3.0
assign (resid 81   and name HG1#  )(resid 82   and name HN    )     4.0  2.2 2.0
assign (resid 81   and name HG2#  )(resid 82   and name HN    )     4.0  2.2 2.0
!F82
assign (resid 82   and name HN    )(resid 82   and name HA    )     3.0  1.2 0.5
assign (resid 82   and name HN    )(resid 82   and name HB2   )     4.0  2.2 1.0
assign (resid 82   and name HN    )(resid 82   and name HB1   )     4.0  2.2 1.0
assign (resid 82   and name HN    )(resid 82   and name HD#   )     4.0  2.2 3.0
assign (resid 82   and name HN    )(resid 82   and name HZ    )     4.0  2.2 1.0
assign (resid 82   and name HN    )(resid 83   and name HN    )     3.0  1.2 0.5
!assign (resid 82   and name HA    )(resid 82   and name HB2   )     4.0  2.2 1.0
!assign (resid 82   and name HA    )(resid 82   and name HB1   )     4.0  2.2 1.0
assign (resid 82   and name HA    )(resid 82   and name HD#   )     4.0  2.2 2.0
assign (resid 82   and name HA    )(resid 83   and name HN    )     4.0  2.2 1.0
!assign (resid 82   and name HB2   )(resid 82   and name HB1   )     2.5  0.7 0.4
!assign (resid 82   and name HB1   )(resid 82   and name HB2   )     2.5  0.7 0.4
assign (resid 82   and name HB2   )(resid 82   and name HD#   )     4.0  2.2 3.0
assign (resid 82   and name HB1   )(resid 82   and name HD#   )     4.0  2.2 3.0
assign (resid 82   and name HB2   )(resid 83   and name HN    )     4.0  2.2 1.0
assign (resid 82   and name HB1   )(resid 83   and name HN    )     4.0  2.2 1.0
!assign (resid 82   and name HD#   )(resid 82   and name HE#   )     4.0  2.2 5.0
!assign (resid 82   and name HD#   )(resid 82   and name HZ    )     4.0  2.2 3.0
assign (resid 82   and name HD#   )(resid 83   and name HN    )     4.0  2.2 3.0
!assign (resid 82   and name HE#   )(resid 82   and name HZ    )     4.0  2.2 3.0
!E83
assign (resid 83   and name HN    )(resid 83   and name HA    )     4.0  2.2 1.0
assign (resid 83   and name HN    )(resid 83   and name HB2   )     4.0  2.2 1.0
assign (resid 83   and name HN    )(resid 83   and name HB1   )     4.0  2.2 1.0
assign (resid 83   and name HN    )(resid 83   and name HG#   )     4.0  2.2 2.0
assign (resid 83   and name HN    )(resid 84   and name HN    )     3.0  1.2 0.5
assign (resid 83   and name HN    )(resid 84   and name HG    )     4.0  2.2 1.0
assign (resid 83   and name HN    )(resid 84   and name HD2#  )     4.0  2.2 2.0
!assign (resid 83   and name HA    )(resid 83   and name HB2   )     4.0  2.2 1.0
!assign (resid 83   and name HA    )(resid 83   and name HB1   )     4.0  2.2 1.0
assign (resid 83   and name HA    )(resid 83   and name HG#   )     4.0  2.2 2.0
assign (resid 83   and name HA    )(resid 84   and name HN    )     3.0  1.2 0.5
!assign (resid 83   and name HB2   )(resid 83   and name HG#   )     4.0  2.2 2.0
!assign (resid 83   and name HB1   )(resid 83   and name HG#   )     4.0  2.2 2.0
assign (resid 83   and name HB2   )(resid 84   and name HN    )     4.0  2.2 1.0
assign (resid 83   and name HB1   )(resid 84   and name HN    )     4.0  2.2 1.0
assign (resid 83   and name HB#   )(resid 84   and name HB#   )     4.0  2.2 3.0
assign (resid 83   and name HG#   )(resid 84   and name HN    )     4.0  2.2 2.0
!L84
assign (resid 84   and name HN    )(resid 84   and name HA    )     3.0  1.2 0.5
assign (resid 84   and name HN    )(resid 84   and name HB2   )     4.0  2.2 1.0
assign (resid 84   and name HN    )(resid 84   and name HB1   )     4.0  2.2 1.0
assign (resid 84   and name HN    )(resid 84   and name HG    )     4.0  2.2 1.0
assign (resid 84   and name HN    )(resid 84   and name HD2#  )     4.0  2.2 2.0
assign (resid 84   and name HN    )(resid 85   and name HN    )     3.0  1.2 0.5
!assign (resid 84   and name HA    )(resid 84   and name HB2   )     4.0  2.2 1.0
!assign (resid 84   and name HA    )(resid 84   and name HB1   )     4.0  2.2 1.0
assign (resid 84   and name HA    )(resid 84   and name HG    )     4.0  2.2 1.0
assign (resid 84   and name HA    )(resid 84   and name HD1#  )     4.0  2.2 2.0
assign (resid 84   and name HA    )(resid 84   and name HD2#  )     4.0  2.2 2.0
assign (resid 84   and name HA    )(resid 85   and name HN    )     3.0  1.2 0.5
!assign (resid 84   and name HB2   )(resid 84   and name HB1   )     2.5  0.7 0.4
!assign (resid 84   and name HB1   )(resid 84   and name HB2   )     2.5  0.7 0.4
!assign (resid 84   and name HB2   )(resid 84   and name HG    )     4.0  2.2 1.0
!assign (resid 84   and name HB1   )(resid 84   and name HG    )     4.0  2.2 1.0
assign (resid 84   and name HB2   )(resid 84   and name HD1#  )     4.0  2.2 2.0
assign (resid 84   and name HB2   )(resid 84   and name HD2#  )     4.0  2.2 2.0
assign (resid 84   and name HB1   )(resid 84   and name HD1#  )     4.0  2.2 2.0
assign (resid 84   and name HB1   )(resid 84   and name HD2#  )     4.0  2.2 2.0
assign (resid 84   and name HB2   )(resid 85   and name HN    )     4.0  2.2 1.0
assign (resid 84   and name HB1   )(resid 85   and name HN    )     4.0  2.2 1.0
!assign (resid 84   and name HG    )(resid 84   and name HD1#  )     4.0  2.2 2.0
!assign (resid 84   and name HG    )(resid 84   and name HD2#  )     4.0  2.2 2.0
!assign (resid 84   and name HD1#  )(resid 84   and name HD2#  )     4.0  2.2 3.0
assign (resid 84   and name HD2#  )(resid 85   and name HN    )     4.0  2.2 2.0
!E85
assign (resid 85   and name HN    )(resid 85   and name HA    )     3.0  1.2 0.5
assign (resid 85   and name HN    )(resid 85   and name HB#   )     3.0  1.2 1.5
assign (resid 85   and name HN    )(resid 85   and name HG#   )     4.0  2.2 2.0
!assign (resid 85   and name HA    )(resid 85   and name HB#   )     3.0  1.2 1.5
assign (resid 85   and name HA    )(resid 85   and name HG#   )     4.0  2.2 2.0
assign (resid 85   and name HA    )(resid 86   and name HN    )     4.0  2.2 1.0
!assign (resid 85   and name HB#   )(resid 85   and name HG#   )     4.0  2.2 3.0
assign (resid 85   and name HB#   )(resid 86   and name HN    )     4.0  2.2 2.0
assign (resid 85   and name HG#   )(resid 86   and name HN    )     4.0  2.2 2.0
!H86
assign (resid 86   and name HN    )(resid 86   and name HA    )     4.0  2.2 1.0
!assign (resid 86   and name HA    )(resid 86   and name HB#   )     3.0  1.2 1.5
assign (resid 86   and name HB#   )(resid 87   and name HN    )     4.0  2.2 2.0
assign (resid 86   and name HB#   )(resid 87   and name HA    )     4.0  2.2 2.0
!H87
assign (resid 87   and name HN    )(resid 87   and name HA    )     4.0  2.2 1.0


----------------------------------
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          1HT       MET   1  14.835   1.005  -3.780
    2   2H    MET   1          2HT       MET   1  14.224   0.441  -2.299
    3   3H    MET   1          3HT       MET   1  14.671   2.071  -2.472
    4    HA   MET   1           HA       MET   1  12.400   2.211  -2.657
    5   1HB   MET   1          2HB       MET   1  13.658   1.848  -5.380
    6   2HB   MET   1          3HB       MET   1  11.962   2.302  -5.207
    7   1HG   MET   1          2HG       MET   1  12.780   4.183  -3.668
    8   2HG   MET   1          3HG       MET   1  14.399   3.827  -4.270
    9   1HE   MET   1          1HE       MET   1  15.325   4.324  -6.390
   10   2HE   MET   1          2HE       MET   1  15.083   5.883  -5.606
   11   3HE   MET   1          3HE       MET   1  14.745   5.708  -7.327
   12    H    LYS   2           H        LYS   2  12.639  -0.318  -1.726
   13    HA   LYS   2           HA       LYS   2  10.373  -1.634  -2.883
   14   1HB   LYS   2          2HB       LYS   2  11.696  -3.793  -3.342
   15   2HB   LYS   2          3HB       LYS   2  11.824  -2.502  -4.535
   16   1HG   LYS   2          2HG       LYS   2  13.944  -1.756  -3.517
   17   2HG   LYS   2          3HG       LYS   2  13.818  -3.034  -2.309
   18   1HD   LYS   2          2HD       LYS   2  15.310  -3.784  -4.078
   19   2HD   LYS   2          3HD       LYS   2  13.818  -4.720  -4.165
   20   1HE   LYS   2          2HE       LYS   2  13.104  -3.663  -6.104
   21   2HE   LYS   2          3HE       LYS   2  14.018  -2.193  -5.765
   22   1HZ   LYS   2          1HZ       LYS   2  15.898  -4.178  -5.983
   23   2HZ   LYS   2          1HZ       LYS   2  15.549  -2.981  -7.138
   24   3HZ   LYS   2          3HZ       LYS   2  14.798  -4.502  -7.232
   25    H    ILE   3           H        ILE   3  10.276  -0.876  -0.463
   26    HA   ILE   3           HA       ILE   3  10.078  -1.445   1.751
   27    HB   ILE   3           HB       ILE   3  10.147  -4.253   0.617
   28   1HG1  ILE   3          2HG1      ILE   3   7.698  -2.630   1.326
   29   2HG1  ILE   3          3HG1      ILE   3   8.417  -2.537  -0.281
   30   1HG2  ILE   3          1HG2      ILE   3   8.656  -4.609   2.710
   31   2HG2  ILE   3          2HG2      ILE   3  10.396  -4.466   2.960
   32   3HG2  ILE   3          3HG2      ILE   3   9.342  -3.089   3.285
   33   1HD1  ILE   3          1HD1      ILE   3   6.524  -4.333   0.305
   34   2HD1  ILE   3          2HD1      ILE   3   7.828  -4.699  -0.824
   35   3HD1  ILE   3          3HD1      ILE   3   7.924  -5.258   0.846
   36    H    ILE   4           H        ILE   4  11.915  -0.787   2.763
   37    HA   ILE   4           HA       ILE   4  14.273  -2.559   2.647
   38    HB   ILE   4           HB       ILE   4  14.273   0.206   3.826
   39   1HG1  ILE   4          2HG1      ILE   4  13.242   0.399   1.581
   40   2HG1  ILE   4          3HG1      ILE   4  14.858   1.100   1.603
   41   1HG2  ILE   4          1HG2      ILE   4  16.626   0.127   3.083
   42   2HG2  ILE   4          2HG2      ILE   4  16.248  -1.235   4.136
   43   3HG2  ILE   4          3HG2      ILE   4  16.355  -1.473   2.392
   44   1HD1  ILE   4          1HD1      ILE   4  14.174  -1.687   0.616
   45   2HD1  ILE   4          2HD1      ILE   4  14.506  -0.293  -0.410
   46   3HD1  ILE   4          3HD1      ILE   4  15.779  -0.956   0.613
   47    H    SER   5           H        SER   5  11.925  -1.143   4.855
   48    HA   SER   5           HA       SER   5  12.484  -3.080   6.863
   49   1HB   SER   5          2HB       SER   5  13.442  -1.659   8.588
   50   2HB   SER   5          3HB       SER   5  14.487  -1.646   7.172
   51    HG   SER   5           HG       SER   5  12.449   0.272   7.458
   52    H    ILE   6           H        ILE   6  10.871  -3.214   8.331
   53    HA   ILE   6           HA       ILE   6   8.628  -1.342   8.029
   54    HB   ILE   6           HB       ILE   6   8.672  -3.901   9.639
   55   1HG1  ILE   6          2HG1      ILE   6   9.385  -4.474   7.374
   56   2HG1  ILE   6          3HG1      ILE   6   7.715  -4.988   7.599
   57   1HG2  ILE   6          1HG2      ILE   6   6.573  -2.046   8.547
   58   2HG2  ILE   6          2HG2      ILE   6   6.187  -3.749   8.788
   59   3HG2  ILE   6          3HG2      ILE   6   6.701  -2.761  10.154
   60   1HD1  ILE   6          1HD1      ILE   6   8.795  -2.726   5.952
   61   2HD1  ILE   6          2HD1      ILE   6   7.558  -3.914   5.544
   62   3HD1  ILE   6          3HD1      ILE   6   7.174  -2.581   6.633
   63    H    SER   7           H        SER   7   7.381  -1.062  10.241
   64    HA   SER   7           HA       SER   7   9.265  -0.620  12.456
   65   1HB   SER   7          2HB       SER   7   8.894   1.483  10.966
   66   2HB   SER   7          3HB       SER   7   7.307   1.540  11.727
   67    HG   SER   7           HG       SER   7   9.706   1.286  13.208
   68    H    GLU   8           H        GLU   8   8.395  -0.911  14.442
   69    HA   GLU   8           HA       GLU   8   5.828  -2.181  14.621
   70   1HB   GLU   8          2HB       GLU   8   7.281  -1.319  17.075
   71   2HB   GLU   8          3HB       GLU   8   6.473  -2.841  16.721
   72   1HG   GLU   8          2HG       GLU   8   9.188  -1.928  15.743
   73   2HG   GLU   8          3HG       GLU   8   8.824  -3.313  16.769
   74    H    THR   9           H        THR   9   4.029  -1.463  15.735
   75    HA   THR   9           HA       THR   9   3.946   1.282  16.737
   76    HB   THR   9           HB       THR   9   3.362   1.813  14.527
   77    HG1  THR   9           HG1      THR   9   0.815   1.030  15.409
   78   1HG2  THR   9          1HG2      THR   9   1.604   0.240  13.368
   79   2HG2  THR   9          2HG2      THR   9   3.307  -0.221  13.402
   80   3HG2  THR   9          3HG2      THR   9   2.176  -0.939  14.547
   81    HA   PRO  10           HA       PRO  10   1.262  -0.359  19.784
   82   1HB   PRO  10          2HB       PRO  10  -0.833   1.584  19.429
   83   2HB   PRO  10          3HB       PRO  10   0.400   1.524  20.697
   84   1HG   PRO  10          2HG       PRO  10   0.283   3.173  18.302
   85   2HG   PRO  10          3HG       PRO  10   1.274   3.362  19.756
   86   1HD   PRO  10          2HD       PRO  10   2.275   2.617  17.301
   87   2HD   PRO  10          3HD       PRO  10   3.047   2.214  18.850
   88    H    ASN  11           H        ASN  11  -0.326   0.711  16.796
   89    HA   ASN  11           HA       ASN  11  -2.366  -1.383  17.076
   90   1HB   ASN  11          2HB       ASN  11  -2.726   1.129  16.320
   91   2HB   ASN  11          3HB       ASN  11  -2.251   0.495  14.747
   92   1HD2  ASN  11          2HD2      ASN  11  -4.897   1.450  15.170
   93   2HD2  ASN  11          1HD2      ASN  11  -5.967   0.134  15.114
   94    H    HIS  12           H        HIS  12  -2.951  -2.325  14.756
   95    HA   HIS  12           HA       HIS  12  -0.504  -3.049  13.295
   96   1HB   HIS  12          2HB       HIS  12  -1.159  -4.752  15.155
   97   2HB   HIS  12          3HB       HIS  12  -2.470  -5.195  14.063
   98    HD1  HIS  12           HD1      HIS  12  -0.617  -7.426  14.396
   99    HD2  HIS  12           HD2      HIS  12   0.244  -4.386  11.676
  100    HE1  HIS  12           HE1      HIS  12   1.037  -8.392  12.740
  101    H    ASN  13           H        ASN  13  -3.095  -1.474  12.915
  102    HA   ASN  13           HA       ASN  13  -4.413  -2.945  10.766
  103   1HB   ASN  13          2HB       ASN  13  -5.838  -1.670  12.230
  104   2HB   ASN  13          3HB       ASN  13  -4.882  -0.213  11.981
  105   1HD2  ASN  13          2HD2      ASN  13  -7.514  -2.095  10.752
  106   2HD2  ASN  13          1HD2      ASN  13  -7.796  -1.175   9.354
  107    H    THR  14           H        THR  14  -1.979  -0.512  11.203
  108    HA   THR  14           HA       THR  14  -1.506  -0.475   8.330
  109    HB   THR  14           HB       THR  14  -3.085   1.408   8.719
  110    HG1  THR  14           HG1      THR  14  -0.958   1.386   7.354
  111   1HG2  THR  14          1HG2      THR  14  -2.699   3.086  10.249
  112   2HG2  THR  14          2HG2      THR  14  -1.902   1.762  11.097
  113   3HG2  THR  14          3HG2      THR  14  -0.946   2.910  10.160
  114    H    MET  15           H        MET  15   0.596  -0.528   7.904
  115    HA   MET  15           HA       MET  15   2.478   0.246  10.060
  116   1HB   MET  15          2HB       MET  15   4.040  -1.422   8.999
  117   2HB   MET  15          3HB       MET  15   2.607  -2.131   9.743
  118   1HG   MET  15          2HG       MET  15   1.542  -2.436   7.623
  119   2HG   MET  15          3HG       MET  15   2.735  -1.431   6.802
  120   1HE   MET  15          1HE       MET  15   2.224  -5.159   6.130
  121   2HE   MET  15          2HE       MET  15   3.418  -4.422   5.066
  122   3HE   MET  15          3HE       MET  15   1.992  -3.506   5.545
  123    H    LYS  16           H        LYS  16   4.487   1.192   9.402
  124    HA   LYS  16           HA       LYS  16   4.197   2.787   6.959
  125   1HB   LYS  16          2HB       LYS  16   5.730   4.310   7.892
  126   2HB   LYS  16          3HB       LYS  16   4.752   3.782   9.261
  127   1HG   LYS  16          2HG       LYS  16   6.592   1.970   9.592
  128   2HG   LYS  16          3HG       LYS  16   7.578   3.002   8.555
  129   1HD   LYS  16          2HD       LYS  16   6.286   3.769  11.190
  130   2HD   LYS  16          3HD       LYS  16   8.011   3.622  10.856
  131   1HE   LYS  16          2HE       LYS  16   7.742   5.917  10.643
  132   2HE   LYS  16          3HE       LYS  16   7.474   5.411   8.975
  133   1HZ   LYS  16          1HZ       LYS  16   5.081   5.264  10.507
  134   2HZ   LYS  16          1HZ       LYS  16   5.385   6.107   9.064
  135   3HZ   LYS  16          3HZ       LYS  16   5.737   6.827  10.562
  136    H    ILE  17           H        ILE  17   5.469   2.588   5.215
  137    HA   ILE  17           HA       ILE  17   7.430   0.396   5.206
  138    HB   ILE  17           HB       ILE  17   6.272   1.937   2.868
  139   1HG1  ILE  17          2HG1      ILE  17   5.521  -0.843   3.813
  140   2HG1  ILE  17          3HG1      ILE  17   4.620   0.595   4.291
  141   1HG2  ILE  17          1HG2      ILE  17   7.138   0.038   1.557
  142   2HG2  ILE  17          2HG2      ILE  17   8.445   0.826   2.439
  143   3HG2  ILE  17          3HG2      ILE  17   7.777  -0.696   3.027
  144   1HD1  ILE  17          1HD1      ILE  17   5.184   0.103   1.380
  145   2HD1  ILE  17          2HD1      ILE  17   3.860  -0.753   2.169
  146   3HD1  ILE  17          3HD1      ILE  17   3.865   1.010   2.120
  147    H    THR  18           H        THR  18   9.526   0.830   5.303
  148    HA   THR  18           HA       THR  18  10.473   3.572   5.050
  149    HB   THR  18           HB       THR  18  11.986   1.023   5.676
  150    HG1  THR  18           HG1      THR  18  11.849   1.853   7.810
  151   1HG2  THR  18          1HG2      THR  18  12.728   3.951   5.724
  152   2HG2  THR  18          2HG2      THR  18  13.614   2.743   6.655
  153   3HG2  THR  18          3HG2      THR  18  13.555   2.631   4.896
  154    H    LEU  19           H        LEU  19  11.490   4.397   3.323
  155    HA   LEU  19           HA       LEU  19  11.960   2.619   1.022
  156   1HB   LEU  19          2HB       LEU  19  11.985   5.638   0.995
  157   2HB   LEU  19          3HB       LEU  19  11.759   4.535  -0.363
  158    HG   LEU  19           HG       LEU  19   9.836   4.844   1.966
  159   1HD1  LEU  19          1HD1      LEU  19   8.382   5.990   0.398
  160   2HD1  LEU  19          2HD1      LEU  19   9.944   6.808   0.406
  161   3HD1  LEU  19          3HD1      LEU  19   9.524   5.723  -0.919
  162   1HD2  LEU  19          1HD2      LEU  19   9.787   3.185  -0.571
  163   2HD2  LEU  19          2HD2      LEU  19   9.681   2.610   1.093
  164   3HD2  LEU  19          3HD2      LEU  19   8.341   3.511   0.385
  165    H    SER  20           H        SER  20  13.882   3.070  -0.316
  166    HA   SER  20           HA       SER  20  16.260   3.024   1.239
  167   1HB   SER  20          2HB       SER  20  17.412   2.798  -0.852
  168   2HB   SER  20          3HB       SER  20  15.912   1.886  -0.990
  169    HG   SER  20           HG       SER  20  16.001   3.123  -2.793
  170    H    GLU  21           H        GLU  21  14.304   5.553   0.350
  171    HA   GLU  21           HA       GLU  21  16.453   7.486  -0.028
  172   1HB   GLU  21          2HB       GLU  21  13.446   7.661  -0.160
  173   2HB   GLU  21          3HB       GLU  21  14.471   9.095  -0.207
  174   1HG   GLU  21          2HG       GLU  21  14.991   6.781  -2.067
  175   2HG   GLU  21          3HG       GLU  21  13.779   7.997  -2.466
  176    H    SER  22           H        SER  22  16.334   9.543   1.241
  177    HA   SER  22           HA       SER  22  15.200   9.327   3.919
  178   1HB   SER  22          2HB       SER  22  17.344   9.711   5.038
  179   2HB   SER  22          3HB       SER  22  17.395   8.209   4.120
  180    HG   SER  22           HG       SER  22  18.658  10.659   3.657
  181    H    ARG  23           H        ARG  23  15.774  11.374   5.200
  182    HA   ARG  23           HA       ARG  23  15.338  13.640   5.339
  183   1HB   ARG  23          2HB       ARG  23  17.471  13.720   3.190
  184   2HB   ARG  23          3HB       ARG  23  17.057  15.015   4.311
  185   1HG   ARG  23          2HG       ARG  23  17.894  12.316   5.357
  186   2HG   ARG  23          3HG       ARG  23  19.106  13.495   4.859
  187   1HD   ARG  23          2HD       ARG  23  17.850  15.164   6.365
  188   2HD   ARG  23          3HD       ARG  23  17.036  13.755   7.041
  189    HE   ARG  23           HE       ARG  23  19.913  13.506   7.008
  190   1HH1  ARG  23          1HH1      ARG  23  17.493  15.352   8.596
  191   2HH1  ARG  23          2HH1      ARG  23  18.114  15.074  10.189
  192   1HH2  ARG  23          1HH2      ARG  23  20.582  12.881   9.134
  193   2HH2  ARG  23          2HH2      ARG  23  19.861  13.676  10.493
  194    H    GLU  24           H        GLU  24  15.647  15.641   3.345
  195    HA   GLU  24           HA       GLU  24  14.079  16.788   2.055
  196   1HB   GLU  24          2HB       GLU  24  14.962  14.461   0.335
  197   2HB   GLU  24          3HB       GLU  24  14.149  15.901  -0.280
  198   1HG   GLU  24          2HG       GLU  24  15.982  17.295   0.702
  199   2HG   GLU  24          3HG       GLU  24  16.814  15.812   1.164
  200    H    GLY  25           H        GLY  25  13.212  13.893   0.373
  201   1HA   GLY  25          1HA       GLY  25  11.200  12.580   1.272
  202   2HA   GLY  25          2HA       GLY  25  10.433  14.166   1.337
  203    H    MET  26           H        MET  26  10.040  11.614  -0.324
  204    HA   MET  26           HA       MET  26  10.434  12.630  -3.035
  205   1HB   MET  26          2HB       MET  26   9.207  10.022  -2.097
  206   2HB   MET  26          3HB       MET  26   9.668  10.427  -3.751
  207   1HG   MET  26          2HG       MET  26  11.915  10.170  -3.335
  208   2HG   MET  26          3HG       MET  26  11.776  10.709  -1.661
  209   1HE   MET  26          1HE       MET  26   9.752   7.249  -3.341
  210   2HE   MET  26          2HE       MET  26  11.424   6.832  -3.710
  211   3HE   MET  26          3HE       MET  26  10.777   8.388  -4.224
  212    H    THR  27           H        THR  27   7.781  10.744  -3.224
  213    HA   THR  27           HA       THR  27   6.032  12.957  -3.777
  214    HB   THR  27           HB       THR  27   4.348  11.066  -4.146
  215    HG1  THR  27           HG1      THR  27   6.313   9.746  -2.925
  216   1HG2  THR  27          1HG2      THR  27   5.429  11.965  -6.060
  217   2HG2  THR  27          2HG2      THR  27   6.980  11.253  -5.614
  218   3HG2  THR  27          3HG2      THR  27   5.665  10.222  -6.179
  219    H    SER  28           H        SER  28   3.819  13.075  -2.851
  220    HA   SER  28           HA       SER  28   3.396  11.966  -0.215
  221   1HB   SER  28          2HB       SER  28   3.191  14.190   0.888
  222   2HB   SER  28          3HB       SER  28   4.839  13.819   0.390
  223    HG   SER  28           HG       SER  28   3.059  15.725  -0.548
  224    H    ASP  29           H        ASP  29   1.431  11.191  -0.771
  225    HA   ASP  29           HA       ASP  29  -0.762  13.041  -1.006
  226   1HB   ASP  29          2HB       ASP  29   0.259  11.555  -3.384
  227   2HB   ASP  29          3HB       ASP  29  -1.486  11.675  -3.175
  228    H    THR  30           H        THR  30  -2.846  11.945  -0.982
  229    HA   THR  30           HA       THR  30  -2.667   9.325   0.361
  230    HB   THR  30           HB       THR  30  -5.073  11.148   0.280
  231    HG1  THR  30           HG1      THR  30  -3.820  11.283   2.596
  232   1HG2  THR  30          1HG2      THR  30  -4.226   9.172   2.400
  233   2HG2  THR  30          2HG2      THR  30  -5.821   9.875   2.138
  234   3HG2  THR  30          3HG2      THR  30  -5.186   8.683   1.005
  235    H    TYR  31           H        TYR  31  -3.603   7.542  -0.494
  236    HA   TYR  31           HA       TYR  31  -5.159   7.875  -2.993
  237   1HB   TYR  31          2HB       TYR  31  -3.532   5.423  -2.336
  238   2HB   TYR  31          3HB       TYR  31  -4.148   5.948  -3.902
  239    HD1  TYR  31           HD1      TYR  31  -1.196   5.482  -2.371
  240    HD2  TYR  31           HD2      TYR  31  -3.401   8.721  -4.134
  241    HE1  TYR  31           HE1      TYR  31   0.924   6.697  -2.794
  242    HE2  TYR  31           HE2      TYR  31  -1.282   9.934  -4.554
  243    HH   TYR  31           HH       TYR  31   1.665   8.543  -4.540
  244    H    THR  32           H        THR  32  -7.223   7.597  -2.432
  245    HA   THR  32           HA       THR  32  -7.924   5.229  -0.799
  246    HB   THR  32           HB       THR  32  -8.562   6.897   0.656
  247    HG1  THR  32           HG1      THR  32 -10.556   6.302   0.550
  248   1HG2  THR  32          1HG2      THR  32  -9.575   9.100  -0.287
  249   2HG2  THR  32          2HG2      THR  32  -7.835   8.849  -0.428
  250   3HG2  THR  32          3HG2      THR  32  -8.881   8.578  -1.822
  251    H    LYS  33           H        LYS  33  -8.055   6.573  -3.818
  252    HA   LYS  33           HA       LYS  33 -10.163   4.748  -4.654
  253   1HB   LYS  33          2HB       LYS  33 -11.302   6.635  -5.947
  254   2HB   LYS  33          3HB       LYS  33 -11.565   6.619  -4.203
  255   1HG   LYS  33          2HG       LYS  33 -10.182   8.457  -3.836
  256   2HG   LYS  33          3HG       LYS  33  -9.246   8.177  -5.304
  257   1HD   LYS  33          2HD       LYS  33 -11.054   8.968  -6.695
  258   2HD   LYS  33          3HD       LYS  33 -12.149   9.048  -5.314
  259   1HE   LYS  33          2HE       LYS  33 -10.774  10.801  -4.291
  260   2HE   LYS  33          3HE       LYS  33  -9.617  10.693  -5.617
  261   1HZ   LYS  33          1HZ       LYS  33 -11.065  11.658  -7.085
  262   2HZ   LYS  33          1HZ       LYS  33 -11.481  12.477  -5.655
  263   3HZ   LYS  33          3HZ       LYS  33 -12.447  11.198  -6.216
  264    H    VAL  34           H        VAL  34  -7.315   4.935  -5.081
  265    HA   VAL  34           HA       VAL  34  -5.732   4.863  -6.743
  266    HB   VAL  34           HB       VAL  34  -8.115   4.260  -8.506
  267   1HG1  VAL  34          1HG1      VAL  34  -5.151   3.904  -8.706
  268   2HG1  VAL  34          2HG1      VAL  34  -6.178   2.643  -9.388
  269   3HG1  VAL  34          3HG1      VAL  34  -6.319   4.303  -9.966
  270   1HG2  VAL  34          1HG2      VAL  34  -6.482   2.337  -6.823
  271   2HG2  VAL  34          2HG2      VAL  34  -8.090   2.911  -6.386
  272   3HG2  VAL  34          3HG2      VAL  34  -7.867   1.935  -7.837
  273    H    ASP  35           H        ASP  35  -5.309   5.683  -9.145
  274    HA   ASP  35           HA       ASP  35  -5.004   7.485 -10.527
  275   1HB   ASP  35          2HB       ASP  35  -7.530   7.200 -10.732
  276   2HB   ASP  35          3HB       ASP  35  -7.674   8.510  -9.562
  277    H    ASP  36           H        ASP  36  -3.406   8.745  -9.850
  278    HA   ASP  36           HA       ASP  36  -3.762  11.227  -8.653
  279   1HB   ASP  36          2HB       ASP  36  -3.615   9.025  -6.728
  280   2HB   ASP  36          3HB       ASP  36  -2.345  10.214  -6.474
  281    H    SER  37           H        SER  37  -2.217   9.450 -10.564
  282    HA   SER  37           HA       SER  37  -0.205   9.643 -11.649
  283   1HB   SER  37          2HB       SER  37   1.061  11.525 -11.362
  284   2HB   SER  37          3HB       SER  37  -0.374  12.054 -10.493
  285    HG   SER  37           HG       SER  37   2.103  11.150  -9.522
  286    H    GLN  38           H        GLN  38  -0.820   7.917  -9.178
  287    HA   GLN  38           HA       GLN  38   1.831   7.377  -8.108
  288   1HB   GLN  38          2HB       GLN  38  -0.239   5.361  -7.589
  289   2HB   GLN  38          3HB       GLN  38   0.763   6.262  -6.456
  290   1HG   GLN  38          2HG       GLN  38  -1.283   7.167  -5.924
  291   2HG   GLN  38          3HG       GLN  38  -0.836   8.269  -7.223
  292   1HE2  GLN  38          2HE2      GLN  38  -3.157   5.904  -6.221
  293   2HE2  GLN  38          1HE2      GLN  38  -4.037   5.845  -7.672
  294    HA   PRO  39           HA       PRO  39   2.896   4.085 -10.823
  295   1HB   PRO  39          2HB       PRO  39   3.519   2.096  -8.829
  296   2HB   PRO  39          3HB       PRO  39   4.636   3.148  -9.710
  297   1HG   PRO  39          2HG       PRO  39   4.059   3.289  -7.003
  298   2HG   PRO  39          3HG       PRO  39   4.839   4.549  -7.969
  299   1HD   PRO  39          2HD       PRO  39   2.045   4.413  -6.970
  300   2HD   PRO  39          3HD       PRO  39   3.035   5.830  -7.379
  301    H    ALA  40           H        ALA  40   1.698   2.685 -12.013
  302    HA   ALA  40           HA       ALA  40  -0.836   1.813 -11.400
  303   1HB   ALA  40          1HB       ALA  40  -0.358  -0.059 -13.093
  304   2HB   ALA  40          2HB       ALA  40  -0.153   1.601 -13.652
  305   3HB   ALA  40          3HB       ALA  40   1.258   0.635 -13.221
  306    H    PHE  41           H        PHE  41   2.237   0.263 -10.666
  307    HA   PHE  41           HA       PHE  41   1.368  -2.239  -9.812
  308   1HB   PHE  41          2HB       PHE  41   3.553  -0.729  -8.392
  309   2HB   PHE  41          3HB       PHE  41   3.446  -2.456  -8.729
  310    HD1  PHE  41           HD1      PHE  41   5.239   0.306  -9.616
  311    HD2  PHE  41           HD2      PHE  41   2.911  -2.791 -11.475
  312    HE1  PHE  41           HE1      PHE  41   6.482   0.641 -11.735
  313    HE2  PHE  41           HE2      PHE  41   4.155  -2.453 -13.592
  314    HZ   PHE  41           HZ       PHE  41   5.940  -0.738 -13.722
  315    H    ILE  42           H        ILE  42   1.257   0.875  -8.173
  316    HA   ILE  42           HA       ILE  42   0.512  -0.229  -5.614
  317    HB   ILE  42           HB       ILE  42   0.696   2.541  -6.763
  318   1HG1  ILE  42          2HG1      ILE  42   2.619   1.123  -5.718
  319   2HG1  ILE  42          3HG1      ILE  42   2.439   2.798  -5.202
  320   1HG2  ILE  42          1HG2      ILE  42  -0.726   1.700  -4.232
  321   2HG2  ILE  42          2HG2      ILE  42  -0.020   3.306  -4.410
  322   3HG2  ILE  42          3HG2      ILE  42  -1.301   2.780  -5.501
  323   1HD1  ILE  42          1HD1      ILE  42   0.920   0.743  -3.668
  324   2HD1  ILE  42          2HD1      ILE  42   2.668   0.785  -3.443
  325   3HD1  ILE  42          3HD1      ILE  42   1.700   2.219  -3.102
  326    H    ASN  43           H        ASN  43  -1.154   0.705  -8.521
  327    HA   ASN  43           HA       ASN  43  -3.715   1.215  -7.450
  328   1HB   ASN  43          2HB       ASN  43  -2.912   0.016 -10.116
  329   2HB   ASN  43          3HB       ASN  43  -4.538   0.538  -9.706
  330   1HD2  ASN  43          2HD2      ASN  43  -1.899   2.432  -8.393
  331   2HD2  ASN  43          1HD2      ASN  43  -2.070   3.749  -9.448
  332    H    ASP  44           H        ASP  44  -1.941  -1.698  -8.256
  333    HA   ASP  44           HA       ASP  44  -3.996  -3.602  -8.024
  334   1HB   ASP  44          2HB       ASP  44  -1.479  -3.839  -8.745
  335   2HB   ASP  44          3HB       ASP  44  -1.219  -4.167  -7.033
  336    H    ILE  45           H        ILE  45  -1.682  -2.394  -5.604
  337    HA   ILE  45           HA       ILE  45  -2.502  -3.804  -3.373
  338    HB   ILE  45           HB       ILE  45  -1.522  -0.946  -3.583
  339   1HG1  ILE  45          2HG1      ILE  45  -0.127  -3.567  -2.940
  340   2HG1  ILE  45          3HG1      ILE  45   0.019  -2.668  -4.450
  341   1HG2  ILE  45          1HG2      ILE  45  -2.651  -1.257  -1.437
  342   2HG2  ILE  45          2HG2      ILE  45  -1.773  -2.762  -1.165
  343   3HG2  ILE  45          3HG2      ILE  45  -0.907  -1.226  -1.184
  344   1HD1  ILE  45          1HD1      ILE  45   1.639  -1.391  -3.555
  345   2HD1  ILE  45          2HD1      ILE  45   0.546  -0.877  -2.270
  346   3HD1  ILE  45          3HD1      ILE  45   1.532  -2.324  -2.063
  347    H    LEU  46           H        LEU  46  -3.750  -0.660  -4.508
  348    HA   LEU  46           HA       LEU  46  -5.704  -0.358  -2.491
  349   1HB   LEU  46          2HB       LEU  46  -5.652   0.734  -5.317
  350   2HB   LEU  46          3HB       LEU  46  -6.734   1.285  -4.038
  351    HG   LEU  46           HG       LEU  46  -3.705   1.344  -3.862
  352   1HD1  LEU  46          1HD1      LEU  46  -3.840   3.707  -4.286
  353   2HD1  LEU  46          2HD1      LEU  46  -4.735   2.906  -5.576
  354   3HD1  LEU  46          3HD1      LEU  46  -5.603   3.674  -4.247
  355   1HD2  LEU  46          1HD2      LEU  46  -5.967   2.159  -2.049
  356   2HD2  LEU  46          2HD2      LEU  46  -4.481   1.298  -1.652
  357   3HD2  LEU  46          3HD2      LEU  46  -4.436   3.031  -1.978
  358    H    LYS  47           H        LYS  47  -5.763  -1.943  -5.643
  359    HA   LYS  47           HA       LYS  47  -8.597  -2.542  -5.466
  360   1HB   LYS  47          2HB       LYS  47  -6.430  -3.240  -7.446
  361   2HB   LYS  47          3HB       LYS  47  -8.062  -3.900  -7.564
  362   1HG   LYS  47          2HG       LYS  47  -8.982  -1.601  -7.601
  363   2HG   LYS  47          3HG       LYS  47  -7.344  -0.952  -7.518
  364   1HD   LYS  47          2HD       LYS  47  -6.780  -1.841  -9.665
  365   2HD   LYS  47          3HD       LYS  47  -8.234  -2.840  -9.710
  366   1HE   LYS  47          2HE       LYS  47  -9.651  -0.962 -10.019
  367   2HE   LYS  47          3HE       LYS  47  -8.394   0.171  -9.527
  368   1HZ   LYS  47          1HZ       LYS  47  -8.471   0.302 -11.843
  369   2HZ   LYS  47          1HZ       LYS  47  -8.581  -1.383 -12.035
  370   3HZ   LYS  47          3HZ       LYS  47  -7.123  -0.677 -11.525
  371    H    VAL  48           H        VAL  48  -5.778  -3.885  -4.189
  372    HA   VAL  48           HA       VAL  48  -6.541  -6.661  -4.327
  373    HB   VAL  48           HB       VAL  48  -4.430  -5.151  -2.783
  374   1HG1  VAL  48          1HG1      VAL  48  -4.887  -6.838  -1.230
  375   2HG1  VAL  48          2HG1      VAL  48  -5.382  -7.987  -2.473
  376   3HG1  VAL  48          3HG1      VAL  48  -3.674  -7.609  -2.251
  377   1HG2  VAL  48          1HG2      VAL  48  -3.072  -5.780  -4.484
  378   2HG2  VAL  48          2HG2      VAL  48  -3.676  -7.435  -4.449
  379   3HG2  VAL  48          3HG2      VAL  48  -4.541  -6.201  -5.364
  380    H    GLU  49           H        GLU  49  -8.161  -7.495  -3.223
  381    HA   GLU  49           HA       GLU  49  -9.689  -6.253  -1.277
  382   1HB   GLU  49          2HB       GLU  49  -9.314  -9.233  -1.220
  383   2HB   GLU  49          3HB       GLU  49 -10.789  -8.291  -0.998
  384   1HG   GLU  49          2HG       GLU  49 -10.526  -7.567  -3.439
  385   2HG   GLU  49          3HG       GLU  49  -9.299  -8.825  -3.576
  386    H    GLY  50           H        GLY  50  -9.558  -5.963   0.872
  387   1HA   GLY  50          1HA       GLY  50  -8.868  -6.798   3.071
  388   2HA   GLY  50          2HA       GLY  50  -7.339  -7.273   2.335
  389    H    VAL  51           H        VAL  51  -7.203  -4.813   0.723
  390    HA   VAL  51           HA       VAL  51  -5.897  -3.137   2.683
  391    HB   VAL  51           HB       VAL  51  -6.256  -2.960  -0.313
  392   1HG1  VAL  51          1HG1      VAL  51  -5.130  -0.964   1.645
  393   2HG1  VAL  51          2HG1      VAL  51  -4.470  -1.076   0.013
  394   3HG1  VAL  51          3HG1      VAL  51  -6.172  -0.681   0.250
  395   1HG2  VAL  51          1HG2      VAL  51  -3.644  -3.063   1.157
  396   2HG2  VAL  51          2HG2      VAL  51  -4.591  -4.544   1.025
  397   3HG2  VAL  51          3HG2      VAL  51  -4.057  -3.705  -0.431
  398    H    LYS  52           H        LYS  52  -6.478  -1.069   3.296
  399    HA   LYS  52           HA       LYS  52  -9.304  -0.371   2.829
  400   1HB   LYS  52          2HB       LYS  52  -8.356  -0.690   5.192
  401   2HB   LYS  52          3HB       LYS  52  -7.490   0.823   4.924
  402   1HG   LYS  52          2HG       LYS  52  -9.793   1.791   4.242
  403   2HG   LYS  52          3HG       LYS  52 -10.471   0.362   5.021
  404   1HD   LYS  52          2HD       LYS  52  -8.861   1.071   7.002
  405   2HD   LYS  52          3HD       LYS  52  -8.974   2.657   6.241
  406   1HE   LYS  52          2HE       LYS  52 -11.164   0.994   7.467
  407   2HE   LYS  52          3HE       LYS  52 -10.764   2.685   7.762
  408   1HZ   LYS  52          1HZ       LYS  52 -12.350   3.160   6.304
  409   2HZ   LYS  52          1HZ       LYS  52 -12.488   1.546   5.793
  410   3HZ   LYS  52          3HZ       LYS  52 -11.326   2.566   5.090
  411    H    SER  53           H        SER  53  -6.096   1.175   3.122
  412    HA   SER  53           HA       SER  53  -6.492   2.808   0.816
  413   1HB   SER  53          2HB       SER  53  -6.396   5.001   2.178
  414   2HB   SER  53          3HB       SER  53  -7.948   4.178   2.059
  415    HG   SER  53           HG       SER  53  -7.702   4.545   4.189
  416    H    ILE  54           H        ILE  54  -4.765   4.698   0.903
  417    HA   ILE  54           HA       ILE  54  -2.332   3.791   2.296
  418    HB   ILE  54           HB       ILE  54  -2.563   4.330  -0.677
  419   1HG1  ILE  54          2HG1      ILE  54  -1.638   1.878   0.862
  420   2HG1  ILE  54          3HG1      ILE  54  -3.226   2.051   0.116
  421   1HG2  ILE  54          1HG2      ILE  54  -0.511   5.341   0.068
  422   2HG2  ILE  54          2HG2      ILE  54  -0.150   3.975   1.123
  423   3HG2  ILE  54          3HG2      ILE  54  -0.079   3.781  -0.629
  424   1HD1  ILE  54          1HD1      ILE  54  -1.747   2.653  -2.026
  425   2HD1  ILE  54          2HD1      ILE  54  -0.558   1.668  -1.174
  426   3HD1  ILE  54          3HD1      ILE  54  -2.123   0.982  -1.608
  427    H    PHE  55           H        PHE  55  -0.778   5.416   2.613
  428    HA   PHE  55           HA       PHE  55  -1.558   8.170   1.918
  429   1HB   PHE  55          2HB       PHE  55  -2.419   7.947   4.131
  430   2HB   PHE  55          3HB       PHE  55  -0.985   7.085   4.680
  431    HD1  PHE  55           HD1      PHE  55  -1.577  10.292   2.794
  432    HD2  PHE  55           HD2      PHE  55   0.290   8.358   6.148
  433    HE1  PHE  55           HE1      PHE  55  -0.538  12.443   3.459
  434    HE2  PHE  55           HE2      PHE  55   1.327  10.509   6.809
  435    HZ   PHE  55           HZ       PHE  55   0.913  12.551   5.466
  436    H    HIS  56           H        HIS  56   0.099   8.758   0.652
  437    HA   HIS  56           HA       HIS  56   2.827   7.901   1.311
  438   1HB   HIS  56          2HB       HIS  56   1.680   7.911  -1.062
  439   2HB   HIS  56          3HB       HIS  56   2.141   9.609  -1.056
  440    HD1  HIS  56           HD1      HIS  56   3.390   6.734  -2.435
  441    HD2  HIS  56           HD2      HIS  56   5.137   9.501   0.146
  442    HE1  HIS  56           HE1      HIS  56   5.895   6.487  -2.709
  443    H    VAL  57           H        VAL  57   4.312   9.222   2.182
  444    HA   VAL  57           HA       VAL  57   4.250  12.074   1.896
  445    HB   VAL  57           HB       VAL  57   2.478  11.429   3.711
  446   1HG1  VAL  57          1HG1      VAL  57   4.272   9.940   4.848
  447   2HG1  VAL  57          2HG1      VAL  57   4.925  11.455   5.471
  448   3HG1  VAL  57          3HG1      VAL  57   3.280  10.970   5.879
  449   1HG2  VAL  57          1HG2      VAL  57   4.626  13.537   3.883
  450   2HG2  VAL  57          2HG2      VAL  57   2.932  13.718   3.431
  451   3HG2  VAL  57          3HG2      VAL  57   3.369  13.443   5.116
  452    H    MET  58           H        MET  58   6.099  13.101   2.895
  453    HA   MET  58           HA       MET  58   8.395  13.147   3.152
  454   1HB   MET  58          2HB       MET  58   7.253  12.487   5.454
  455   2HB   MET  58          3HB       MET  58   8.118  10.974   5.192
  456   1HG   MET  58          2HG       MET  58  10.169  12.528   4.700
  457   2HG   MET  58          3HG       MET  58   9.230  13.746   5.563
  458   1HE   MET  58          1HE       MET  58   9.199  14.105   7.809
  459   2HE   MET  58          2HE       MET  58   9.286  12.927   9.116
  460   3HE   MET  58          3HE       MET  58   7.923  12.894   8.001
  461    H    ASP  59           H        ASP  59   9.718  10.599   4.326
  462    HA   ASP  59           HA       ASP  59  10.196   9.336   1.705
  463   1HB   ASP  59          2HB       ASP  59  12.281   8.459   2.855
  464   2HB   ASP  59          3HB       ASP  59  12.217  10.203   2.620
  465    H    PHE  60           H        PHE  60   7.849   8.611   3.145
  466    HA   PHE  60           HA       PHE  60   8.286   5.755   3.311
  467   1HB   PHE  60          2HB       PHE  60   7.532   5.431   5.574
  468   2HB   PHE  60          3HB       PHE  60   8.877   6.569   5.612
  469    HD1  PHE  60           HD1      PHE  60   5.188   6.239   5.838
  470    HD2  PHE  60           HD2      PHE  60   8.560   8.869   6.275
  471    HE1  PHE  60           HE1      PHE  60   3.743   7.904   6.970
  472    HE2  PHE  60           HE2      PHE  60   7.112  10.532   7.408
  473    HZ   PHE  60           HZ       PHE  60   4.705  10.050   7.756
  474    H    ILE  61           H        ILE  61   6.167   4.613   3.875
  475    HA   ILE  61           HA       ILE  61   3.815   6.175   3.018
  476    HB   ILE  61           HB       ILE  61   4.541   3.471   1.864
  477   1HG1  ILE  61          2HG1      ILE  61   4.598   6.202   0.535
  478   2HG1  ILE  61          3HG1      ILE  61   6.033   5.328   1.071
  479   1HG2  ILE  61          1HG2      ILE  61   2.136   3.848   1.987
  480   2HG2  ILE  61          2HG2      ILE  61   2.317   5.454   1.282
  481   3HG2  ILE  61          3HG2      ILE  61   2.653   4.021   0.311
  482   1HD1  ILE  61          1HD1      ILE  61   4.186   4.723  -1.204
  483   2HD1  ILE  61          2HD1      ILE  61   5.946   4.635  -1.136
  484   3HD1  ILE  61          3HD1      ILE  61   4.971   3.374  -0.383
  485    H    SER  62           H        SER  62   2.020   5.717   4.138
  486    HA   SER  62           HA       SER  62   2.133   3.512   6.091
  487   1HB   SER  62          2HB       SER  62   0.493   6.041   5.948
  488   2HB   SER  62          3HB       SER  62   0.140   4.745   7.087
  489    HG   SER  62           HG       SER  62   2.382   4.961   7.755
  490    H    VAL  63           H        VAL  63   1.239   1.689   5.375
  491    HA   VAL  63           HA       VAL  63  -1.105   1.834   3.590
  492    HB   VAL  63           HB       VAL  63   0.724  -0.505   4.201
  493   1HG1  VAL  63          1HG1      VAL  63  -0.434  -1.506   2.216
  494   2HG1  VAL  63          2HG1      VAL  63  -1.515  -1.251   3.585
  495   3HG1  VAL  63          3HG1      VAL  63  -1.546  -0.137   2.218
  496   1HG2  VAL  63          1HG2      VAL  63   1.691  -0.102   2.025
  497   2HG2  VAL  63          2HG2      VAL  63   0.503   1.151   1.668
  498   3HG2  VAL  63          3HG2      VAL  63   1.734   1.428   2.901
  499    H    ASP  64           H        ASP  64  -3.010   1.620   4.527
  500    HA   ASP  64           HA       ASP  64  -3.216   0.124   7.062
  501   1HB   ASP  64          2HB       ASP  64  -5.427   1.847   6.025
  502   2HB   ASP  64          3HB       ASP  64  -4.983   1.484   7.684
  503    H    LYS  65           H        LYS  65  -4.649  -1.539   7.302
  504    HA   LYS  65           HA       LYS  65  -6.117  -2.399   4.874
  505   1HB   LYS  65          2HB       LYS  65  -5.711  -4.729   5.591
  506   2HB   LYS  65          3HB       LYS  65  -4.199  -3.874   5.291
  507   1HG   LYS  65          2HG       LYS  65  -3.740  -3.631   7.601
  508   2HG   LYS  65          3HG       LYS  65  -5.405  -3.990   8.058
  509   1HD   LYS  65          2HD       LYS  65  -4.916  -6.302   6.884
  510   2HD   LYS  65          3HD       LYS  65  -3.233  -5.872   7.187
  511   1HE   LYS  65          2HE       LYS  65  -3.893  -7.088   9.117
  512   2HE   LYS  65          3HE       LYS  65  -3.975  -5.396   9.611
  513   1HZ   LYS  65          1HZ       LYS  65  -6.180  -5.491   9.832
  514   2HZ   LYS  65          1HZ       LYS  65  -5.984  -7.179   9.848
  515   3HZ   LYS  65          3HZ       LYS  65  -6.396  -6.382   8.405
  516    H    GLU  66           H        GLU  66  -7.622  -4.401   5.863
  517    HA   GLU  66           HA       GLU  66  -9.400  -2.989   7.732
  518   1HB   GLU  66          2HB       GLU  66  -9.947  -5.497   6.124
  519   2HB   GLU  66          3HB       GLU  66 -11.126  -4.512   6.989
  520   1HG   GLU  66          2HG       GLU  66 -10.277  -2.565   5.492
  521   2HG   GLU  66          3HG       GLU  66  -9.597  -3.839   4.480
  522    H    ASN  67           H        ASN  67  -9.697  -3.671   9.781
  523    HA   ASN  67           HA       ASN  67  -7.977  -5.403  11.082
  524   1HB   ASN  67          2HB       ASN  67  -9.577  -5.407  12.927
  525   2HB   ASN  67          3HB       ASN  67  -9.457  -3.792  12.232
  526   1HD2  ASN  67          2HD2      ASN  67 -11.524  -6.709  12.311
  527   2HD2  ASN  67          1HD2      ASN  67 -12.939  -5.911  11.819
  528    H    ASP  68           H        ASP  68 -10.816  -6.130   9.218
  529    HA   ASP  68           HA       ASP  68 -11.251  -8.779  10.201
  530   1HB   ASP  68          2HB       ASP  68 -12.873  -7.248   8.894
  531   2HB   ASP  68          3HB       ASP  68 -12.027  -7.816   7.454
  532    H    ALA  69           H        ALA  69  -9.283  -7.361   7.660
  533    HA   ALA  69           HA       ALA  69  -8.534  -9.953   6.561
  534   1HB   ALA  69          1HB       ALA  69  -8.831  -7.976   5.091
  535   2HB   ALA  69          2HB       ALA  69  -7.487  -7.186   5.916
  536   3HB   ALA  69          3HB       ALA  69  -7.207  -8.654   4.979
  537    H    ASN  70           H        ASN  70  -5.937  -9.802   5.998
  538    HA   ASN  70           HA       ASN  70  -4.511  -9.360   8.548
  539   1HB   ASN  70          2HB       ASN  70  -3.906 -11.759   6.841
  540   2HB   ASN  70          3HB       ASN  70  -3.536 -11.486   8.540
  541   1HD2  ASN  70          2HD2      ASN  70  -4.805 -12.793   9.848
  542   2HD2  ASN  70          1HD2      ASN  70  -6.417 -13.221   9.534
  543    H    TRP  71           H        TRP  71  -2.025  -9.994   7.953
  544    HA   TRP  71           HA       TRP  71  -1.333  -8.172   5.748
  545   1HB   TRP  71          2HB       TRP  71   0.080  -9.101   8.229
  546   2HB   TRP  71          3HB       TRP  71   1.015  -8.481   6.869
  547    HD1  TRP  71           HD1      TRP  71  -0.412  -7.291   9.920
  548    HE1  TRP  71           HE1      TRP  71  -0.923  -4.766   9.848
  549    HE3  TRP  71           HE3      TRP  71  -0.153  -6.483   4.884
  550    HZ2  TRP  71           HZ2      TRP  71  -1.183  -2.680   7.911
  551    HZ3  TRP  71           HZ3      TRP  71  -0.537  -4.218   3.954
  552    HH2  TRP  71           HH2      TRP  71  -1.052  -2.319   5.460
  553    H    GLU  72           H        GLU  72  -0.505 -11.357   7.071
  554    HA   GLU  72           HA       GLU  72   1.335 -12.211   5.175
  555   1HB   GLU  72          2HB       GLU  72  -0.705 -14.136   6.239
  556   2HB   GLU  72          3HB       GLU  72   1.027 -14.360   6.010
  557   1HG   GLU  72          2HG       GLU  72   0.954 -14.102   8.311
  558   2HG   GLU  72          3HG       GLU  72   1.185 -12.426   7.820
  559    H    THR  73           H        THR  73  -2.063 -11.724   4.825
  560    HA   THR  73           HA       THR  73  -2.298 -13.398   2.455
  561    HB   THR  73           HB       THR  73  -4.212 -13.272   3.962
  562    HG1  THR  73           HG1      THR  73  -5.396 -13.354   2.255
  563   1HG2  THR  73          1HG2      THR  73  -4.652 -10.390   3.268
  564   2HG2  THR  73          2HG2      THR  73  -5.219 -11.302   4.666
  565   3HG2  THR  73          3HG2      THR  73  -3.536 -10.788   4.572
  566    H    VAL  74           H        VAL  74  -2.300  -9.984   3.316
  567    HA   VAL  74           HA       VAL  74  -2.567  -9.068   0.605
  568    HB   VAL  74           HB       VAL  74  -2.613  -7.955   3.287
  569   1HG1  VAL  74          1HG1      VAL  74  -1.164  -6.389   1.134
  570   2HG1  VAL  74          2HG1      VAL  74  -1.783  -5.699   2.634
  571   3HG1  VAL  74          3HG1      VAL  74  -0.500  -6.907   2.684
  572   1HG2  VAL  74          1HG2      VAL  74  -3.559  -6.775   0.667
  573   2HG2  VAL  74          2HG2      VAL  74  -4.432  -8.051   1.515
  574   3HG2  VAL  74          3HG2      VAL  74  -4.207  -6.479   2.281
  575    H    LEU  75           H        LEU  75   0.106  -9.436   2.897
  576    HA   LEU  75           HA       LEU  75   2.106  -7.977   1.725
  577   1HB   LEU  75          2HB       LEU  75   1.967 -10.226   3.534
  578   2HB   LEU  75          3HB       LEU  75   3.360 -10.377   2.466
  579    HG   LEU  75           HG       LEU  75   3.989  -8.019   3.027
  580   1HD1  LEU  75          1HD1      LEU  75   2.114  -6.884   3.770
  581   2HD1  LEU  75          2HD1      LEU  75   1.488  -8.277   4.649
  582   3HD1  LEU  75          3HD1      LEU  75   2.815  -7.334   5.324
  583   1HD2  LEU  75          1HD2      LEU  75   5.240  -9.530   4.279
  584   2HD2  LEU  75          2HD2      LEU  75   4.442  -8.627   5.566
  585   3HD2  LEU  75          3HD2      LEU  75   3.819 -10.204   5.078
  586    HA   PRO  76           HA       PRO  76   3.356 -11.883  -1.052
  587   1HB   PRO  76          2HB       PRO  76   0.807 -12.956  -1.864
  588   2HB   PRO  76          3HB       PRO  76   2.133 -13.782  -1.033
  589   1HG   PRO  76          2HG       PRO  76  -0.342 -12.688   0.048
  590   2HG   PRO  76          3HG       PRO  76   0.772 -13.866   0.751
  591   1HD   PRO  76          2HD       PRO  76   0.504 -11.308   1.692
  592   2HD   PRO  76          3HD       PRO  76   2.005 -12.248   1.844
  593    H    LYS  77           H        LYS  77   0.412  -9.962  -1.353
  594    HA   LYS  77           HA       LYS  77   0.658  -9.673  -4.229
  595   1HB   LYS  77          2HB       LYS  77  -1.171  -8.450  -2.158
  596   2HB   LYS  77          3HB       LYS  77  -1.201  -7.962  -3.850
  597   1HG   LYS  77          2HG       LYS  77  -2.807  -9.648  -3.853
  598   2HG   LYS  77          3HG       LYS  77  -1.363 -10.560  -4.290
  599   1HD   LYS  77          2HD       LYS  77  -1.051 -11.236  -1.952
  600   2HD   LYS  77          3HD       LYS  77  -2.448 -10.273  -1.471
  601   1HE   LYS  77          2HE       LYS  77  -3.266 -12.500  -1.674
  602   2HE   LYS  77          3HE       LYS  77  -3.797 -11.679  -3.141
  603   1HZ   LYS  77          1HZ       LYS  77  -1.251 -12.677  -3.632
  604   2HZ   LYS  77          1HZ       LYS  77  -2.721 -13.202  -4.305
  605   3HZ   LYS  77          3HZ       LYS  77  -2.123 -13.929  -2.891
  606    H    VAL  78           H        VAL  78   1.247  -7.719  -1.338
  607    HA   VAL  78           HA       VAL  78   1.921  -5.298  -2.599
  608    HB   VAL  78           HB       VAL  78   2.856  -6.466   0.033
  609   1HG1  VAL  78          1HG1      VAL  78   3.289  -4.008   0.559
  610   2HG1  VAL  78          2HG1      VAL  78   4.430  -4.760  -0.555
  611   3HG1  VAL  78          3HG1      VAL  78   3.159  -3.706  -1.174
  612   1HG2  VAL  78          1HG2      VAL  78   0.864  -4.243  -0.338
  613   2HG2  VAL  78          2HG2      VAL  78   0.341  -5.916  -0.526
  614   3HG2  VAL  78          3HG2      VAL  78   1.030  -5.374   1.005
  615    H    GLU  79           H        GLU  79   3.958  -8.046  -1.617
  616    HA   GLU  79           HA       GLU  79   6.463  -7.012  -2.244
  617   1HB   GLU  79          2HB       GLU  79   6.007  -9.210  -1.124
  618   2HB   GLU  79          3HB       GLU  79   5.569  -9.869  -2.701
  619   1HG   GLU  79          2HG       GLU  79   7.782  -9.484  -3.566
  620   2HG   GLU  79          3HG       GLU  79   8.238  -8.552  -2.142
  621    H    ALA  80           H        ALA  80   4.075  -8.557  -4.338
  622    HA   ALA  80           HA       ALA  80   5.551  -8.805  -6.684
  623   1HB   ALA  80          1HB       ALA  80   2.654  -7.996  -6.693
  624   2HB   ALA  80          2HB       ALA  80   3.503  -9.079  -7.796
  625   3HB   ALA  80          3HB       ALA  80   3.155  -9.597  -6.147
  626    H    VAL  81           H        VAL  81   4.010  -5.974  -5.287
  627    HA   VAL  81           HA       VAL  81   3.971  -4.275  -7.504
  628    HB   VAL  81           HB       VAL  81   4.575  -3.432  -4.660
  629   1HG1  VAL  81          1HG1      VAL  81   3.811  -1.319  -5.281
  630   2HG1  VAL  81          2HG1      VAL  81   4.626  -1.828  -6.759
  631   3HG1  VAL  81          3HG1      VAL  81   2.871  -1.944  -6.633
  632   1HG2  VAL  81          1HG2      VAL  81   1.834  -3.727  -5.905
  633   2HG2  VAL  81          2HG2      VAL  81   2.577  -5.028  -4.979
  634   3HG2  VAL  81          3HG2      VAL  81   2.239  -3.481  -4.207
  635    H    PHE  82           H        PHE  82   6.449  -4.151  -4.914
  636    HA   PHE  82           HA       PHE  82   8.299  -2.818  -6.715
  637   1HB   PHE  82          2HB       PHE  82   9.038  -3.819  -3.980
  638   2HB   PHE  82          3HB       PHE  82   9.606  -2.383  -4.833
  639    HD1  PHE  82           HD1      PHE  82   6.835  -3.857  -2.900
  640    HD2  PHE  82           HD2      PHE  82   8.278  -0.340  -4.903
  641    HE1  PHE  82           HE1      PHE  82   5.051  -2.515  -1.827
  642    HE2  PHE  82           HE2      PHE  82   6.493   1.001  -3.827
  643    HZ   PHE  82           HZ       PHE  82   4.882  -0.090  -2.292
  644    H    GLU  83           H        GLU  83   7.468  -5.626  -7.254
  645    HA   GLU  83           HA       GLU  83  10.089  -6.652  -7.879
  646   1HB   GLU  83          2HB       GLU  83   9.433  -7.368  -5.428
  647   2HB   GLU  83          3HB       GLU  83   8.405  -8.534  -6.258
  648   1HG   GLU  83          2HG       GLU  83  10.562  -9.567  -5.826
  649   2HG   GLU  83          3HG       GLU  83  10.399  -9.299  -7.560
  650    H    LEU  84           H        LEU  84   9.277  -6.459  -9.994
  651    HA   LEU  84           HA       LEU  84   7.857  -8.775 -10.948
  652   1HB   LEU  84          2HB       LEU  84   6.118  -7.190 -12.116
  653   2HB   LEU  84          3HB       LEU  84   5.839  -7.731 -10.462
  654    HG   LEU  84           HG       LEU  84   6.824  -5.633  -9.604
  655   1HD1  LEU  84          1HD1      LEU  84   7.200  -5.079 -12.551
  656   2HD1  LEU  84          2HD1      LEU  84   7.130  -3.777 -11.364
  657   3HD1  LEU  84          3HD1      LEU  84   8.400  -4.996 -11.261
  658   1HD2  LEU  84          1HD2      LEU  84   4.388  -5.777 -10.087
  659   2HD2  LEU  84          2HD2      LEU  84   5.009  -4.139 -10.289
  660   3HD2  LEU  84          3HD2      LEU  84   4.691  -5.143 -11.704
  661    H    GLU  85           H        GLU  85  10.346  -7.063 -11.298
  662    HA   GLU  85           HA       GLU  85  11.813  -6.863 -13.081
  663   1HB   GLU  85          2HB       GLU  85  10.054  -8.500 -14.239
  664   2HB   GLU  85          3HB       GLU  85   9.663  -7.039 -15.146
  665   1HG   GLU  85          2HG       GLU  85  11.377  -8.166 -16.384
  666   2HG   GLU  85          3HG       GLU  85  12.149  -6.789 -15.601
  667    H    HIS  86           H        HIS  86  12.584  -4.912 -13.486
  668    HA   HIS  86           HA       HIS  86  10.683  -2.704 -13.984
  669   1HB   HIS  86          2HB       HIS  86  11.971  -2.399 -11.952
  670   2HB   HIS  86          3HB       HIS  86  13.477  -2.696 -12.817
  671    HD1  HIS  86           HD1      HIS  86  11.173  -0.718 -14.839
  672    HD2  HIS  86           HD2      HIS  86  14.019   0.098 -11.904
  673    HE1  HIS  86           HE1      HIS  86  11.697   1.753 -15.017
  674    H    HIS  87           H        HIS  87  10.562  -2.120 -16.040
  675    HA   HIS  87           HA       HIS  87  12.990  -1.641 -17.581
  676   1HB   HIS  87          2HB       HIS  87  10.891  -3.654 -18.412
  677   2HB   HIS  87          3HB       HIS  87  12.013  -2.915 -19.551
  678    HD1  HIS  87           HD1      HIS  87  14.639  -2.960 -18.136
  679    HD2  HIS  87           HD2      HIS  87  11.955  -6.136 -17.848
  680    HE1  HIS  87           HE1      HIS  87  15.999  -4.988 -17.464
  681    H    HIS  88           H        HIS  88  12.158  -0.936 -19.932
  682    HA   HIS  88           HA       HIS  88   9.894   0.927 -19.523
  683   1HB   HIS  88          2HB       HIS  88  12.200   1.989 -19.592
  684   2HB   HIS  88          3HB       HIS  88  12.310   1.452 -21.267
  685    HD1  HIS  88           HD1      HIS  88   9.321   2.955 -19.431
  686    HD2  HIS  88           HD2      HIS  88  11.787   3.769 -22.692
  687    HE1  HIS  88           HE1      HIS  88   8.365   5.012 -20.557
  688    H    HIS  89           H        HIS  89   8.749  -1.036 -20.397
  689    HA   HIS  89           HA       HIS  89   9.021  -2.181 -22.868
  690   1HB   HIS  89          2HB       HIS  89   6.324  -1.292 -21.842
  691   2HB   HIS  89          3HB       HIS  89   6.714  -2.729 -22.787
  692    HD1  HIS  89           HD1      HIS  89   5.821  -1.936 -19.495
  693    HD2  HIS  89           HD2      HIS  89   8.874  -4.285 -21.091
  694    HE1  HIS  89           HE1      HIS  89   6.566  -3.499 -17.645
  695    H    HIS  90           H        HIS  90   9.210  -1.384 -24.847
  696    HA   HIS  90           HA       HIS  90   7.483   0.760 -25.772
  697   1HB   HIS  90          2HB       HIS  90   9.277   2.062 -24.779
  698   2HB   HIS  90          3HB       HIS  90  10.488   1.101 -25.624
  699    HD1  HIS  90           HD1      HIS  90   7.415   3.158 -26.610
  700    HD2  HIS  90           HD2      HIS  90  11.270   2.323 -27.961
  701    HE1  HIS  90           HE1      HIS  90   7.750   4.529 -28.712
  702    H    HIS  91           H        HIS  91  10.130  -1.489 -26.386
  703    HA   HIS  91           HA       HIS  91  10.669  -2.769 -28.209
  704   1HB   HIS  91          2HB       HIS  91   8.197  -3.296 -28.081
  705   2HB   HIS  91          3HB       HIS  91   7.938  -2.049 -29.299
  706    HD1  HIS  91           HD1      HIS  91  10.784  -2.869 -30.740
  707    HD2  HIS  91           HD2      HIS  91   7.489  -5.316 -30.013
  708    HE1  HIS  91           HE1      HIS  91  10.925  -4.772 -32.403
  Start of MODEL    2
    1   1H    MET   1          1HT       MET   1  13.627   0.924  -6.182
    2   2H    MET   1          2HT       MET   1  13.403   2.593  -6.407
    3   3H    MET   1          3HT       MET   1  12.299   1.489  -7.073
    4    HA   MET   1           HA       MET   1  12.605   2.375  -4.298
    5   1HB   MET   1          2HB       MET   1  10.289   1.779  -6.164
    6   2HB   MET   1          3HB       MET   1  10.085   2.215  -4.469
    7   1HG   MET   1          2HG       MET   1   9.857   4.244  -5.742
    8   2HG   MET   1          3HG       MET   1  11.427   4.313  -4.941
    9   1HE   MET   1          1HE       MET   1  11.225   6.239  -6.626
   10   2HE   MET   1          2HE       MET   1  12.004   6.176  -8.204
   11   3HE   MET   1          3HE       MET   1  12.960   5.913  -6.746
   12    H    LYS   2           H        LYS   2  12.700   0.944  -2.675
   13    HA   LYS   2           HA       LYS   2  11.477  -1.699  -2.945
   14   1HB   LYS   2          2HB       LYS   2  13.968  -1.662  -3.762
   15   2HB   LYS   2          3HB       LYS   2  14.336  -1.583  -2.040
   16   1HG   LYS   2          2HG       LYS   2  14.300  -3.890  -2.423
   17   2HG   LYS   2          3HG       LYS   2  12.657  -3.589  -1.859
   18   1HD   LYS   2          2HD       LYS   2  12.239  -4.834  -3.776
   19   2HD   LYS   2          3HD       LYS   2  12.174  -3.195  -4.424
   20   1HE   LYS   2          2HE       LYS   2  13.582  -4.369  -5.925
   21   2HE   LYS   2          3HE       LYS   2  14.695  -3.472  -4.891
   22   1HZ   LYS   2          1HZ       LYS   2  15.357  -5.349  -3.813
   23   2HZ   LYS   2          1HZ       LYS   2  15.011  -6.018  -5.337
   24   3HZ   LYS   2          3HZ       LYS   2  13.892  -6.167  -4.067
   25    H    ILE   3           H        ILE   3  11.357  -2.847  -0.910
   26    HA   ILE   3           HA       ILE   3  10.937  -1.053   1.325
   27    HB   ILE   3           HB       ILE   3  10.700  -4.071   1.272
   28   1HG1  ILE   3          2HG1      ILE   3   8.742  -1.904   0.450
   29   2HG1  ILE   3          3HG1      ILE   3   9.321  -3.250  -0.528
   30   1HG2  ILE   3          1HG2      ILE   3  10.684  -2.688   3.473
   31   2HG2  ILE   3          2HG2      ILE   3   9.117  -2.096   2.920
   32   3HG2  ILE   3          3HG2      ILE   3   9.359  -3.818   3.203
   33   1HD1  ILE   3          1HD1      ILE   3   8.282  -4.724   1.393
   34   2HD1  ILE   3          2HD1      ILE   3   7.347  -3.269   1.736
   35   3HD1  ILE   3          3HD1      ILE   3   7.231  -4.037   0.154
   36    H    ILE   4           H        ILE   4  12.423  -0.572   2.806
   37    HA   ILE   4           HA       ILE   4  14.793  -2.320   3.062
   38    HB   ILE   4           HB       ILE   4  14.665   0.461   4.180
   39   1HG1  ILE   4          2HG1      ILE   4  13.838   0.662   1.856
   40   2HG1  ILE   4          3HG1      ILE   4  15.446   1.357   2.023
   41   1HG2  ILE   4          1HG2      ILE   4  16.597  -1.053   4.621
   42   2HG2  ILE   4          2HG2      ILE   4  16.888  -1.141   2.884
   43   3HG2  ILE   4          3HG2      ILE   4  17.057   0.397   3.730
   44   1HD1  ILE   4          1HD1      ILE   4  15.352   0.006  -0.012
   45   2HD1  ILE   4          2HD1      ILE   4  16.423  -0.766   1.152
   46   3HD1  ILE   4          3HD1      ILE   4  14.792  -1.389   0.908
   47    H    SER   5           H        SER   5  11.997  -1.159   4.695
   48    HA   SER   5           HA       SER   5  12.503  -2.826   6.970
   49   1HB   SER   5          2HB       SER   5  13.940  -1.032   7.690
   50   2HB   SER   5          3HB       SER   5  12.712   0.172   7.311
   51    HG   SER   5           HG       SER   5  12.388  -1.936   9.187
   52    H    ILE   6           H        ILE   6  10.613  -3.533   7.656
   53    HA   ILE   6           HA       ILE   6   8.174  -2.052   6.943
   54    HB   ILE   6           HB       ILE   6   8.378  -4.880   8.010
   55   1HG1  ILE   6          2HG1      ILE   6   8.177  -4.024   5.103
   56   2HG1  ILE   6          3HG1      ILE   6   9.689  -4.509   5.867
   57   1HG2  ILE   6          1HG2      ILE   6   6.225  -3.150   6.853
   58   2HG2  ILE   6          2HG2      ILE   6   6.180  -4.877   6.507
   59   3HG2  ILE   6          3HG2      ILE   6   6.141  -4.315   8.177
   60   1HD1  ILE   6          1HD1      ILE   6   7.205  -6.197   5.486
   61   2HD1  ILE   6          2HD1      ILE   6   8.799  -6.458   4.778
   62   3HD1  ILE   6          3HD1      ILE   6   8.557  -6.682   6.511
   63    H    SER   7           H        SER   7   6.340  -2.583   8.668
   64    HA   SER   7           HA       SER   7   7.362  -2.267  11.406
   65   1HB   SER   7          2HB       SER   7   5.719  -0.413  11.772
   66   2HB   SER   7          3HB       SER   7   7.014   0.014  10.661
   67    HG   SER   7           HG       SER   7   4.370  -0.038  10.243
   68    H    GLU   8           H        GLU   8   5.966  -3.064  12.989
   69    HA   GLU   8           HA       GLU   8   3.288  -3.882  12.356
   70   1HB   GLU   8          2HB       GLU   8   5.358  -5.707  11.791
   71   2HB   GLU   8          3HB       GLU   8   4.605  -6.271  13.281
   72   1HG   GLU   8          2HG       GLU   8   3.034  -5.546  10.787
   73   2HG   GLU   8          3HG       GLU   8   3.553  -7.186  11.171
   74    H    THR   9           H        THR   9   5.788  -3.217  14.345
   75    HA   THR   9           HA       THR   9   4.289  -3.920  16.787
   76    HB   THR   9           HB       THR   9   7.202  -3.205  16.812
   77    HG1  THR   9           HG1      THR   9   7.645  -4.956  15.773
   78   1HG2  THR   9          1HG2      THR   9   7.204  -4.378  18.852
   79   2HG2  THR   9          2HG2      THR   9   5.647  -3.555  18.865
   80   3HG2  THR   9          3HG2      THR   9   5.733  -5.267  18.449
   81    HA   PRO  10           HA       PRO  10   5.764   0.620  17.380
   82   1HB   PRO  10          2HB       PRO  10   6.085   1.854  14.799
   83   2HB   PRO  10          3HB       PRO  10   7.300   1.623  16.064
   84   1HG   PRO  10          2HG       PRO  10   7.227   0.344  13.600
   85   2HG   PRO  10          3HG       PRO  10   8.210  -0.120  14.995
   86   1HD   PRO  10          2HD       PRO  10   5.742  -1.371  13.946
   87   2HD   PRO  10          3HD       PRO  10   7.030  -2.074  14.950
   88    H    ASN  11           H        ASN  11   3.628  -0.582  15.016
   89    HA   ASN  11           HA       ASN  11   1.607   1.397  15.765
   90   1HB   ASN  11          2HB       ASN  11   2.895   1.915  13.501
   91   2HB   ASN  11          3HB       ASN  11   1.793   0.696  12.864
   92   1HD2  ASN  11          2HD2      ASN  11   1.935   3.831  12.695
   93   2HD2  ASN  11          1HD2      ASN  11   0.337   4.298  13.030
   94    H    HIS  12           H        HIS  12  -0.177   0.400  13.659
   95    HA   HIS  12           HA       HIS  12  -0.463  -2.407  13.763
   96   1HB   HIS  12          2HB       HIS  12  -0.914  -1.948  16.170
   97   2HB   HIS  12          3HB       HIS  12  -2.244  -0.895  15.696
   98    HD1  HIS  12           HD1      HIS  12  -4.111  -2.378  16.662
   99    HD2  HIS  12           HD2      HIS  12  -1.697  -4.372  13.909
  100    HE1  HIS  12           HE1      HIS  12  -5.284  -4.558  16.124
  101    H    ASN  13           H        ASN  13  -2.250  -3.116  12.558
  102    HA   ASN  13           HA       ASN  13  -3.963  -3.004  11.035
  103   1HB   ASN  13          2HB       ASN  13  -4.469  -0.156  11.890
  104   2HB   ASN  13          3HB       ASN  13  -5.605  -1.305  11.190
  105   1HD2  ASN  13          2HD2      ASN  13  -6.476  -2.987  12.591
  106   2HD2  ASN  13          1HD2      ASN  13  -6.326  -2.891  14.278
  107    H    THR  14           H        THR  14  -1.407  -0.718  11.088
  108    HA   THR  14           HA       THR  14  -1.515  -0.523   8.177
  109    HB   THR  14           HB       THR  14  -2.749   1.468   8.931
  110    HG1  THR  14           HG1      THR  14  -0.656   2.881   8.242
  111   1HG2  THR  14          1HG2      THR  14  -0.245   2.466  10.262
  112   2HG2  THR  14          2HG2      THR  14  -1.905   3.024  10.462
  113   3HG2  THR  14          3HG2      THR  14  -1.399   1.491  11.172
  114    H    MET  15           H        MET  15   0.449  -0.809   7.345
  115    HA   MET  15           HA       MET  15   2.776  -0.537   9.153
  116   1HB   MET  15          2HB       MET  15   2.429  -2.199   6.644
  117   2HB   MET  15          3HB       MET  15   3.913  -2.093   7.590
  118   1HG   MET  15          2HG       MET  15   2.446  -2.799   9.602
  119   2HG   MET  15          3HG       MET  15   1.264  -3.280   8.397
  120   1HE   MET  15          1HE       MET  15   1.884  -4.478   6.339
  121   2HE   MET  15          2HE       MET  15   2.875  -5.933   6.311
  122   3HE   MET  15          3HE       MET  15   3.610  -4.368   5.978
  123    H    LYS  16           H        LYS  16   4.565   0.587   8.530
  124    HA   LYS  16           HA       LYS  16   4.183   2.407   6.254
  125   1HB   LYS  16          2HB       LYS  16   5.828   3.834   7.277
  126   2HB   LYS  16          3HB       LYS  16   4.667   3.367   8.517
  127   1HG   LYS  16          2HG       LYS  16   6.500   2.798   9.729
  128   2HG   LYS  16          3HG       LYS  16   6.532   1.356   8.718
  129   1HD   LYS  16          2HD       LYS  16   8.041   2.460   7.135
  130   2HD   LYS  16          3HD       LYS  16   7.965   3.949   8.072
  131   1HE   LYS  16          2HE       LYS  16   9.158   1.302   8.929
  132   2HE   LYS  16          3HE       LYS  16  10.000   2.831   8.696
  133   1HZ   LYS  16          1HZ       LYS  16   8.262   3.629  10.469
  134   2HZ   LYS  16          1HZ       LYS  16   9.709   2.875  10.940
  135   3HZ   LYS  16          3HZ       LYS  16   8.259   1.987  10.894
  136    H    ILE  17           H        ILE  17   5.400   2.283   4.473
  137    HA   ILE  17           HA       ILE  17   7.404   0.143   4.338
  138    HB   ILE  17           HB       ILE  17   6.031   1.773   2.188
  139   1HG1  ILE  17          2HG1      ILE  17   5.837  -1.192   2.772
  140   2HG1  ILE  17          3HG1      ILE  17   4.735  -0.014   3.487
  141   1HG2  ILE  17          1HG2      ILE  17   7.986   1.248   1.086
  142   2HG2  ILE  17          2HG2      ILE  17   8.327  -0.135   2.126
  143   3HG2  ILE  17          3HG2      ILE  17   7.126  -0.271   0.842
  144   1HD1  ILE  17          1HD1      ILE  17   3.961  -1.133   1.310
  145   2HD1  ILE  17          2HD1      ILE  17   3.873   0.626   1.368
  146   3HD1  ILE  17          3HD1      ILE  17   5.195  -0.159   0.506
  147    H    THR  18           H        THR  18   9.448   0.670   4.701
  148    HA   THR  18           HA       THR  18  10.371   3.412   4.409
  149    HB   THR  18           HB       THR  18  12.040   0.994   5.108
  150    HG1  THR  18           HG1      THR  18  10.011   2.206   6.471
  151   1HG2  THR  18          1HG2      THR  18  13.530   2.539   6.076
  152   2HG2  THR  18          2HG2      THR  18  13.027   3.338   4.587
  153   3HG2  THR  18          3HG2      THR  18  12.315   3.816   6.129
  154    H    LEU  19           H        LEU  19  11.379   4.213   2.682
  155    HA   LEU  19           HA       LEU  19  12.126   2.387   0.496
  156   1HB   LEU  19          2HB       LEU  19  11.937   5.407   0.412
  157   2HB   LEU  19          3HB       LEU  19  12.001   4.296  -0.956
  158    HG   LEU  19           HG       LEU  19   9.763   4.440   1.091
  159   1HD1  LEU  19          1HD1      LEU  19   9.658   5.139  -1.850
  160   2HD1  LEU  19          2HD1      LEU  19   8.455   5.483  -0.607
  161   3HD1  LEU  19          3HD1      LEU  19   9.994   6.344  -0.606
  162   1HD2  LEU  19          1HD2      LEU  19   9.948   2.180   0.290
  163   2HD2  LEU  19          2HD2      LEU  19   8.635   2.925  -0.623
  164   3HD2  LEU  19          3HD2      LEU  19  10.220   2.724  -1.365
  165    H    SER  20           H        SER  20  13.982   3.710  -0.870
  166    HA   SER  20           HA       SER  20  16.375   3.256   0.564
  167   1HB   SER  20          2HB       SER  20  17.499   4.149  -1.395
  168   2HB   SER  20          3HB       SER  20  16.158   3.132  -1.915
  169    HG   SER  20           HG       SER  20  15.572   5.805  -1.481
  170    H    GLU  21           H        GLU  21  14.206   5.708   0.948
  171    HA   GLU  21           HA       GLU  21  14.239   7.772   1.939
  172   1HB   GLU  21          2HB       GLU  21  16.757   6.522   3.017
  173   2HB   GLU  21          3HB       GLU  21  16.304   8.171   3.450
  174   1HG   GLU  21          2HG       GLU  21  14.229   7.450   4.401
  175   2HG   GLU  21          3HG       GLU  21  14.404   5.833   3.724
  176    H    SER  22           H        SER  22  14.332   8.801  -0.127
  177    HA   SER  22           HA       SER  22  16.955   9.700  -1.059
  178   1HB   SER  22          2HB       SER  22  14.985   8.889  -2.555
  179   2HB   SER  22          3HB       SER  22  14.332  10.503  -2.285
  180    HG   SER  22           HG       SER  22  15.616  10.674  -4.054
  181    H    ARG  23           H        ARG  23  17.691  11.761  -0.918
  182    HA   ARG  23           HA       ARG  23  16.554  13.476   1.063
  183   1HB   ARG  23          2HB       ARG  23  18.655  14.251  -0.966
  184   2HB   ARG  23          3HB       ARG  23  18.407  14.916   0.647
  185   1HG   ARG  23          2HG       ARG  23  18.882  12.564   1.540
  186   2HG   ARG  23          3HG       ARG  23  19.441  12.168  -0.088
  187   1HD   ARG  23          2HD       ARG  23  21.388  12.835   1.130
  188   2HD   ARG  23          3HD       ARG  23  20.980  14.187   0.078
  189    HE   ARG  23           HE       ARG  23  20.356  15.431   1.972
  190   1HH1  ARG  23          1HH1      ARG  23  20.214  12.140   2.862
  191   2HH1  ARG  23          2HH1      ARG  23  20.655  12.403   4.514
  192   1HH2  ARG  23          1HH2      ARG  23  21.288  15.783   4.084
  193   2HH2  ARG  23          2HH2      ARG  23  21.253  14.465   5.209
  194    H    GLU  24           H        GLU  24  14.930  14.852   0.823
  195    HA   GLU  24           HA       GLU  24  13.213  15.995  -0.235
  196   1HB   GLU  24          2HB       GLU  24  15.131  17.609   0.043
  197   2HB   GLU  24          3HB       GLU  24  15.553  17.297  -1.642
  198   1HG   GLU  24          2HG       GLU  24  13.217  17.971  -2.281
  199   2HG   GLU  24          3HG       GLU  24  12.944  18.432  -0.601
  200    H    GLY  25           H        GLY  25  12.750  13.871  -1.408
  201   1HA   GLY  25          1HA       GLY  25  12.641  14.440  -4.295
  202   2HA   GLY  25          2HA       GLY  25  13.304  12.893  -3.770
  203    H    MET  26           H        MET  26  11.591  12.469  -1.554
  204    HA   MET  26           HA       MET  26   9.153  11.660  -2.972
  205   1HB   MET  26          2HB       MET  26   9.968  10.930  -0.154
  206   2HB   MET  26          3HB       MET  26   8.819  10.099  -1.202
  207   1HG   MET  26          2HG       MET  26  11.823  10.271  -1.547
  208   2HG   MET  26          3HG       MET  26  10.861   8.824  -1.249
  209   1HE   MET  26          1HE       MET  26  11.209   7.277  -3.089
  210   2HE   MET  26          2HE       MET  26  12.651   8.252  -3.357
  211   3HE   MET  26          3HE       MET  26  11.660   7.761  -4.729
  212    H    THR  27           H        THR  27   7.565  13.128  -2.955
  213    HA   THR  27           HA       THR  27   7.296  15.104  -0.879
  214    HB   THR  27           HB       THR  27   5.338  15.853  -2.162
  215    HG1  THR  27           HG1      THR  27   4.836  14.664  -4.068
  216   1HG2  THR  27          1HG2      THR  27   7.536  15.095  -4.088
  217   2HG2  THR  27          2HG2      THR  27   6.519  16.536  -4.112
  218   3HG2  THR  27          3HG2      THR  27   7.749  16.342  -2.862
  219    H    SER  28           H        SER  28   4.191  14.438  -1.584
  220    HA   SER  28           HA       SER  28   3.693  12.314   0.332
  221   1HB   SER  28          2HB       SER  28   2.316  13.724   1.819
  222   2HB   SER  28          3HB       SER  28   3.994  14.251   1.824
  223    HG   SER  28           HG       SER  28   3.204  16.113   1.264
  224    H    ASP  29           H        ASP  29   1.663  11.409   0.073
  225    HA   ASP  29           HA       ASP  29  -0.368  12.770  -1.509
  226   1HB   ASP  29          2HB       ASP  29   0.677  10.108  -2.484
  227   2HB   ASP  29          3HB       ASP  29  -0.498  11.163  -3.269
  228    H    THR  30           H        THR  30  -2.362  11.449  -1.687
  229    HA   THR  30           HA       THR  30  -2.613   9.274   0.260
  230    HB   THR  30           HB       THR  30  -4.399  11.722   0.332
  231    HG1  THR  30           HG1      THR  30  -3.345  11.590   2.580
  232   1HG2  THR  30          1HG2      THR  30  -4.965  10.412   2.588
  233   2HG2  THR  30          2HG2      THR  30  -5.787  10.029   1.075
  234   3HG2  THR  30          3HG2      THR  30  -4.446   9.027   1.629
  235    H    TYR  31           H        TYR  31  -3.527   7.666  -0.890
  236    HA   TYR  31           HA       TYR  31  -5.417   8.391  -3.032
  237   1HB   TYR  31          2HB       TYR  31  -4.201   5.662  -2.652
  238   2HB   TYR  31          3HB       TYR  31  -4.885   6.368  -4.114
  239    HD1  TYR  31           HD1      TYR  31  -3.647   9.054  -4.155
  240    HD2  TYR  31           HD2      TYR  31  -1.932   5.242  -3.157
  241    HE1  TYR  31           HE1      TYR  31  -1.410   9.893  -4.799
  242    HE2  TYR  31           HE2      TYR  31   0.309   6.088  -3.798
  243    HH   TYR  31           HH       TYR  31   0.730   9.379  -5.100
  244    H    THR  32           H        THR  32  -7.460   7.859  -2.972
  245    HA   THR  32           HA       THR  32  -8.475   6.042  -0.873
  246    HB   THR  32           HB       THR  32 -10.595   7.474  -1.071
  247    HG1  THR  32           HG1      THR  32  -9.054   9.614  -1.807
  248   1HG2  THR  32          1HG2      THR  32  -9.521   9.341   0.343
  249   2HG2  THR  32          2HG2      THR  32  -9.343   7.686   0.928
  250   3HG2  THR  32          3HG2      THR  32  -8.002   8.478   0.100
  251    H    LYS  33           H        LYS  33  -7.710   4.847  -2.956
  252    HA   LYS  33           HA       LYS  33  -8.502   3.208  -4.377
  253   1HB   LYS  33          2HB       LYS  33 -10.716   2.834  -4.699
  254   2HB   LYS  33          3HB       LYS  33 -10.907   3.995  -3.398
  255   1HG   LYS  33          2HG       LYS  33 -12.393   4.773  -5.045
  256   2HG   LYS  33          3HG       LYS  33 -10.977   5.780  -5.302
  257   1HD   LYS  33          2HD       LYS  33 -11.021   5.075  -7.451
  258   2HD   LYS  33          3HD       LYS  33 -10.474   3.512  -6.849
  259   1HE   LYS  33          2HE       LYS  33 -12.490   3.249  -8.229
  260   2HE   LYS  33          3HE       LYS  33 -12.830   2.809  -6.556
  261   1HZ   LYS  33          1HZ       LYS  33 -13.391   5.466  -7.755
  262   2HZ   LYS  33          1HZ       LYS  33 -13.813   4.954  -6.192
  263   3HZ   LYS  33          3HZ       LYS  33 -14.543   4.241  -7.551
  264    H    VAL  34           H        VAL  34  -7.175   3.429  -5.945
  265    HA   VAL  34           HA       VAL  34  -5.880   4.680  -7.478
  266    HB   VAL  34           HB       VAL  34  -8.177   4.171  -9.281
  267   1HG1  VAL  34          1HG1      VAL  34  -5.297   3.226  -9.249
  268   2HG1  VAL  34          2HG1      VAL  34  -6.412   3.154 -10.611
  269   3HG1  VAL  34          3HG1      VAL  34  -5.840   4.716 -10.025
  270   1HG2  VAL  34          1HG2      VAL  34  -8.630   2.350  -7.867
  271   2HG2  VAL  34          2HG2      VAL  34  -7.492   1.659  -9.028
  272   3HG2  VAL  34          3HG2      VAL  34  -6.935   2.148  -7.429
  273    H    ASP  35           H        ASP  35  -5.495   6.777  -7.497
  274    HA   ASP  35           HA       ASP  35  -7.204   8.551  -9.001
  275   1HB   ASP  35          2HB       ASP  35  -7.274  10.242  -7.090
  276   2HB   ASP  35          3HB       ASP  35  -8.359   8.864  -6.945
  277    H    ASP  36           H        ASP  36  -6.148  10.963  -8.538
  278    HA   ASP  36           HA       ASP  36  -4.342  12.260  -9.127
  279   1HB   ASP  36          2HB       ASP  36  -3.246  10.395  -7.044
  280   2HB   ASP  36          3HB       ASP  36  -2.201  11.588  -7.817
  281    H    SER  37           H        SER  37  -2.014   9.763  -8.634
  282    HA   SER  37           HA       SER  37  -1.984   8.606 -11.213
  283   1HB   SER  37          2HB       SER  37  -1.364  10.661 -12.171
  284   2HB   SER  37          3HB       SER  37  -0.324  11.090 -10.819
  285    HG   SER  37           HG       SER  37   1.064  10.401 -12.334
  286    H    GLN  38           H        GLN  38  -1.790   7.202  -9.091
  287    HA   GLN  38           HA       GLN  38   0.939   6.878  -8.132
  288   1HB   GLN  38          2HB       GLN  38  -0.213   4.714  -7.123
  289   2HB   GLN  38          3HB       GLN  38  -0.508   6.292  -6.413
  290   1HG   GLN  38          2HG       GLN  38  -2.318   5.567  -8.637
  291   2HG   GLN  38          3HG       GLN  38  -2.473   4.572  -7.190
  292   1HE2  GLN  38          2HE2      GLN  38  -4.415   5.469  -6.343
  293   2HE2  GLN  38          1HE2      GLN  38  -4.538   7.088  -5.861
  294    HA   PRO  39           HA       PRO  39   2.358   4.043 -11.146
  295   1HB   PRO  39          2HB       PRO  39   3.286   2.035  -9.298
  296   2HB   PRO  39          3HB       PRO  39   4.243   3.231 -10.177
  297   1HG   PRO  39          2HG       PRO  39   3.533   3.186  -7.405
  298   2HG   PRO  39          3HG       PRO  39   4.585   4.317  -8.262
  299   1HD   PRO  39          2HD       PRO  39   2.014   4.860  -7.207
  300   2HD   PRO  39          3HD       PRO  39   2.981   5.916  -8.253
  301    H    ALA  40           H        ALA  40   1.416   2.399 -12.317
  302    HA   ALA  40           HA       ALA  40  -1.065   1.366 -11.740
  303   1HB   ALA  40          1HB       ALA  40  -0.712  -0.252 -13.460
  304   2HB   ALA  40          2HB       ALA  40   0.213   1.176 -13.929
  305   3HB   ALA  40          3HB       ALA  40   1.036  -0.217 -13.226
  306    H    PHE  41           H        PHE  41   2.095   0.114 -10.876
  307    HA   PHE  41           HA       PHE  41   1.407  -2.365  -9.811
  308   1HB   PHE  41          2HB       PHE  41   3.498  -0.639  -8.515
  309   2HB   PHE  41          3HB       PHE  41   3.528  -2.373  -8.831
  310    HD1  PHE  41           HD1      PHE  41   5.102   0.495  -9.766
  311    HD2  PHE  41           HD2      PHE  41   2.960  -2.758 -11.584
  312    HE1  PHE  41           HE1      PHE  41   6.283   0.911 -11.906
  313    HE2  PHE  41           HE2      PHE  41   4.145  -2.341 -13.721
  314    HZ   PHE  41           HZ       PHE  41   5.805  -0.506 -13.881
  315    H    ILE  42           H        ILE  42   1.167   0.869  -8.429
  316    HA   ILE  42           HA       ILE  42   0.498  -0.034  -5.773
  317    HB   ILE  42           HB       ILE  42   0.577   2.611  -7.187
  318   1HG1  ILE  42          2HG1      ILE  42   2.525   1.450  -5.950
  319   2HG1  ILE  42          3HG1      ILE  42   2.203   3.135  -5.556
  320   1HG2  ILE  42          1HG2      ILE  42  -1.459   2.945  -6.035
  321   2HG2  ILE  42          2HG2      ILE  42  -0.935   1.982  -4.655
  322   3HG2  ILE  42          3HG2      ILE  42  -0.238   3.578  -4.932
  323   1HD1  ILE  42          1HD1      ILE  42   1.471   2.651  -3.448
  324   2HD1  ILE  42          2HD1      ILE  42   0.727   1.129  -3.940
  325   3HD1  ILE  42          3HD1      ILE  42   2.467   1.214  -3.669
  326    H    ASN  43           H        ASN  43  -1.230   0.516  -8.730
  327    HA   ASN  43           HA       ASN  43  -3.804   1.010  -7.674
  328   1HB   ASN  43          2HB       ASN  43  -3.021  -0.396 -10.244
  329   2HB   ASN  43          3HB       ASN  43  -4.625   0.198  -9.857
  330   1HD2  ASN  43          2HD2      ASN  43  -2.470   2.385  -8.494
  331   2HD2  ASN  43          1HD2      ASN  43  -2.406   3.508  -9.766
  332    H    ASP  44           H        ASP  44  -1.919  -1.903  -8.273
  333    HA   ASP  44           HA       ASP  44  -3.887  -3.868  -7.884
  334   1HB   ASP  44          2HB       ASP  44  -1.048  -4.093  -6.866
  335   2HB   ASP  44          3HB       ASP  44  -2.103  -5.383  -7.435
  336    H    ILE  45           H        ILE  45  -1.665  -2.410  -5.519
  337    HA   ILE  45           HA       ILE  45  -2.481  -3.619  -3.190
  338    HB   ILE  45           HB       ILE  45  -1.538  -0.809  -3.762
  339   1HG1  ILE  45          2HG1      ILE  45  -0.199  -3.089  -2.282
  340   2HG1  ILE  45          3HG1      ILE  45  -0.024  -2.842  -4.019
  341   1HG2  ILE  45          1HG2      ILE  45  -2.831  -0.584  -1.740
  342   2HG2  ILE  45          2HG2      ILE  45  -2.167  -2.081  -1.086
  343   3HG2  ILE  45          3HG2      ILE  45  -1.134  -0.664  -1.269
  344   1HD1  ILE  45          1HD1      ILE  45   0.449  -0.433  -2.361
  345   2HD1  ILE  45          2HD1      ILE  45   1.628  -1.727  -2.156
  346   3HD1  ILE  45          3HD1      ILE  45   1.348  -1.037  -3.754
  347    H    LEU  46           H        LEU  46  -3.832  -0.620  -4.584
  348    HA   LEU  46           HA       LEU  46  -5.899  -0.329  -2.664
  349   1HB   LEU  46          2HB       LEU  46  -5.709   0.729  -5.499
  350   2HB   LEU  46          3HB       LEU  46  -6.877   1.268  -4.289
  351    HG   LEU  46           HG       LEU  46  -3.876   1.367  -3.851
  352   1HD1  LEU  46          1HD1      LEU  46  -4.648   2.813  -5.773
  353   2HD1  LEU  46          2HD1      LEU  46  -5.690   3.663  -4.634
  354   3HD1  LEU  46          3HD1      LEU  46  -3.940   3.708  -4.426
  355   1HD2  LEU  46          1HD2      LEU  46  -4.808   1.536  -1.742
  356   2HD2  LEU  46          2HD2      LEU  46  -4.880   3.231  -2.225
  357   3HD2  LEU  46          3HD2      LEU  46  -6.319   2.217  -2.346
  358    H    LYS  47           H        LYS  47  -5.746  -1.978  -5.791
  359    HA   LYS  47           HA       LYS  47  -8.573  -2.642  -5.762
  360   1HB   LYS  47          2HB       LYS  47  -6.258  -3.356  -7.563
  361   2HB   LYS  47          3HB       LYS  47  -7.838  -4.118  -7.743
  362   1HG   LYS  47          2HG       LYS  47  -8.876  -1.877  -7.971
  363   2HG   LYS  47          3HG       LYS  47  -7.279  -1.138  -7.849
  364   1HD   LYS  47          2HD       LYS  47  -6.588  -1.969  -9.929
  365   2HD   LYS  47          3HD       LYS  47  -7.784  -3.265  -9.918
  366   1HE   LYS  47          2HE       LYS  47  -8.567  -0.342 -10.054
  367   2HE   LYS  47          3HE       LYS  47  -8.274  -1.308 -11.499
  368   1HZ   LYS  47          1HZ       LYS  47  -9.913  -2.823  -9.879
  369   2HZ   LYS  47          1HZ       LYS  47 -10.346  -2.032 -11.319
  370   3HZ   LYS  47          3HZ       LYS  47 -10.553  -1.255  -9.821
  371    H    VAL  48           H        VAL  48  -5.789  -3.866  -4.278
  372    HA   VAL  48           HA       VAL  48  -6.478  -6.665  -4.330
  373    HB   VAL  48           HB       VAL  48  -4.419  -5.002  -2.904
  374   1HG1  VAL  48          1HG1      VAL  48  -4.970  -6.442  -1.122
  375   2HG1  VAL  48          2HG1      VAL  48  -5.334  -7.790  -2.201
  376   3HG1  VAL  48          3HG1      VAL  48  -3.662  -7.295  -1.940
  377   1HG2  VAL  48          1HG2      VAL  48  -4.416  -6.270  -5.310
  378   2HG2  VAL  48          2HG2      VAL  48  -2.959  -6.022  -4.346
  379   3HG2  VAL  48          3HG2      VAL  48  -3.809  -7.564  -4.279
  380    H    GLU  49           H        GLU  49  -8.023  -7.591  -3.173
  381    HA   GLU  49           HA       GLU  49  -9.709  -6.314  -1.375
  382   1HB   GLU  49          2HB       GLU  49  -8.997  -9.251  -1.549
  383   2HB   GLU  49          3HB       GLU  49 -10.354  -8.603  -0.633
  384   1HG   GLU  49          2HG       GLU  49 -11.103  -7.493  -2.821
  385   2HG   GLU  49          3HG       GLU  49  -9.929  -8.528  -3.626
  386    H    GLY  50           H        GLY  50  -9.839  -6.183   0.859
  387   1HA   GLY  50          1HA       GLY  50  -9.135  -6.633   3.084
  388   2HA   GLY  50          2HA       GLY  50  -7.589  -7.193   2.456
  389    H    VAL  51           H        VAL  51  -7.330  -4.849   0.659
  390    HA   VAL  51           HA       VAL  51  -6.043  -3.086   2.551
  391    HB   VAL  51           HB       VAL  51  -6.360  -2.933  -0.458
  392   1HG1  VAL  51          1HG1      VAL  51  -5.936  -0.706   0.052
  393   2HG1  VAL  51          2HG1      VAL  51  -5.095  -1.102   1.551
  394   3HG1  VAL  51          3HG1      VAL  51  -4.288  -1.327  -0.001
  395   1HG2  VAL  51          1HG2      VAL  51  -4.955  -4.781   0.726
  396   2HG2  VAL  51          2HG2      VAL  51  -4.192  -3.860  -0.569
  397   3HG2  VAL  51          3HG2      VAL  51  -3.840  -3.470   1.114
  398    H    LYS  52           H        LYS  52  -6.479  -0.885   2.871
  399    HA   LYS  52           HA       LYS  52  -9.300  -0.135   2.396
  400   1HB   LYS  52          2HB       LYS  52  -8.695  -0.320   4.755
  401   2HB   LYS  52          3HB       LYS  52  -7.351   0.793   4.516
  402   1HG   LYS  52          2HG       LYS  52  -8.843   2.611   3.983
  403   2HG   LYS  52          3HG       LYS  52 -10.231   1.529   3.947
  404   1HD   LYS  52          2HD       LYS  52  -8.674   1.473   6.464
  405   2HD   LYS  52          3HD       LYS  52  -9.497   2.995   6.134
  406   1HE   LYS  52          2HE       LYS  52 -10.784   1.127   7.433
  407   2HE   LYS  52          3HE       LYS  52 -11.622   2.001   6.152
  408   1HZ   LYS  52          1HZ       LYS  52 -12.025   0.006   5.295
  409   2HZ   LYS  52          1HZ       LYS  52 -10.896  -0.763   6.304
  410   3HZ   LYS  52          3HZ       LYS  52 -10.391  -0.044   4.852
  411    H    SER  53           H        SER  53  -6.122   1.447   2.817
  412    HA   SER  53           HA       SER  53  -6.373   2.979   0.395
  413   1HB   SER  53          2HB       SER  53  -6.576   5.194   1.394
  414   2HB   SER  53          3HB       SER  53  -7.963   4.216   1.856
  415    HG   SER  53           HG       SER  53  -7.358   4.387   3.855
  416    H    ILE  54           H        ILE  54  -4.646   4.958   0.648
  417    HA   ILE  54           HA       ILE  54  -2.289   3.924   2.096
  418    HB   ILE  54           HB       ILE  54  -2.353   4.688  -0.836
  419   1HG1  ILE  54          2HG1      ILE  54  -1.699   2.091   0.603
  420   2HG1  ILE  54          3HG1      ILE  54  -3.162   2.405  -0.327
  421   1HG2  ILE  54          1HG2      ILE  54  -0.058   4.018   1.032
  422   2HG2  ILE  54          2HG2      ILE  54   0.085   4.062  -0.724
  423   3HG2  ILE  54          3HG2      ILE  54  -0.309   5.534   0.164
  424   1HD1  ILE  54          1HD1      ILE  54  -1.233   3.081  -2.144
  425   2HD1  ILE  54          2HD1      ILE  54  -0.436   1.778  -1.264
  426   3HD1  ILE  54          3HD1      ILE  54  -1.989   1.489  -2.045
  427    H    PHE  55           H        PHE  55  -0.685   5.468   2.570
  428    HA   PHE  55           HA       PHE  55  -1.338   8.295   2.053
  429   1HB   PHE  55          2HB       PHE  55  -2.253   7.564   4.300
  430   2HB   PHE  55          3HB       PHE  55  -0.587   7.274   4.800
  431    HD1  PHE  55           HD1      PHE  55  -2.986   9.861   3.658
  432    HD2  PHE  55           HD2      PHE  55   0.901   9.094   5.321
  433    HE1  PHE  55           HE1      PHE  55  -2.733  12.272   4.177
  434    HE2  PHE  55           HE2      PHE  55   1.154  11.509   5.838
  435    HZ   PHE  55           HZ       PHE  55  -0.662  13.098   5.262
  436    H    HIS  56           H        HIS  56   0.395   8.960   0.952
  437    HA   HIS  56           HA       HIS  56   3.070   7.966   1.661
  438   1HB   HIS  56          2HB       HIS  56   2.531   7.834  -0.693
  439   2HB   HIS  56          3HB       HIS  56   2.042   9.527  -0.724
  440    HD1  HIS  56           HD1      HIS  56   3.805  10.804  -1.929
  441    HD2  HIS  56           HD2      HIS  56   5.461   7.928   0.591
  442    HE1  HIS  56           HE1      HIS  56   6.317  11.087  -2.072
  443    H    VAL  57           H        VAL  57   4.619   9.242   2.517
  444    HA   VAL  57           HA       VAL  57   4.565  12.103   2.444
  445    HB   VAL  57           HB       VAL  57   2.809  11.655   4.164
  446   1HG1  VAL  57          1HG1      VAL  57   3.302  10.545   6.194
  447   2HG1  VAL  57          2HG1      VAL  57   4.049   9.527   4.963
  448   3HG1  VAL  57          3HG1      VAL  57   5.042  10.629   5.918
  449   1HG2  VAL  57          1HG2      VAL  57   3.536  13.378   5.560
  450   2HG2  VAL  57          2HG2      VAL  57   5.195  12.783   5.604
  451   3HG2  VAL  57          3HG2      VAL  57   4.589  13.605   4.163
  452    H    MET  58           H        MET  58   6.347  13.000   3.907
  453    HA   MET  58           HA       MET  58   8.651  13.064   4.148
  454   1HB   MET  58          2HB       MET  58   7.726  12.138   6.295
  455   2HB   MET  58          3HB       MET  58   8.094  10.522   5.697
  456   1HG   MET  58          2HG       MET  58  10.488  11.696   5.266
  457   2HG   MET  58          3HG       MET  58   9.938  12.666   6.630
  458   1HE   MET  58          1HE       MET  58   9.101  11.835   8.769
  459   2HE   MET  58          2HE       MET  58  10.851  11.964   8.934
  460   3HE   MET  58          3HE       MET  58  10.006  10.583   9.629
  461    H    ASP  59           H        ASP  59   9.180   9.737   4.640
  462    HA   ASP  59           HA       ASP  59   9.939   9.262   1.839
  463   1HB   ASP  59          2HB       ASP  59  12.122   8.265   2.701
  464   2HB   ASP  59          3HB       ASP  59  12.015  10.022   2.724
  465    H    PHE  60           H        PHE  60   7.719   8.247   3.088
  466    HA   PHE  60           HA       PHE  60   8.196   5.415   2.883
  467   1HB   PHE  60          2HB       PHE  60   7.569   4.763   5.092
  468   2HB   PHE  60          3HB       PHE  60   8.812   6.000   5.288
  469    HD1  PHE  60           HD1      PHE  60   5.169   5.314   5.475
  470    HD2  PHE  60           HD2      PHE  60   8.296   8.164   6.235
  471    HE1  PHE  60           HE1      PHE  60   3.590   6.696   6.797
  472    HE2  PHE  60           HE2      PHE  60   6.714   9.541   7.561
  473    HZ   PHE  60           HZ       PHE  60   4.364   8.808   7.842
  474    H    ILE  61           H        ILE  61   6.107   4.185   3.253
  475    HA   ILE  61           HA       ILE  61   3.758   5.862   2.604
  476    HB   ILE  61           HB       ILE  61   4.482   3.214   1.318
  477   1HG1  ILE  61          2HG1      ILE  61   4.270   5.953   0.029
  478   2HG1  ILE  61          3HG1      ILE  61   5.800   5.290   0.605
  479   1HG2  ILE  61          1HG2      ILE  61   2.143   3.250   1.350
  480   2HG2  ILE  61          2HG2      ILE  61   2.068   5.007   1.241
  481   3HG2  ILE  61          3HG2      ILE  61   2.493   4.054  -0.182
  482   1HD1  ILE  61          1HD1      ILE  61   5.464   3.306  -0.856
  483   2HD1  ILE  61          2HD1      ILE  61   3.983   4.037  -1.473
  484   3HD1  ILE  61          3HD1      ILE  61   5.538   4.807  -1.779
  485    H    SER  62           H        SER  62   2.095   5.520   3.918
  486    HA   SER  62           HA       SER  62   2.138   3.188   5.708
  487   1HB   SER  62          2HB       SER  62   1.801   5.060   7.032
  488   2HB   SER  62          3HB       SER  62   0.880   5.904   5.793
  489    HG   SER  62           HG       SER  62  -0.368   5.055   7.592
  490    H    VAL  63           H        VAL  63   1.016   1.467   5.103
  491    HA   VAL  63           HA       VAL  63  -1.345   1.811   3.365
  492    HB   VAL  63           HB       VAL  63   0.263  -0.693   3.935
  493   1HG1  VAL  63          1HG1      VAL  63  -2.116  -0.029   2.233
  494   2HG1  VAL  63          2HG1      VAL  63  -0.965  -1.225   1.641
  495   3HG1  VAL  63          3HG1      VAL  63  -1.785  -1.478   3.183
  496   1HG2  VAL  63          1HG2      VAL  63   1.427  -0.318   1.904
  497   2HG2  VAL  63          2HG2      VAL  63   0.281   0.914   1.373
  498   3HG2  VAL  63          3HG2      VAL  63   1.415   1.263   2.677
  499    H    ASP  64           H        ASP  64  -3.264   1.697   4.351
  500    HA   ASP  64           HA       ASP  64  -3.463   0.177   6.870
  501   1HB   ASP  64          2HB       ASP  64  -5.670   1.487   7.085
  502   2HB   ASP  64          3HB       ASP  64  -4.167   2.370   7.319
  503    H    LYS  65           H        LYS  65  -4.957  -1.397   7.148
  504    HA   LYS  65           HA       LYS  65  -6.601  -2.166   4.813
  505   1HB   LYS  65          2HB       LYS  65  -6.102  -4.534   5.361
  506   2HB   LYS  65          3HB       LYS  65  -4.651  -3.640   4.909
  507   1HG   LYS  65          2HG       LYS  65  -4.013  -3.380   7.237
  508   2HG   LYS  65          3HG       LYS  65  -5.542  -4.079   7.774
  509   1HD   LYS  65          2HD       LYS  65  -4.851  -6.155   6.393
  510   2HD   LYS  65          3HD       LYS  65  -3.232  -5.453   6.410
  511   1HE   LYS  65          2HE       LYS  65  -3.321  -5.361   8.896
  512   2HE   LYS  65          3HE       LYS  65  -4.907  -6.128   8.850
  513   1HZ   LYS  65          1HZ       LYS  65  -3.079  -7.706   9.229
  514   2HZ   LYS  65          1HZ       LYS  65  -2.439  -7.310   7.706
  515   3HZ   LYS  65          3HZ       LYS  65  -3.962  -8.049   7.824
  516    H    GLU  66           H        GLU  66  -7.941  -4.264   5.805
  517    HA   GLU  66           HA       GLU  66  -9.568  -3.058   7.935
  518   1HB   GLU  66          2HB       GLU  66 -10.084  -5.044   5.752
  519   2HB   GLU  66          3HB       GLU  66 -11.095  -5.075   7.196
  520   1HG   GLU  66          2HG       GLU  66 -10.574  -2.472   5.781
  521   2HG   GLU  66          3HG       GLU  66 -11.814  -3.568   5.179
  522    H    ASN  67           H        ASN  67  -9.867  -4.002   9.882
  523    HA   ASN  67           HA       ASN  67  -7.992  -5.749  10.963
  524   1HB   ASN  67          2HB       ASN  67  -9.741  -6.095  12.782
  525   2HB   ASN  67          3HB       ASN  67  -9.265  -4.429  12.466
  526   1HD2  ASN  67          2HD2      ASN  67 -11.897  -5.627  13.504
  527   2HD2  ASN  67          1HD2      ASN  67 -13.082  -4.967  12.483
  528    H    ASP  68           H        ASP  68 -10.914  -6.416   9.194
  529    HA   ASP  68           HA       ASP  68 -11.300  -9.126   9.946
  530   1HB   ASP  68          2HB       ASP  68 -11.987  -8.020   7.232
  531   2HB   ASP  68          3HB       ASP  68 -12.847  -9.235   8.179
  532    H    ALA  69           H        ALA  69  -9.249  -7.570   7.541
  533    HA   ALA  69           HA       ALA  69  -8.482 -10.113   6.335
  534   1HB   ALA  69          1HB       ALA  69  -8.647  -8.356   4.762
  535   2HB   ALA  69          2HB       ALA  69  -7.772  -7.229   5.799
  536   3HB   ALA  69          3HB       ALA  69  -6.914  -8.555   5.014
  537    H    ASN  70           H        ASN  70  -5.967 -10.245   5.901
  538    HA   ASN  70           HA       ASN  70  -4.506  -9.704   8.416
  539   1HB   ASN  70          2HB       ASN  70  -4.631 -12.299   6.867
  540   2HB   ASN  70          3HB       ASN  70  -3.411 -11.959   8.094
  541   1HD2  ASN  70          2HD2      ASN  70  -4.334 -11.360  10.334
  542   2HD2  ASN  70          1HD2      ASN  70  -5.782 -12.106  10.809
  543    H    TRP  71           H        TRP  71  -2.127  -9.847   8.150
  544    HA   TRP  71           HA       TRP  71  -1.296  -8.400   5.800
  545   1HB   TRP  71          2HB       TRP  71   0.079  -9.333   8.306
  546   2HB   TRP  71          3HB       TRP  71   1.013  -8.688   6.955
  547    HD1  TRP  71           HD1      TRP  71  -0.631  -7.568   9.984
  548    HE1  TRP  71           HE1      TRP  71  -1.140  -5.039   9.907
  549    HE3  TRP  71           HE3      TRP  71   0.083  -6.673   5.007
  550    HZ2  TRP  71           HZ2      TRP  71  -1.226  -2.920   7.992
  551    HZ3  TRP  71           HZ3      TRP  71  -0.220  -4.392   4.084
  552    HH2  TRP  71           HH2      TRP  71  -0.873  -2.517   5.568
  553    H    GLU  72           H        GLU  72  -0.272 -11.516   7.235
  554    HA   GLU  72           HA       GLU  72   1.489 -12.372   5.313
  555   1HB   GLU  72          2HB       GLU  72   1.196 -13.702   7.266
  556   2HB   GLU  72          3HB       GLU  72  -0.517 -13.940   6.936
  557   1HG   GLU  72          2HG       GLU  72  -0.034 -15.324   5.020
  558   2HG   GLU  72          3HG       GLU  72   1.684 -14.929   5.101
  559    H    THR  73           H        THR  73  -1.906 -11.923   4.960
  560    HA   THR  73           HA       THR  73  -2.115 -13.604   2.579
  561    HB   THR  73           HB       THR  73  -4.055 -11.853   4.098
  562    HG1  THR  73           HG1      THR  73  -4.563 -14.499   3.547
  563   1HG2  THR  73          1HG2      THR  73  -5.745 -12.935   2.464
  564   2HG2  THR  73          2HG2      THR  73  -4.790 -11.578   1.870
  565   3HG2  THR  73          3HG2      THR  73  -4.347 -13.227   1.427
  566    H    VAL  74           H        VAL  74  -2.287 -10.196   3.475
  567    HA   VAL  74           HA       VAL  74  -2.488  -9.320   0.730
  568    HB   VAL  74           HB       VAL  74  -2.839  -8.193   3.404
  569   1HG1  VAL  74          1HG1      VAL  74  -2.367  -5.861   2.679
  570   2HG1  VAL  74          2HG1      VAL  74  -0.911  -6.844   2.813
  571   3HG1  VAL  74          3HG1      VAL  74  -1.597  -6.500   1.227
  572   1HG2  VAL  74          1HG2      VAL  74  -4.563  -6.918   2.222
  573   2HG2  VAL  74          2HG2      VAL  74  -3.887  -7.411   0.670
  574   3HG2  VAL  74          3HG2      VAL  74  -4.631  -8.610   1.728
  575    H    LEU  75           H        LEU  75   0.009  -9.338   3.247
  576    HA   LEU  75           HA       LEU  75   1.895  -7.655   2.200
  577   1HB   LEU  75          2HB       LEU  75   1.880  -9.408   4.272
  578   2HB   LEU  75          3HB       LEU  75   3.016 -10.204   3.184
  579    HG   LEU  75           HG       LEU  75   3.188  -7.282   3.975
  580   1HD1  LEU  75          1HD1      LEU  75   4.990  -7.928   5.478
  581   2HD1  LEU  75          2HD1      LEU  75   3.548  -8.849   5.903
  582   3HD1  LEU  75          3HD1      LEU  75   4.846  -9.615   4.985
  583   1HD2  LEU  75          1HD2      LEU  75   5.568  -7.649   3.099
  584   2HD2  LEU  75          2HD2      LEU  75   4.983  -9.174   2.431
  585   3HD2  LEU  75          3HD2      LEU  75   4.294  -7.647   1.881
  586    HA   PRO  76           HA       PRO  76   3.740 -11.483  -0.394
  587   1HB   PRO  76          2HB       PRO  76   1.336 -12.679  -1.453
  588   2HB   PRO  76          3HB       PRO  76   2.623 -13.442  -0.506
  589   1HG   PRO  76          2HG       PRO  76   0.010 -12.464   0.353
  590   2HG   PRO  76          3HG       PRO  76   1.094 -13.619   1.132
  591   1HD   PRO  76          2HD       PRO  76   0.667 -11.117   2.121
  592   2HD   PRO  76          3HD       PRO  76   2.211 -11.973   2.330
  593    H    LYS  77           H        LYS  77   0.728  -9.729  -0.998
  594    HA   LYS  77           HA       LYS  77   1.288  -9.382  -3.831
  595   1HB   LYS  77          2HB       LYS  77  -0.855  -8.338  -1.982
  596   2HB   LYS  77          3HB       LYS  77  -0.715  -7.799  -3.654
  597   1HG   LYS  77          2HG       LYS  77  -2.136  -9.576  -3.986
  598   2HG   LYS  77          3HG       LYS  77  -0.607 -10.452  -4.075
  599   1HD   LYS  77          2HD       LYS  77  -0.787 -10.875  -1.602
  600   2HD   LYS  77          3HD       LYS  77  -2.397 -10.160  -1.648
  601   1HE   LYS  77          2HE       LYS  77  -1.512 -12.554  -3.286
  602   2HE   LYS  77          3HE       LYS  77  -2.472 -12.639  -1.813
  603   1HZ   LYS  77          1HZ       LYS  77  -4.308 -11.974  -2.875
  604   2HZ   LYS  77          1HZ       LYS  77  -3.491 -12.458  -4.284
  605   3HZ   LYS  77          3HZ       LYS  77  -3.491 -10.825  -3.815
  606    H    VAL  78           H        VAL  78   1.084  -7.259  -0.967
  607    HA   VAL  78           HA       VAL  78   1.744  -4.828  -2.020
  608    HB   VAL  78           HB       VAL  78   2.908  -5.968   0.536
  609   1HG1  VAL  78          1HG1      VAL  78   4.001  -3.915   0.118
  610   2HG1  VAL  78          2HG1      VAL  78   2.552  -3.181  -0.569
  611   3HG1  VAL  78          3HG1      VAL  78   2.660  -3.464   1.168
  612   1HG2  VAL  78          1HG2      VAL  78   0.301  -4.479   0.062
  613   2HG2  VAL  78          2HG2      VAL  78   0.432  -6.202   0.397
  614   3HG2  VAL  78          3HG2      VAL  78   0.913  -5.034   1.624
  615    H    GLU  79           H        GLU  79   4.119  -7.257  -0.906
  616    HA   GLU  79           HA       GLU  79   6.443  -5.917  -1.639
  617   1HB   GLU  79          2HB       GLU  79   6.264  -8.069  -0.321
  618   2HB   GLU  79          3HB       GLU  79   6.047  -8.907  -1.856
  619   1HG   GLU  79          2HG       GLU  79   8.364  -9.065  -1.494
  620   2HG   GLU  79          3HG       GLU  79   8.229  -7.683  -2.580
  621    H    ALA  80           H        ALA  80   4.334  -7.999  -3.577
  622    HA   ALA  80           HA       ALA  80   5.820  -8.325  -5.872
  623   1HB   ALA  80          1HB       ALA  80   3.820  -8.820  -6.983
  624   2HB   ALA  80          2HB       ALA  80   3.440  -9.166  -5.295
  625   3HB   ALA  80          3HB       ALA  80   2.892  -7.660  -6.034
  626    H    VAL  81           H        VAL  81   4.146  -5.441  -4.777
  627    HA   VAL  81           HA       VAL  81   4.162  -3.966  -7.177
  628    HB   VAL  81           HB       VAL  81   4.477  -2.832  -4.389
  629   1HG1  VAL  81          1HG1      VAL  81   2.927  -1.664  -6.695
  630   2HG1  VAL  81          2HG1      VAL  81   3.580  -0.845  -5.278
  631   3HG1  VAL  81          3HG1      VAL  81   4.663  -1.399  -6.556
  632   1HG2  VAL  81          1HG2      VAL  81   2.529  -4.592  -4.989
  633   2HG2  VAL  81          2HG2      VAL  81   2.246  -3.194  -3.956
  634   3HG2  VAL  81          3HG2      VAL  81   1.794  -3.137  -5.658
  635    H    PHE  82           H        PHE  82   6.408  -3.706  -4.404
  636    HA   PHE  82           HA       PHE  82   8.334  -2.282  -6.053
  637   1HB   PHE  82          2HB       PHE  82   8.939  -3.204  -3.266
  638   2HB   PHE  82          3HB       PHE  82   9.419  -1.717  -4.083
  639    HD1  PHE  82           HD1      PHE  82   6.732  -3.435  -2.251
  640    HD2  PHE  82           HD2      PHE  82   7.868   0.172  -4.288
  641    HE1  PHE  82           HE1      PHE  82   4.784  -2.263  -1.266
  642    HE2  PHE  82           HE2      PHE  82   5.917   1.341  -3.304
  643    HZ   PHE  82           HZ       PHE  82   4.373   0.120  -1.797
  644    H    GLU  83           H        GLU  83   7.923  -4.823  -7.078
  645    HA   GLU  83           HA       GLU  83  10.609  -5.859  -6.998
  646   1HB   GLU  83          2HB       GLU  83   8.673  -7.024  -5.249
  647   2HB   GLU  83          3HB       GLU  83   9.021  -8.184  -6.528
  648   1HG   GLU  83          2HG       GLU  83  11.153  -6.746  -4.913
  649   2HG   GLU  83          3HG       GLU  83  10.560  -8.363  -4.541
  650    H    LEU  84           H        LEU  84   7.280  -6.143  -8.092
  651    HA   LEU  84           HA       LEU  84   6.356  -7.069 -10.008
  652   1HB   LEU  84          2HB       LEU  84   8.655  -5.338 -10.893
  653   2HB   LEU  84          3HB       LEU  84   7.644  -6.155 -12.081
  654    HG   LEU  84           HG       LEU  84   6.358  -4.569  -9.878
  655   1HD1  LEU  84          1HD1      LEU  84   6.440  -2.560 -11.267
  656   2HD1  LEU  84          2HD1      LEU  84   8.084  -3.105 -10.945
  657   3HD1  LEU  84          3HD1      LEU  84   7.340  -3.422 -12.514
  658   1HD2  LEU  84          1HD2      LEU  84   5.473  -4.738 -12.744
  659   2HD2  LEU  84          2HD2      LEU  84   5.234  -6.134 -11.693
  660   3HD2  LEU  84          3HD2      LEU  84   4.497  -4.586 -11.283
  661    H    GLU  85           H        GLU  85   7.506  -9.145  -8.900
  662    HA   GLU  85           HA       GLU  85   8.691 -11.113  -9.173
  663   1HB   GLU  85          2HB       GLU  85   7.705 -10.723 -12.009
  664   2HB   GLU  85          3HB       GLU  85   8.164 -12.252 -11.269
  665   1HG   GLU  85          2HG       GLU  85   5.818 -12.237 -11.064
  666   2HG   GLU  85          3HG       GLU  85   6.370 -11.695  -9.481
  667    H    HIS  86           H        HIS  86   9.867 -11.995 -11.740
  668    HA   HIS  86           HA       HIS  86  12.295 -10.302 -11.706
  669   1HB   HIS  86          2HB       HIS  86  12.213 -13.217 -12.488
  670   2HB   HIS  86          3HB       HIS  86  13.620 -12.232 -12.085
  671    HD1  HIS  86           HD1      HIS  86  13.746 -11.396  -9.523
  672    HD2  HIS  86           HD2      HIS  86  11.042 -14.472 -10.289
  673    HE1  HIS  86           HE1      HIS  86  13.142 -12.394  -7.275
  674    H    HIS  87           H        HIS  87  12.805  -9.307 -13.545
  675    HA   HIS  87           HA       HIS  87  12.093 -10.474 -16.129
  676   1HB   HIS  87          2HB       HIS  87  10.916  -7.921 -15.044
  677   2HB   HIS  87          3HB       HIS  87  11.116  -8.157 -16.776
  678    HD1  HIS  87           HD1      HIS  87  10.276 -10.933 -17.311
  679    HD2  HIS  87           HD2      HIS  87   8.323  -8.627 -14.439
  680    HE1  HIS  87           HE1      HIS  87   7.988 -11.967 -16.999
  681    H    HIS  88           H        HIS  88  12.614  -8.386 -17.763
  682    HA   HIS  88           HA       HIS  88  15.481  -7.961 -17.331
  683   1HB   HIS  88          2HB       HIS  88  15.367  -7.158 -19.742
  684   2HB   HIS  88          3HB       HIS  88  14.963  -8.855 -19.484
  685    HD1  HIS  88           HD1      HIS  88  12.294  -6.634 -18.335
  686    HD2  HIS  88           HD2      HIS  88  13.346  -8.418 -21.955
  687    HE1  HIS  88           HE1      HIS  88  10.241  -6.522 -19.811
  688    H    HIS  89           H        HIS  89  14.519  -6.419 -15.530
  689    HA   HIS  89           HA       HIS  89  13.408  -3.932 -16.240
  690   1HB   HIS  89          2HB       HIS  89  13.419  -4.720 -13.925
  691   2HB   HIS  89          3HB       HIS  89  15.180  -4.650 -13.885
  692    HD1  HIS  89           HD1      HIS  89  12.843  -2.038 -15.355
  693    HD2  HIS  89           HD2      HIS  89  15.545  -2.446 -12.203
  694    HE1  HIS  89           HE1      HIS  89  13.100   0.262 -14.329
  695    H    HIS  90           H        HIS  90  16.391  -3.479 -14.608
  696    HA   HIS  90           HA       HIS  90  17.657  -2.394 -17.047
  697   1HB   HIS  90          2HB       HIS  90  17.304  -1.050 -14.362
  698   2HB   HIS  90          3HB       HIS  90  18.522  -0.532 -15.526
  699    HD1  HIS  90           HD1      HIS  90  15.867  -1.649 -17.573
  700    HD2  HIS  90           HD2      HIS  90  16.439   1.779 -15.267
  701    HE1  HIS  90           HE1      HIS  90  14.264   0.094 -18.470
  702    H    HIS  91           H        HIS  91  18.006  -3.634 -13.767
  703    HA   HIS  91           HA       HIS  91  20.674  -4.648 -14.476
  704   1HB   HIS  91          2HB       HIS  91  20.878  -2.471 -13.190
  705   2HB   HIS  91          3HB       HIS  91  20.122  -3.295 -11.826
  706    HD1  HIS  91           HD1      HIS  91  22.652  -4.820 -14.207
  707    HD2  HIS  91           HD2      HIS  91  22.372  -3.662 -10.214
  708    HE1  HIS  91           HE1      HIS  91  24.759  -5.651 -13.073
  Start of MODEL    3
    1   1H    MET   1          1HT       MET   1  13.990   1.154  -4.135
    2   2H    MET   1          2HT       MET   1  14.198   2.804  -4.475
    3   3H    MET   1          3HT       MET   1  13.448   1.789  -5.612
    4    HA   MET   1           HA       MET   1  12.391   2.827  -3.065
    5   1HB   MET   1          2HB       MET   1  11.382   2.639  -5.920
    6   2HB   MET   1          3HB       MET   1  10.406   3.225  -4.573
    7   1HG   MET   1          2HG       MET   1  12.031   5.013  -4.140
    8   2HG   MET   1          3HG       MET   1  13.059   4.413  -5.443
    9   1HE   MET   1          1HE       MET   1  12.928   4.902  -7.722
   10   2HE   MET   1          2HE       MET   1  11.508   5.372  -8.653
   11   3HE   MET   1          3HE       MET   1  11.574   3.779  -7.905
   12    H    LYS   2           H        LYS   2  12.827   0.577  -2.203
   13    HA   LYS   2           HA       LYS   2  10.500  -1.158  -2.775
   14   1HB   LYS   2          2HB       LYS   2  13.319  -2.091  -2.167
   15   2HB   LYS   2          3HB       LYS   2  11.916  -3.127  -2.433
   16   1HG   LYS   2          2HG       LYS   2  11.701  -1.945  -4.718
   17   2HG   LYS   2          3HG       LYS   2  13.339  -1.358  -4.427
   18   1HD   LYS   2          2HD       LYS   2  12.737  -4.287  -4.102
   19   2HD   LYS   2          3HD       LYS   2  12.989  -3.624  -5.717
   20   1HE   LYS   2          2HE       LYS   2  14.943  -3.082  -3.482
   21   2HE   LYS   2          3HE       LYS   2  15.064  -4.534  -4.474
   22   1HZ   LYS   2          1HZ       LYS   2  14.785  -2.707  -6.364
   23   2HZ   LYS   2          1HZ       LYS   2  16.300  -3.163  -5.746
   24   3HZ   LYS   2          3HZ       LYS   2  15.540  -1.751  -5.184
   25    H    ILE   3           H        ILE   3  10.812  -3.026  -0.843
   26    HA   ILE   3           HA       ILE   3  10.176  -1.536   1.563
   27    HB   ILE   3           HB       ILE   3  10.255  -4.513   1.001
   28   1HG1  ILE   3          2HG1      ILE   3   7.803  -2.823   1.471
   29   2HG1  ILE   3          3HG1      ILE   3   8.521  -2.909  -0.136
   30   1HG2  ILE   3          1HG2      ILE   3   8.822  -4.531   3.134
   31   2HG2  ILE   3          2HG2      ILE   3  10.550  -4.262   3.349
   32   3HG2  ILE   3          3HG2      ILE   3   9.431  -2.903   3.425
   33   1HD1  ILE   3          1HD1      ILE   3   7.757  -5.352   1.486
   34   2HD1  ILE   3          2HD1      ILE   3   6.708  -4.618   0.276
   35   3HD1  ILE   3          3HD1      ILE   3   8.258  -5.309  -0.204
   36    H    ILE   4           H        ILE   4  11.539  -1.102   3.176
   37    HA   ILE   4           HA       ILE   4  14.151  -2.488   3.222
   38    HB   ILE   4           HB       ILE   4  13.300   0.298   3.969
   39   1HG1  ILE   4          2HG1      ILE   4  15.430   0.778   2.687
   40   2HG1  ILE   4          3HG1      ILE   4  15.528  -0.943   2.331
   41   1HG2  ILE   4          1HG2      ILE   4  14.472  -0.290   5.943
   42   2HG2  ILE   4          2HG2      ILE   4  15.632  -1.283   5.060
   43   3HG2  ILE   4          3HG2      ILE   4  15.693   0.475   4.926
   44   1HD1  ILE   4          1HD1      ILE   4  13.709  -0.897   0.909
   45   2HD1  ILE   4          2HD1      ILE   4  12.956   0.458   1.746
   46   3HD1  ILE   4          3HD1      ILE   4  14.317   0.738   0.661
   47    H    SER   5           H        SER   5  11.803  -0.972   5.456
   48    HA   SER   5           HA       SER   5  11.666  -3.254   7.156
   49   1HB   SER   5          2HB       SER   5  12.786  -2.259   9.135
   50   2HB   SER   5          3HB       SER   5  13.912  -2.580   7.820
   51    HG   SER   5           HG       SER   5  12.765  -0.116   8.617
   52    H    ILE   6           H        ILE   6  10.079  -3.043   8.733
   53    HA   ILE   6           HA       ILE   6   8.320  -0.730   8.390
   54    HB   ILE   6           HB       ILE   6   7.872  -3.269   9.984
   55   1HG1  ILE   6          2HG1      ILE   6   6.681  -2.663   7.279
   56   2HG1  ILE   6          3HG1      ILE   6   8.274  -3.409   7.395
   57   1HG2  ILE   6          1HG2      ILE   6   6.377  -1.526  10.706
   58   2HG2  ILE   6          2HG2      ILE   6   6.062  -1.025   9.045
   59   3HG2  ILE   6          3HG2      ILE   6   5.454  -2.574   9.631
   60   1HD1  ILE   6          1HD1      ILE   6   7.440  -5.353   8.391
   61   2HD1  ILE   6          2HD1      ILE   6   5.979  -4.551   8.968
   62   3HD1  ILE   6          3HD1      ILE   6   6.153  -4.942   7.257
   63    H    SER   7           H        SER   7   7.527   0.484  10.169
   64    HA   SER   7           HA       SER   7   9.488   0.759  12.327
   65   1HB   SER   7          2HB       SER   7   8.555   2.922  12.693
   66   2HB   SER   7          3HB       SER   7   8.655   2.724  10.947
   67    HG   SER   7           HG       SER   7   6.483   3.045  12.549
   68    H    GLU   8           H        GLU   8   7.708   2.004  14.175
   69    HA   GLU   8           HA       GLU   8   6.767  -0.292  15.577
   70   1HB   GLU   8          2HB       GLU   8   6.073   2.555  16.270
   71   2HB   GLU   8          3HB       GLU   8   6.293   1.183  17.347
   72   1HG   GLU   8          2HG       GLU   8   8.448   2.630  15.786
   73   2HG   GLU   8          3HG       GLU   8   8.251   2.588  17.537
   74    H    THR   9           H        THR   9   4.614  -0.665  16.246
   75    HA   THR   9           HA       THR   9   2.460   0.673  14.793
   76    HB   THR   9           HB       THR   9   2.945  -0.964  13.174
   77    HG1  THR   9           HG1      THR   9   0.814  -1.184  13.569
   78   1HG2  THR   9          1HG2      THR   9   4.615  -2.247  14.226
   79   2HG2  THR   9          2HG2      THR   9   3.556  -2.691  15.563
   80   3HG2  THR   9          3HG2      THR   9   3.302  -3.396  13.967
   81    HA   PRO  10           HA       PRO  10   1.508  -0.989  19.072
   82   1HB   PRO  10          2HB       PRO  10   1.292   1.689  20.099
   83   2HB   PRO  10          3HB       PRO  10   2.473   0.442  20.522
   84   1HG   PRO  10          2HG       PRO  10   3.035   2.787  19.183
   85   2HG   PRO  10          3HG       PRO  10   4.057   1.341  19.205
   86   1HD   PRO  10          2HD       PRO  10   2.212   2.313  17.067
   87   2HD   PRO  10          3HD       PRO  10   3.738   1.414  16.927
   88    H    ASN  11           H        ASN  11  -0.056   0.091  16.622
   89    HA   ASN  11           HA       ASN  11  -2.617   0.321  18.035
   90   1HB   ASN  11          2HB       ASN  11  -1.853   2.635  17.530
   91   2HB   ASN  11          3HB       ASN  11  -1.792   2.211  15.820
   92   1HD2  ASN  11          2HD2      ASN  11  -4.169   1.872  18.534
   93   2HD2  ASN  11          1HD2      ASN  11  -5.506   2.342  17.600
   94    H    HIS  12           H        HIS  12  -0.717  -0.749  15.400
   95    HA   HIS  12           HA       HIS  12  -1.152  -2.186  13.663
   96   1HB   HIS  12          2HB       HIS  12  -2.604  -3.168  15.690
   97   2HB   HIS  12          3HB       HIS  12  -3.925  -2.733  14.608
   98    HD1  HIS  12           HD1      HIS  12  -0.491  -4.160  13.754
   99    HD2  HIS  12           HD2      HIS  12  -4.526  -5.122  13.353
  100    HE1  HIS  12           HE1      HIS  12  -0.587  -6.283  12.375
  101    H    ASN  13           H        ASN  13  -3.665  -2.746  12.426
  102    HA   ASN  13           HA       ASN  13  -5.155  -1.950  10.883
  103   1HB   ASN  13          2HB       ASN  13  -4.674   0.812  12.015
  104   2HB   ASN  13          3HB       ASN  13  -6.057   0.262  11.072
  105   1HD2  ASN  13          2HD2      ASN  13  -6.957  -1.993  12.233
  106   2HD2  ASN  13          1HD2      ASN  13  -7.277  -1.779  13.887
  107    H    THR  14           H        THR  14  -2.442   0.353  11.298
  108    HA   THR  14           HA       THR  14  -1.761  -0.054   8.482
  109    HB   THR  14           HB       THR  14  -3.273   1.902   8.476
  110    HG1  THR  14           HG1      THR  14  -1.503   3.417   7.729
  111   1HG2  THR  14          1HG2      THR  14  -2.485   2.516  10.898
  112   2HG2  THR  14          2HG2      THR  14  -1.216   3.413  10.063
  113   3HG2  THR  14          3HG2      THR  14  -2.909   3.807   9.775
  114    H    MET  15           H        MET  15   0.362  -0.233   8.197
  115    HA   MET  15           HA       MET  15   2.140   0.672  10.388
  116   1HB   MET  15          2HB       MET  15   3.013  -1.309   8.310
  117   2HB   MET  15          3HB       MET  15   3.550  -1.125   9.980
  118   1HG   MET  15          2HG       MET  15   1.170  -1.827  10.650
  119   2HG   MET  15          3HG       MET  15   0.978  -2.336   8.974
  120   1HE   MET  15          1HE       MET  15   2.567  -3.734   7.734
  121   2HE   MET  15          2HE       MET  15   1.413  -4.889   8.395
  122   3HE   MET  15          3HE       MET  15   3.132  -5.270   8.404
  123    H    LYS  16           H        LYS  16   4.247   1.466   9.769
  124    HA   LYS  16           HA       LYS  16   4.114   3.082   7.315
  125   1HB   LYS  16          2HB       LYS  16   4.569   4.194   9.506
  126   2HB   LYS  16          3HB       LYS  16   6.072   3.280   9.613
  127   1HG   LYS  16          2HG       LYS  16   6.845   4.282   7.497
  128   2HG   LYS  16          3HG       LYS  16   5.335   5.183   7.369
  129   1HD   LYS  16          2HD       LYS  16   6.795   6.754   8.333
  130   2HD   LYS  16          3HD       LYS  16   5.947   6.097   9.733
  131   1HE   LYS  16          2HE       LYS  16   8.023   5.709  10.566
  132   2HE   LYS  16          3HE       LYS  16   8.049   4.336   9.460
  133   1HZ   LYS  16          1HZ       LYS  16   8.829   6.146   7.778
  134   2HZ   LYS  16          1HZ       LYS  16   9.941   5.438   8.851
  135   3HZ   LYS  16          3HZ       LYS  16   9.299   6.977   9.180
  136    H    ILE  17           H        ILE  17   5.235   2.524   5.576
  137    HA   ILE  17           HA       ILE  17   7.292   0.436   5.801
  138    HB   ILE  17           HB       ILE  17   5.968   1.577   3.328
  139   1HG1  ILE  17          2HG1      ILE  17   5.403  -1.073   4.684
  140   2HG1  ILE  17          3HG1      ILE  17   4.455   0.376   5.015
  141   1HG2  ILE  17          1HG2      ILE  17   8.049   0.560   2.730
  142   2HG2  ILE  17          2HG2      ILE  17   7.802  -0.778   3.853
  143   3HG2  ILE  17          3HG2      ILE  17   6.816  -0.655   2.395
  144   1HD1  ILE  17          1HD1      ILE  17   3.428  -1.057   3.250
  145   2HD1  ILE  17          2HD1      ILE  17   3.835   0.557   2.665
  146   3HD1  ILE  17          3HD1      ILE  17   4.868  -0.814   2.258
  147    H    THR  18           H        THR  18   9.364   0.966   5.775
  148    HA   THR  18           HA       THR  18  10.194   3.664   5.058
  149    HB   THR  18           HB       THR  18  11.775   1.298   6.098
  150    HG1  THR  18           HG1      THR  18  11.187   1.981   7.984
  151   1HG2  THR  18          1HG2      THR  18  12.498   4.177   5.544
  152   2HG2  THR  18          2HG2      THR  18  13.400   3.199   6.701
  153   3HG2  THR  18          3HG2      THR  18  13.331   2.718   5.007
  154    H    LEU  19           H        LEU  19  11.177   4.235   3.201
  155    HA   LEU  19           HA       LEU  19  11.708   2.114   1.221
  156   1HB   LEU  19          2HB       LEU  19  11.452   5.102   0.800
  157   2HB   LEU  19          3HB       LEU  19  11.588   3.876  -0.458
  158    HG   LEU  19           HG       LEU  19   9.336   4.009   1.571
  159   1HD1  LEU  19          1HD1      LEU  19   8.908   5.842   0.184
  160   2HD1  LEU  19          2HD1      LEU  19   9.655   5.081  -1.221
  161   3HD1  LEU  19          3HD1      LEU  19   8.068   4.547  -0.667
  162   1HD2  LEU  19          1HD2      LEU  19   9.521   1.762   0.869
  163   2HD2  LEU  19          2HD2      LEU  19   8.323   2.434  -0.235
  164   3HD2  LEU  19          3HD2      LEU  19   9.990   2.217  -0.769
  165    H    SER  20           H        SER  20  13.538   2.792  -0.359
  166    HA   SER  20           HA       SER  20  15.976   2.781   1.084
  167   1HB   SER  20          2HB       SER  20  17.048   2.862  -1.099
  168   2HB   SER  20          3HB       SER  20  15.674   1.762  -1.162
  169    HG   SER  20           HG       SER  20  15.887   4.413  -2.135
  170    H    GLU  21           H        GLU  21  13.903   5.315   0.482
  171    HA   GLU  21           HA       GLU  21  14.058   7.584   0.769
  172   1HB   GLU  21          2HB       GLU  21  16.936   7.202   1.608
  173   2HB   GLU  21          3HB       GLU  21  15.827   8.493   2.067
  174   1HG   GLU  21          2HG       GLU  21  14.383   6.511   3.034
  175   2HG   GLU  21          3HG       GLU  21  15.921   5.649   3.026
  176    H    SER  22           H        SER  22  14.295   9.142  -0.726
  177    HA   SER  22           HA       SER  22  16.667   9.198  -2.431
  178   1HB   SER  22          2HB       SER  22  15.082   7.677  -3.583
  179   2HB   SER  22          3HB       SER  22  13.881   8.964  -3.591
  180    HG   SER  22           HG       SER  22  15.784   8.537  -5.344
  181    H    ARG  23           H        ARG  23  17.325  11.220  -2.383
  182    HA   ARG  23           HA       ARG  23  17.305  13.507  -2.024
  183   1HB   ARG  23          2HB       ARG  23  15.418  12.987  -4.311
  184   2HB   ARG  23          3HB       ARG  23  15.794  14.632  -3.795
  185   1HG   ARG  23          2HG       ARG  23  18.061  12.721  -4.238
  186   2HG   ARG  23          3HG       ARG  23  17.265  13.426  -5.645
  187   1HD   ARG  23          2HD       ARG  23  17.671  15.685  -4.763
  188   2HD   ARG  23          3HD       ARG  23  18.431  14.999  -3.330
  189    HE   ARG  23           HE       ARG  23  20.302  14.389  -4.654
  190   1HH1  ARG  23          1HH2      ARG  23  19.787  17.198  -5.704
  191   2HH1  ARG  23          2HH2      ARG  23  19.886  16.957  -7.416
  192   1HH2  ARG  23          1HH1      ARG  23  19.557  13.511  -7.217
  193   2HH2  ARG  23          2HH1      ARG  23  19.755  14.869  -8.273
  194    H    GLU  24           H        GLU  24  16.493  13.715   0.067
  195    HA   GLU  24           HA       GLU  24  15.034  14.338   1.724
  196   1HB   GLU  24          2HB       GLU  24  14.191  15.951  -0.665
  197   2HB   GLU  24          3HB       GLU  24  13.285  16.074   0.843
  198   1HG   GLU  24          2HG       GLU  24  15.302  16.695   2.061
  199   2HG   GLU  24          3HG       GLU  24  16.286  16.449   0.620
  200    H    GLY  25           H        GLY  25  12.479  14.679  -0.648
  201   1HA   GLY  25          1HA       GLY  25  11.318  12.079  -0.057
  202   2HA   GLY  25          2HA       GLY  25  10.444  13.454   0.614
  203    H    MET  26           H        MET  26   8.699  12.665  -0.786
  204    HA   MET  26           HA       MET  26   8.809  13.993  -3.393
  205   1HB   MET  26          2HB       MET  26   7.474  11.785  -4.170
  206   2HB   MET  26          3HB       MET  26   9.218  11.959  -4.354
  207   1HG   MET  26          2HG       MET  26   9.574  10.796  -2.213
  208   2HG   MET  26          3HG       MET  26   7.831  10.644  -1.997
  209   1HE   MET  26          1HE       MET  26   9.146   7.948  -1.723
  210   2HE   MET  26          2HE       MET  26  10.572   8.764  -2.360
  211   3HE   MET  26          3HE       MET  26   9.992   7.290  -3.131
  212    H    THR  27           H        THR  27   7.473  15.474  -2.214
  213    HA   THR  27           HA       THR  27   5.517  16.298  -1.304
  214    HB   THR  27           HB       THR  27   5.204  16.340  -3.778
  215    HG1  THR  27           HG1      THR  27   3.462  16.660  -1.888
  216   1HG2  THR  27          1HG2      THR  27   3.566  14.647  -4.701
  217   2HG2  THR  27          2HG2      THR  27   5.160  13.998  -4.325
  218   3HG2  THR  27          3HG2      THR  27   3.809  13.705  -3.231
  219    H    SER  28           H        SER  28   2.865  15.102  -1.700
  220    HA   SER  28           HA       SER  28   2.876  12.611  -0.222
  221   1HB   SER  28          2HB       SER  28   1.429  13.636   1.607
  222   2HB   SER  28          3HB       SER  28   3.141  14.044   1.663
  223    HG   SER  28           HG       SER  28   2.625  15.991   0.584
  224    H    ASP  29           H        ASP  29   0.970  11.492  -0.453
  225    HA   ASP  29           HA       ASP  29  -1.437  12.810  -1.397
  226   1HB   ASP  29          2HB       ASP  29   0.278  11.117  -3.186
  227   2HB   ASP  29          3HB       ASP  29  -1.473  11.106  -3.386
  228    H    THR  30           H        THR  30  -3.223  11.709  -0.812
  229    HA   THR  30           HA       THR  30  -2.836   9.107   0.513
  230    HB   THR  30           HB       THR  30  -5.353  10.771   0.591
  231    HG1  THR  30           HG1      THR  30  -3.879  12.180   1.333
  232   1HG2  THR  30          1HG2      THR  30  -5.388   8.432   1.445
  233   2HG2  THR  30          2HG2      THR  30  -4.085   8.845   2.562
  234   3HG2  THR  30          3HG2      THR  30  -5.663   9.616   2.724
  235    H    TYR  31           H        TYR  31  -3.580   7.281  -0.377
  236    HA   TYR  31           HA       TYR  31  -5.370   7.508  -2.718
  237   1HB   TYR  31          2HB       TYR  31  -3.378   5.322  -2.064
  238   2HB   TYR  31          3HB       TYR  31  -4.361   5.441  -3.524
  239    HD1  TYR  31           HD1      TYR  31  -4.201   7.870  -4.710
  240    HD2  TYR  31           HD2      TYR  31  -1.184   6.104  -2.212
  241    HE1  TYR  31           HE1      TYR  31  -2.483   9.322  -5.757
  242    HE2  TYR  31           HE2      TYR  31   0.532   7.557  -3.259
  243    HH   TYR  31           HH       TYR  31  -0.237  10.240  -5.155
  244    H    THR  32           H        THR  32  -7.366   6.857  -2.365
  245    HA   THR  32           HA       THR  32  -7.850   4.644  -0.461
  246    HB   THR  32           HB       THR  32  -9.822   5.721   0.329
  247    HG1  THR  32           HG1      THR  32 -10.689   7.482  -0.667
  248   1HG2  THR  32          1HG2      THR  32  -8.957   7.693   1.349
  249   2HG2  THR  32          2HG2      THR  32  -7.557   6.653   1.088
  250   3HG2  THR  32          3HG2      THR  32  -7.868   8.005  -0.003
  251    H    LYS  33           H        LYS  33  -8.159   5.834  -3.611
  252    HA   LYS  33           HA       LYS  33  -9.723   3.522  -4.420
  253   1HB   LYS  33          2HB       LYS  33 -11.331   5.009  -5.718
  254   2HB   LYS  33          3HB       LYS  33 -11.556   4.988  -3.969
  255   1HG   LYS  33          2HG       LYS  33 -10.429   7.098  -3.712
  256   2HG   LYS  33          3HG       LYS  33  -9.883   7.078  -5.390
  257   1HD   LYS  33          2HD       LYS  33 -12.257   7.175  -6.135
  258   2HD   LYS  33          3HD       LYS  33 -12.759   7.287  -4.447
  259   1HE   LYS  33          2HE       LYS  33 -10.912   9.253  -5.839
  260   2HE   LYS  33          3HE       LYS  33 -12.628   9.521  -5.539
  261   1HZ   LYS  33          1HZ       LYS  33 -11.508  10.548  -3.774
  262   2HZ   LYS  33          1HZ       LYS  33 -10.448   9.238  -3.557
  263   3HZ   LYS  33          3HZ       LYS  33 -12.086   9.091  -3.127
  264    H    VAL  34           H        VAL  34  -7.028   4.544  -4.829
  265    HA   VAL  34           HA       VAL  34  -5.483   4.512  -6.519
  266    HB   VAL  34           HB       VAL  34  -7.869   4.146  -8.339
  267   1HG1  VAL  34          1HG1      VAL  34  -6.101   4.905  -9.712
  268   2HG1  VAL  34          2HG1      VAL  34  -4.887   4.041  -8.769
  269   3HG1  VAL  34          3HG1      VAL  34  -5.991   3.149  -9.816
  270   1HG2  VAL  34          1HG2      VAL  34  -7.383   1.794  -8.254
  271   2HG2  VAL  34          2HG2      VAL  34  -5.888   2.075  -7.363
  272   3HG2  VAL  34          3HG2      VAL  34  -7.445   2.351  -6.581
  273    H    ASP  35           H        ASP  35  -4.764   5.863  -8.407
  274    HA   ASP  35           HA       ASP  35  -6.227   8.327  -8.868
  275   1HB   ASP  35          2HB       ASP  35  -5.104   8.805  -6.732
  276   2HB   ASP  35          3HB       ASP  35  -3.553   8.366  -7.441
  277    H    ASP  36           H        ASP  36  -2.880   8.754  -9.132
  278    HA   ASP  36           HA       ASP  36  -2.417   7.449 -11.638
  279   1HB   ASP  36          2HB       ASP  36  -4.002   9.342 -12.258
  280   2HB   ASP  36          3HB       ASP  36  -2.718  10.451 -11.783
  281    H    SER  37           H        SER  37  -1.595  10.103  -9.459
  282    HA   SER  37           HA       SER  37   1.048  10.556 -10.265
  283   1HB   SER  37          2HB       SER  37  -0.376  11.876  -8.585
  284   2HB   SER  37          3HB       SER  37   0.125  10.680  -7.394
  285    HG   SER  37           HG       SER  37   1.487  12.589  -7.573
  286    H    GLN  38           H        GLN  38  -0.376   8.067  -8.274
  287    HA   GLN  38           HA       GLN  38   2.143   7.032  -7.305
  288   1HB   GLN  38          2HB       GLN  38   0.840   5.419  -6.161
  289   2HB   GLN  38          3HB       GLN  38  -0.145   6.879  -6.147
  290   1HG   GLN  38          2HG       GLN  38  -1.034   5.844  -8.450
  291   2HG   GLN  38          3HG       GLN  38  -0.535   4.344  -7.674
  292   1HE2  GLN  38          2HE2      GLN  38  -1.186   4.937  -4.972
  293   2HE2  GLN  38          1HE2      GLN  38  -2.866   5.129  -4.848
  294    HA   PRO  39           HA       PRO  39   3.206   4.385 -10.657
  295   1HB   PRO  39          2HB       PRO  39   3.744   2.063  -9.050
  296   2HB   PRO  39          3HB       PRO  39   4.904   3.197  -9.752
  297   1HG   PRO  39          2HG       PRO  39   4.121   2.913  -7.027
  298   2HG   PRO  39          3HG       PRO  39   5.316   4.013  -7.722
  299   1HD   PRO  39          2HD       PRO  39   2.750   4.681  -6.657
  300   2HD   PRO  39          3HD       PRO  39   3.914   5.769  -7.436
  301    H    ALA  40           H        ALA  40   2.112   3.012 -12.025
  302    HA   ALA  40           HA       ALA  40  -0.516   2.284 -11.657
  303   1HB   ALA  40          1HB       ALA  40   0.898   2.152 -13.795
  304   2HB   ALA  40          2HB       ALA  40   1.388   0.554 -13.230
  305   3HB   ALA  40          3HB       ALA  40  -0.312   0.891 -13.558
  306    H    PHE  41           H        PHE  41   2.389   0.466 -10.836
  307    HA   PHE  41           HA       PHE  41   1.272  -1.977 -10.115
  308   1HB   PHE  41          2HB       PHE  41   3.537  -0.693  -8.594
  309   2HB   PHE  41          3HB       PHE  41   3.281  -2.404  -8.943
  310    HD1  PHE  41           HD1      PHE  41   2.967  -2.877 -11.604
  311    HD2  PHE  41           HD2      PHE  41   5.153   0.388  -9.867
  312    HE1  PHE  41           HE1      PHE  41   4.272  -2.638 -13.697
  313    HE2  PHE  41           HE2      PHE  41   6.458   0.627 -11.960
  314    HZ   PHE  41           HZ       PHE  41   6.017  -0.886 -13.876
  315    H    ILE  42           H        ILE  42   1.774   0.926  -8.099
  316    HA   ILE  42           HA       ILE  42   0.815  -0.098  -5.685
  317    HB   ILE  42           HB       ILE  42   1.073   2.633  -6.859
  318   1HG1  ILE  42          2HG1      ILE  42   2.869   1.307  -5.597
  319   2HG1  ILE  42          3HG1      ILE  42   2.568   2.948  -5.031
  320   1HG2  ILE  42          1HG2      ILE  42  -0.549   1.994  -4.376
  321   2HG2  ILE  42          2HG2      ILE  42   0.076   3.596  -4.760
  322   3HG2  ILE  42          3HG2      ILE  42  -1.107   2.834  -5.821
  323   1HD1  ILE  42          1HD1      ILE  42   0.926   0.808  -3.780
  324   2HD1  ILE  42          2HD1      ILE  42   2.641   0.821  -3.370
  325   3HD1  ILE  42          3HD1      ILE  42   1.647   2.244  -3.054
  326    H    ASN  43           H        ASN  43  -0.912   0.912  -8.556
  327    HA   ASN  43           HA       ASN  43  -3.467   1.280  -7.413
  328   1HB   ASN  43          2HB       ASN  43  -2.834   0.216 -10.176
  329   2HB   ASN  43          3HB       ASN  43  -4.329   0.975  -9.656
  330   1HD2  ASN  43          2HD2      ASN  43  -2.200   2.785  -8.000
  331   2HD2  ASN  43          1HD2      ASN  43  -1.836   3.975  -9.154
  332    H    ASP  44           H        ASP  44  -1.812  -1.578  -8.728
  333    HA   ASP  44           HA       ASP  44  -3.912  -3.418  -8.488
  334   1HB   ASP  44          2HB       ASP  44  -2.363  -4.875  -9.209
  335   2HB   ASP  44          3HB       ASP  44  -1.215  -3.541  -9.194
  336    H    ILE  45           H        ILE  45  -1.622  -2.218  -6.087
  337    HA   ILE  45           HA       ILE  45  -2.233  -4.014  -3.992
  338    HB   ILE  45           HB       ILE  45  -1.374  -1.117  -3.759
  339   1HG1  ILE  45          2HG1      ILE  45   0.224  -3.668  -4.132
  340   2HG1  ILE  45          3HG1      ILE  45   0.157  -2.290  -5.230
  341   1HG2  ILE  45          1HG2      ILE  45  -0.889  -3.452  -1.891
  342   2HG2  ILE  45          2HG2      ILE  45  -0.509  -1.756  -1.599
  343   3HG2  ILE  45          3HG2      ILE  45  -2.189  -2.283  -1.673
  344   1HD1  ILE  45          1HD1      ILE  45   2.053  -1.645  -4.134
  345   2HD1  ILE  45          2HD1      ILE  45   0.918  -1.050  -2.924
  346   3HD1  ILE  45          3HD1      ILE  45   1.684  -2.625  -2.714
  347    H    LEU  46           H        LEU  46  -3.488  -0.794  -4.761
  348    HA   LEU  46           HA       LEU  46  -5.292  -0.509  -2.661
  349   1HB   LEU  46          2HB       LEU  46  -5.248   0.575  -5.470
  350   2HB   LEU  46          3HB       LEU  46  -6.543   0.985  -4.342
  351    HG   LEU  46           HG       LEU  46  -3.611   1.303  -3.650
  352   1HD1  LEU  46          1HD1      LEU  46  -3.684   3.564  -4.319
  353   2HD1  LEU  46          2HD1      LEU  46  -4.453   2.707  -5.655
  354   3HD1  LEU  46          3HD1      LEU  46  -5.440   3.560  -4.466
  355   1HD2  LEU  46          1HD2      LEU  46  -4.681   2.954  -2.003
  356   2HD2  LEU  46          2HD2      LEU  46  -6.229   2.233  -2.445
  357   3HD2  LEU  46          3HD2      LEU  46  -4.978   1.244  -1.691
  358    H    LYS  47           H        LYS  47  -5.578  -2.306  -5.658
  359    HA   LYS  47           HA       LYS  47  -8.407  -2.781  -5.350
  360   1HB   LYS  47          2HB       LYS  47  -6.312  -3.958  -7.183
  361   2HB   LYS  47          3HB       LYS  47  -8.022  -4.396  -7.244
  362   1HG   LYS  47          2HG       LYS  47  -8.682  -2.203  -7.852
  363   2HG   LYS  47          3HG       LYS  47  -7.135  -1.511  -7.361
  364   1HD   LYS  47          2HD       LYS  47  -5.998  -2.491  -9.224
  365   2HD   LYS  47          3HD       LYS  47  -7.381  -3.514  -9.613
  366   1HE   LYS  47          2HE       LYS  47  -8.708  -1.575 -10.235
  367   2HE   LYS  47          3HE       LYS  47  -7.424  -0.485  -9.713
  368   1HZ   LYS  47          1HZ       LYS  47  -6.497  -0.669 -11.697
  369   2HZ   LYS  47          1HZ       LYS  47  -7.747  -1.701 -12.207
  370   3HZ   LYS  47          3HZ       LYS  47  -6.342  -2.346 -11.503
  371    H    VAL  48           H        VAL  48  -5.753  -3.984  -3.720
  372    HA   VAL  48           HA       VAL  48  -6.590  -6.745  -3.491
  373    HB   VAL  48           HB       VAL  48  -4.627  -5.152  -1.811
  374   1HG1  VAL  48          1HG1      VAL  48  -3.776  -7.512  -1.307
  375   2HG1  VAL  48          2HG1      VAL  48  -5.302  -7.066  -0.547
  376   3HG1  VAL  48          3HG1      VAL  48  -5.298  -8.099  -1.975
  377   1HG2  VAL  48          1HG2      VAL  48  -2.911  -6.125  -3.197
  378   2HG2  VAL  48          2HG2      VAL  48  -4.083  -7.153  -4.022
  379   3HG2  VAL  48          3HG2      VAL  48  -4.102  -5.411  -4.279
  380    H    GLU  49           H        GLU  49  -8.571  -7.032  -2.600
  381    HA   GLU  49           HA       GLU  49  -9.941  -5.454  -0.821
  382   1HB   GLU  49          2HB       GLU  49  -9.929  -8.462  -1.104
  383   2HB   GLU  49          3HB       GLU  49 -11.070  -7.601  -0.070
  384   1HG   GLU  49          2HG       GLU  49 -11.985  -6.398  -1.934
  385   2HG   GLU  49          3HG       GLU  49 -10.701  -6.953  -3.006
  386    H    GLY  50           H        GLY  50  -9.224  -4.616   1.015
  387   1HA   GLY  50          1HA       GLY  50  -8.982  -5.259   3.431
  388   2HA   GLY  50          2HA       GLY  50  -7.698  -6.332   2.885
  389    H    VAL  51           H        VAL  51  -7.694  -3.578   1.000
  390    HA   VAL  51           HA       VAL  51  -5.259  -2.639   2.225
  391    HB   VAL  51           HB       VAL  51  -5.857  -0.693   0.375
  392   1HG1  VAL  51          1HG1      VAL  51  -4.320  -3.270  -0.017
  393   2HG1  VAL  51          2HG1      VAL  51  -4.094  -1.774  -0.923
  394   3HG1  VAL  51          3HG1      VAL  51  -3.717  -1.828   0.797
  395   1HG2  VAL  51          1HG2      VAL  51  -7.605  -2.807  -0.262
  396   2HG2  VAL  51          2HG2      VAL  51  -7.153  -1.454  -1.276
  397   3HG2  VAL  51          3HG2      VAL  51  -6.255  -2.961  -1.379
  398    H    LYS  52           H        LYS  52  -8.564  -1.697   2.473
  399    HA   LYS  52           HA       LYS  52  -9.632   0.040   3.502
  400   1HB   LYS  52          2HB       LYS  52  -8.696  -0.814   5.517
  401   2HB   LYS  52          3HB       LYS  52  -7.104  -0.157   5.139
  402   1HG   LYS  52          2HG       LYS  52  -7.651   1.934   5.868
  403   2HG   LYS  52          3HG       LYS  52  -9.275   1.851   5.191
  404   1HD   LYS  52          2HD       LYS  52  -8.514   0.246   7.631
  405   2HD   LYS  52          3HD       LYS  52  -9.062   1.915   7.765
  406   1HE   LYS  52          2HE       LYS  52 -10.616  -0.250   6.322
  407   2HE   LYS  52          3HE       LYS  52 -10.909   0.211   7.997
  408   1HZ   LYS  52          1HZ       LYS  52 -10.799   2.515   6.366
  409   2HZ   LYS  52          1HZ       LYS  52 -12.083   1.945   7.323
  410   3HZ   LYS  52          3HZ       LYS  52 -11.918   1.418   5.716
  411    H    SER  53           H        SER  53  -6.202   1.019   3.499
  412    HA   SER  53           HA       SER  53  -6.575   3.065   1.544
  413   1HB   SER  53          2HB       SER  53  -6.936   4.977   2.733
  414   2HB   SER  53          3HB       SER  53  -7.733   3.861   3.836
  415    HG   SER  53           HG       SER  53  -5.581   3.677   4.842
  416    H    ILE  54           H        ILE  54  -4.705   4.540   1.391
  417    HA   ILE  54           HA       ILE  54  -2.248   3.567   2.680
  418    HB   ILE  54           HB       ILE  54  -2.595   3.887  -0.321
  419   1HG1  ILE  54          2HG1      ILE  54  -1.967   1.416   1.334
  420   2HG1  ILE  54          3HG1      ILE  54  -3.554   1.784   0.658
  421   1HG2  ILE  54          1HG2      ILE  54  -0.220   2.964  -0.306
  422   2HG2  ILE  54          2HG2      ILE  54  -0.391   4.617   0.281
  423   3HG2  ILE  54          3HG2      ILE  54  -0.193   3.292   1.427
  424   1HD1  ILE  54          1HD1      ILE  54  -1.000   1.130  -0.811
  425   2HD1  ILE  54          2HD1      ILE  54  -2.575   0.350  -0.946
  426   3HD1  ILE  54          3HD1      ILE  54  -2.329   1.962  -1.616
  427    H    PHE  55           H        PHE  55  -0.597   5.156   2.769
  428    HA   PHE  55           HA       PHE  55  -1.321   7.842   1.791
  429   1HB   PHE  55          2HB       PHE  55  -2.022   7.701   4.146
  430   2HB   PHE  55          3HB       PHE  55  -0.392   7.208   4.602
  431    HD1  PHE  55           HD1      PHE  55   0.939   8.895   5.495
  432    HD2  PHE  55           HD2      PHE  55  -1.959   9.894   2.483
  433    HE1  PHE  55           HE1      PHE  55   1.618  11.276   5.628
  434    HE2  PHE  55           HE2      PHE  55  -1.278  12.274   2.616
  435    HZ   PHE  55           HZ       PHE  55   0.510  12.965   4.189
  436    H    HIS  56           H        HIS  56   0.262   8.495   0.517
  437    HA   HIS  56           HA       HIS  56   3.016   7.573   1.013
  438   1HB   HIS  56          2HB       HIS  56   2.200   7.177  -1.243
  439   2HB   HIS  56          3HB       HIS  56   1.738   8.870  -1.408
  440    HD1  HIS  56           HD1      HIS  56   3.383   9.539  -3.236
  441    HD2  HIS  56           HD2      HIS  56   5.258   7.747   0.028
  442    HE1  HIS  56           HE1      HIS  56   5.872   9.858  -3.575
  443    H    VAL  57           H        VAL  57   4.582   8.953   1.669
  444    HA   VAL  57           HA       VAL  57   4.441  11.788   1.230
  445    HB   VAL  57           HB       VAL  57   2.862  11.697   3.063
  446   1HG1  VAL  57          1HG1      VAL  57   3.330   9.601   4.091
  447   2HG1  VAL  57          2HG1      VAL  57   5.013  10.035   4.385
  448   3HG1  VAL  57          3HG1      VAL  57   3.728  10.814   5.306
  449   1HG2  VAL  57          1HG2      VAL  57   4.725  13.470   2.992
  450   2HG2  VAL  57          2HG2      VAL  57   3.906  13.246   4.537
  451   3HG2  VAL  57          3HG2      VAL  57   5.500  12.542   4.276
  452    H    MET  58           H        MET  58   6.347  12.888   1.862
  453    HA   MET  58           HA       MET  58   8.641  13.034   1.900
  454   1HB   MET  58          2HB       MET  58   7.987  12.837   4.315
  455   2HB   MET  58          3HB       MET  58   8.338  11.112   4.217
  456   1HG   MET  58          2HG       MET  58  10.619  11.448   4.012
  457   2HG   MET  58          3HG       MET  58  10.428  13.031   3.260
  458   1HE   MET  58          1HE       MET  58  12.302  14.437   5.334
  459   2HE   MET  58          2HE       MET  58  12.488  12.783   4.758
  460   3HE   MET  58          3HE       MET  58  12.540  13.118   6.487
  461    H    ASP  59           H        ASP  59   9.316  10.008   3.341
  462    HA   ASP  59           HA       ASP  59   9.932   8.792   0.725
  463   1HB   ASP  59          2HB       ASP  59  12.093   7.969   1.742
  464   2HB   ASP  59          3HB       ASP  59  12.031   9.698   1.419
  465    H    PHE  60           H        PHE  60   7.958   8.439   3.087
  466    HA   PHE  60           HA       PHE  60   8.314   5.514   3.246
  467   1HB   PHE  60          2HB       PHE  60   7.425   5.556   5.555
  468   2HB   PHE  60          3HB       PHE  60   8.961   6.407   5.419
  469    HD1  PHE  60           HD1      PHE  60   5.335   6.765   5.933
  470    HD2  PHE  60           HD2      PHE  60   9.075   8.850   5.573
  471    HE1  PHE  60           HE1      PHE  60   4.286   8.809   6.863
  472    HE2  PHE  60           HE2      PHE  60   8.024  10.894   6.502
  473    HZ   PHE  60           HZ       PHE  60   5.630  10.873   7.149
  474    H    ILE  61           H        ILE  61   6.250   4.386   3.777
  475    HA   ILE  61           HA       ILE  61   3.886   5.881   2.828
  476    HB   ILE  61           HB       ILE  61   4.479   3.049   1.963
  477   1HG1  ILE  61          2HG1      ILE  61   5.112   5.647   0.514
  478   2HG1  ILE  61          3HG1      ILE  61   6.291   4.479   1.110
  479   1HG2  ILE  61          1HG2      ILE  61   2.701   3.384   0.438
  480   2HG2  ILE  61          2HG2      ILE  61   2.128   4.137   1.925
  481   3HG2  ILE  61          3HG2      ILE  61   2.761   5.137   0.618
  482   1HD1  ILE  61          1HD1      ILE  61   4.916   2.782  -0.371
  483   2HD1  ILE  61          2HD1      ILE  61   4.405   4.246  -1.212
  484   3HD1  ILE  61          3HD1      ILE  61   6.116   3.833  -1.121
  485    H    SER  62           H        SER  62   2.133   5.596   4.028
  486    HA   SER  62           HA       SER  62   2.164   3.524   6.122
  487   1HB   SER  62          2HB       SER  62   1.424   6.255   6.109
  488   2HB   SER  62          3HB       SER  62  -0.070   5.341   6.296
  489    HG   SER  62           HG       SER  62   2.146   4.507   7.767
  490    H    VAL  63           H        VAL  63   1.228   1.675   5.462
  491    HA   VAL  63           HA       VAL  63  -1.098   1.819   3.660
  492    HB   VAL  63           HB       VAL  63   0.606  -0.568   4.431
  493   1HG1  VAL  63          1HG1      VAL  63  -1.821  -0.194   2.687
  494   2HG1  VAL  63          2HG1      VAL  63  -0.634  -1.431   2.276
  495   3HG1  VAL  63          3HG1      VAL  63  -1.465  -1.487   3.830
  496   1HG2  VAL  63          1HG2      VAL  63   1.757   1.161   3.025
  497   2HG2  VAL  63          2HG2      VAL  63   1.531  -0.372   2.181
  498   3HG2  VAL  63          3HG2      VAL  63   0.472   0.994   1.829
  499    H    ASP  64           H        ASP  64  -3.031   1.681   4.515
  500    HA   ASP  64           HA       ASP  64  -3.372   0.562   7.216
  501   1HB   ASP  64          2HB       ASP  64  -5.481   1.951   5.581
  502   2HB   ASP  64          3HB       ASP  64  -5.416   1.759   7.324
  503    H    LYS  65           H        LYS  65  -5.075  -0.976   7.613
  504    HA   LYS  65           HA       LYS  65  -6.051  -2.357   5.196
  505   1HB   LYS  65          2HB       LYS  65  -5.643  -4.536   6.266
  506   2HB   LYS  65          3HB       LYS  65  -4.140  -3.643   6.040
  507   1HG   LYS  65          2HG       LYS  65  -3.806  -3.375   8.284
  508   2HG   LYS  65          3HG       LYS  65  -5.525  -3.177   8.623
  509   1HD   LYS  65          2HD       LYS  65  -5.871  -5.597   8.332
  510   2HD   LYS  65          3HD       LYS  65  -4.158  -5.806   7.973
  511   1HE   LYS  65          2HE       LYS  65  -3.728  -4.702  10.264
  512   2HE   LYS  65          3HE       LYS  65  -5.437  -4.996  10.586
  513   1HZ   LYS  65          1HZ       LYS  65  -3.538  -7.104   9.723
  514   2HZ   LYS  65          1HZ       LYS  65  -5.132  -7.315  10.270
  515   3HZ   LYS  65          3HZ       LYS  65  -3.924  -6.794  11.344
  516    H    GLU  66           H        GLU  66  -7.878  -3.849   5.695
  517    HA   GLU  66           HA       GLU  66  -9.998  -2.510   6.876
  518   1HB   GLU  66          2HB       GLU  66  -9.529  -5.399   6.205
  519   2HB   GLU  66          3HB       GLU  66 -11.005  -4.914   7.038
  520   1HG   GLU  66          2HG       GLU  66 -10.011  -3.765   4.413
  521   2HG   GLU  66          3HG       GLU  66 -11.318  -4.933   4.584
  522    H    ASN  67           H        ASN  67 -11.351  -3.344   8.722
  523    HA   ASN  67           HA       ASN  67 -10.387  -2.832  11.167
  524   1HB   ASN  67          2HB       ASN  67 -12.039  -4.711  11.983
  525   2HB   ASN  67          3HB       ASN  67 -12.658  -3.274  11.171
  526   1HD2  ASN  67          2HD2      ASN  67 -14.208  -3.832   9.646
  527   2HD2  ASN  67          1HD2      ASN  67 -14.169  -5.226   8.678
  528    H    ASP  68           H        ASP  68 -10.133  -5.993   9.575
  529    HA   ASP  68           HA       ASP  68  -7.965  -6.683  11.455
  530   1HB   ASP  68          2HB       ASP  68  -9.958  -8.725  10.473
  531   2HB   ASP  68          3HB       ASP  68  -8.783  -8.882  11.776
  532    H    ALA  69           H        ALA  69  -9.619  -7.740   8.468
  533    HA   ALA  69           HA       ALA  69  -8.795  -8.630   6.509
  534   1HB   ALA  69          1HB       ALA  69  -7.786  -6.112   6.852
  535   2HB   ALA  69          2HB       ALA  69  -6.314  -7.046   6.604
  536   3HB   ALA  69          3HB       ALA  69  -7.592  -7.073   5.387
  537    H    ASN  70           H        ASN  70  -6.103  -8.913   5.637
  538    HA   ASN  70           HA       ASN  70  -4.820 -10.648   7.617
  539   1HB   ASN  70          2HB       ASN  70  -6.346 -12.130   6.372
  540   2HB   ASN  70          3HB       ASN  70  -5.605 -11.618   4.857
  541   1HD2  ASN  70          2HD2      ASN  70  -4.977 -13.952   4.567
  542   2HD2  ASN  70          1HD2      ASN  70  -3.614 -14.547   5.385
  543    H    TRP  71           H        TRP  71  -2.806  -9.926   7.710
  544    HA   TRP  71           HA       TRP  71  -1.557  -8.460   5.589
  545   1HB   TRP  71          2HB       TRP  71  -0.646  -9.522   8.253
  546   2HB   TRP  71          3HB       TRP  71   0.521  -8.859   7.112
  547    HD1  TRP  71           HD1      TRP  71  -1.606  -7.816   9.855
  548    HE1  TRP  71           HE1      TRP  71  -1.990  -5.268   9.841
  549    HE3  TRP  71           HE3      TRP  71   0.031  -6.699   5.149
  550    HZ2  TRP  71           HZ2      TRP  71  -1.650  -3.046   8.069
  551    HZ3  TRP  71           HZ3      TRP  71  -0.009  -4.363   4.325
  552    HH2  TRP  71           HH2      TRP  71  -0.846  -2.537   5.778
  553    H    GLU  72           H        GLU  72  -1.361 -11.765   6.810
  554    HA   GLU  72           HA       GLU  72   0.860 -12.690   5.395
  555   1HB   GLU  72          2HB       GLU  72  -0.435 -13.915   7.187
  556   2HB   GLU  72          3HB       GLU  72  -1.643 -14.293   5.960
  557   1HG   GLU  72          2HG       GLU  72   0.073 -15.422   4.601
  558   2HG   GLU  72          3HG       GLU  72   1.297 -15.029   5.806
  559    H    THR  73           H        THR  73  -2.357 -11.957   4.299
  560    HA   THR  73           HA       THR  73  -2.011 -13.350   1.755
  561    HB   THR  73           HB       THR  73  -4.253 -11.882   3.107
  562    HG1  THR  73           HG1      THR  73  -4.109 -14.366   1.754
  563   1HG2  THR  73          1HG2      THR  73  -4.424 -10.941   0.926
  564   2HG2  THR  73          2HG2      THR  73  -3.975 -12.462   0.154
  565   3HG2  THR  73          3HG2      THR  73  -5.548 -12.299   0.935
  566    H    VAL  74           H        VAL  74  -2.378 -10.045   2.972
  567    HA   VAL  74           HA       VAL  74  -2.171  -8.759   0.459
  568    HB   VAL  74           HB       VAL  74  -2.446  -8.020   3.245
  569   1HG1  VAL  74          1HG1      VAL  74  -0.629  -6.287   1.548
  570   2HG1  VAL  74          2HG1      VAL  74  -1.353  -5.802   3.080
  571   3HG1  VAL  74          3HG1      VAL  74  -0.180  -7.118   3.038
  572   1HG2  VAL  74          1HG2      VAL  74  -3.730  -6.216   2.282
  573   2HG2  VAL  74          2HG2      VAL  74  -2.951  -6.432   0.715
  574   3HG2  VAL  74          3HG2      VAL  74  -4.048  -7.666   1.332
  575    H    LEU  75           H        LEU  75   0.262  -9.592   2.910
  576    HA   LEU  75           HA       LEU  75   2.432  -8.146   2.024
  577   1HB   LEU  75          2HB       LEU  75   2.037 -10.598   3.563
  578   2HB   LEU  75          3HB       LEU  75   3.552 -10.600   2.667
  579    HG   LEU  75           HG       LEU  75   3.674  -9.585   4.995
  580   1HD1  LEU  75          1HD1      LEU  75   4.506  -8.212   2.463
  581   2HD1  LEU  75          2HD1      LEU  75   4.791  -7.394   3.999
  582   3HD1  LEU  75          3HD1      LEU  75   5.500  -8.981   3.701
  583   1HD2  LEU  75          1HD2      LEU  75   2.553  -7.635   5.529
  584   2HD2  LEU  75          2HD2      LEU  75   2.467  -7.095   3.853
  585   3HD2  LEU  75          3HD2      LEU  75   1.373  -8.350   4.434
  586    HA   PRO  76           HA       PRO  76   3.733 -11.782  -0.994
  587   1HB   PRO  76          2HB       PRO  76   1.284 -13.042  -1.819
  588   2HB   PRO  76          3HB       PRO  76   2.681 -13.776  -1.022
  589   1HG   PRO  76          2HG       PRO  76   0.120 -13.030   0.090
  590   2HG   PRO  76          3HG       PRO  76   1.408 -14.011   0.798
  591   1HD   PRO  76          2HD       PRO  76   0.704 -11.449   1.632
  592   2HD   PRO  76          3HD       PRO  76   2.247 -12.253   1.984
  593    H    LYS  77           H        LYS  77   0.636 -10.104  -1.221
  594    HA   LYS  77           HA       LYS  77   0.744  -9.796  -4.091
  595   1HB   LYS  77          2HB       LYS  77  -0.991  -8.522  -1.964
  596   2HB   LYS  77          3HB       LYS  77  -1.176  -8.221  -3.692
  597   1HG   LYS  77          2HG       LYS  77  -1.781 -10.469  -4.135
  598   2HG   LYS  77          3HG       LYS  77  -1.176 -11.026  -2.574
  599   1HD   LYS  77          2HD       LYS  77  -2.956  -9.798  -1.416
  600   2HD   LYS  77          3HD       LYS  77  -3.542  -9.168  -2.956
  601   1HE   LYS  77          2HE       LYS  77  -4.003 -11.477  -3.721
  602   2HE   LYS  77          3HE       LYS  77  -3.444 -12.095  -2.166
  603   1HZ   LYS  77          1HZ       LYS  77  -5.991 -11.412  -2.736
  604   2HZ   LYS  77          1HZ       LYS  77  -5.423 -10.015  -1.953
  605   3HZ   LYS  77          3HZ       LYS  77  -5.342 -11.521  -1.172
  606    H    VAL  78           H        VAL  78   1.249  -7.673  -1.283
  607    HA   VAL  78           HA       VAL  78   1.860  -5.308  -2.660
  608    HB   VAL  78           HB       VAL  78   2.764  -6.363   0.027
  609   1HG1  VAL  78          1HG1      VAL  78   4.458  -4.793  -0.573
  610   2HG1  VAL  78          2HG1      VAL  78   3.288  -3.701  -1.312
  611   3HG1  VAL  78          3HG1      VAL  78   3.325  -3.897   0.440
  612   1HG2  VAL  78          1HG2      VAL  78   0.316  -5.779  -0.458
  613   2HG2  VAL  78          2HG2      VAL  78   1.057  -4.943   0.906
  614   3HG2  VAL  78          3HG2      VAL  78   0.856  -4.110  -0.634
  615    H    GLU  79           H        GLU  79   3.896  -8.037  -1.729
  616    HA   GLU  79           HA       GLU  79   6.419  -7.009  -2.320
  617   1HB   GLU  79          2HB       GLU  79   5.225  -9.751  -2.287
  618   2HB   GLU  79          3HB       GLU  79   6.846  -9.539  -2.949
  619   1HG   GLU  79          2HG       GLU  79   7.741  -8.873  -0.916
  620   2HG   GLU  79          3HG       GLU  79   6.201  -8.256  -0.320
  621    H    ALA  80           H        ALA  80   4.082  -8.602  -4.473
  622    HA   ALA  80           HA       ALA  80   5.610  -8.839  -6.770
  623   1HB   ALA  80          1HB       ALA  80   2.688  -8.062  -6.676
  624   2HB   ALA  80          2HB       ALA  80   3.526  -8.862  -8.005
  625   3HB   ALA  80          3HB       ALA  80   3.290  -9.707  -6.475
  626    H    VAL  81           H        VAL  81   4.038  -5.985  -5.454
  627    HA   VAL  81           HA       VAL  81   4.203  -4.306  -7.702
  628    HB   VAL  81           HB       VAL  81   4.479  -3.434  -4.819
  629   1HG1  VAL  81          1HG1      VAL  81   4.631  -1.907  -7.040
  630   2HG1  VAL  81          2HG1      VAL  81   2.877  -1.966  -6.857
  631   3HG1  VAL  81          3HG1      VAL  81   3.880  -1.338  -5.550
  632   1HG2  VAL  81          1HG2      VAL  81   2.395  -4.192  -4.426
  633   2HG2  VAL  81          2HG2      VAL  81   1.792  -3.306  -5.825
  634   3HG2  VAL  81          3HG2      VAL  81   2.386  -4.953  -6.016
  635    H    PHE  82           H        PHE  82   6.387  -4.328  -4.865
  636    HA   PHE  82           HA       PHE  82   8.417  -2.891  -6.371
  637   1HB   PHE  82          2HB       PHE  82   8.924  -4.052  -3.657
  638   2HB   PHE  82          3HB       PHE  82   9.480  -2.528  -4.347
  639    HD1  PHE  82           HD1      PHE  82   7.339  -3.853  -1.973
  640    HD2  PHE  82           HD2      PHE  82   7.364  -0.970  -5.156
  641    HE1  PHE  82           HE1      PHE  82   5.420  -2.683  -0.929
  642    HE2  PHE  82           HE2      PHE  82   5.444   0.200  -4.110
  643    HZ   PHE  82           HZ       PHE  82   4.472  -0.660  -1.999
  644    H    GLU  83           H        GLU  83   7.509  -5.909  -6.663
  645    HA   GLU  83           HA       GLU  83  10.135  -6.829  -7.453
  646   1HB   GLU  83          2HB       GLU  83   9.017  -7.626  -4.899
  647   2HB   GLU  83          3HB       GLU  83   9.217  -9.023  -5.954
  648   1HG   GLU  83          2HG       GLU  83  11.552  -8.423  -6.358
  649   2HG   GLU  83          3HG       GLU  83  11.370  -6.970  -5.377
  650    H    LEU  84           H        LEU  84   8.859  -6.605  -9.432
  651    HA   LEU  84           HA       LEU  84   6.641  -8.361  -9.918
  652   1HB   LEU  84          2HB       LEU  84   8.240  -7.232 -12.181
  653   2HB   LEU  84          3HB       LEU  84   6.494  -7.365 -11.992
  654    HG   LEU  84           HG       LEU  84   7.028  -5.661  -9.959
  655   1HD1  LEU  84          1HD1      LEU  84   8.858  -4.549 -12.040
  656   2HD1  LEU  84          2HD1      LEU  84   8.860  -4.303 -10.295
  657   3HD1  LEU  84          3HD1      LEU  84   9.507  -5.796 -10.975
  658   1HD2  LEU  84          1HD2      LEU  84   6.567  -5.068 -12.893
  659   2HD2  LEU  84          2HD2      LEU  84   5.364  -5.169 -11.607
  660   3HD2  LEU  84          3HD2      LEU  84   6.498  -3.819 -11.649
  661    H    GLU  85           H        GLU  85   9.625  -8.274 -11.837
  662    HA   GLU  85           HA       GLU  85   9.491 -11.112 -12.317
  663   1HB   GLU  85          2HB       GLU  85  11.642 -10.727 -13.539
  664   2HB   GLU  85          3HB       GLU  85  10.325  -9.689 -14.087
  665   1HG   GLU  85          2HG       GLU  85  11.182  -7.866 -12.631
  666   2HG   GLU  85          3HG       GLU  85  12.524  -8.901 -12.147
  667    H    HIS  86           H        HIS  86  10.935 -12.698 -11.589
  668    HA   HIS  86           HA       HIS  86  11.842 -12.437  -8.919
  669   1HB   HIS  86          2HB       HIS  86  12.715 -14.499 -10.957
  670   2HB   HIS  86          3HB       HIS  86  12.779 -14.651  -9.201
  671    HD1  HIS  86           HD1      HIS  86  10.413 -14.718  -7.947
  672    HD2  HIS  86           HD2      HIS  86  10.242 -15.149 -12.090
  673    HE1  HIS  86           HE1      HIS  86   8.106 -15.618  -8.478
  674    H    HIS  87           H        HIS  87  13.687 -11.636  -8.113
  675    HA   HIS  87           HA       HIS  87  15.699 -10.591  -9.933
  676   1HB   HIS  87          2HB       HIS  87  15.578 -10.523  -6.906
  677   2HB   HIS  87          3HB       HIS  87  16.689  -9.602  -7.922
  678    HD1  HIS  87           HD1      HIS  87  14.099  -9.253 -10.041
  679    HD2  HIS  87           HD2      HIS  87  14.502  -7.911  -6.114
  680    HE1  HIS  87           HE1      HIS  87  12.467  -7.336  -9.768
  681    H    HIS  88           H        HIS  88  16.586 -12.513 -10.793
  682    HA   HIS  88           HA       HIS  88  18.777 -13.568  -9.259
  683   1HB   HIS  88          2HB       HIS  88  16.921 -14.964  -8.397
  684   2HB   HIS  88          3HB       HIS  88  16.556 -15.473 -10.044
  685    HD1  HIS  88           HD1      HIS  88  20.104 -15.176  -9.935
  686    HD2  HIS  88           HD2      HIS  88  17.411 -18.039  -8.541
  687    HE1  HIS  88           HE1      HIS  88  21.431 -17.307  -9.605
  688    H    HIS  89           H        HIS  89  19.980 -12.759 -10.995
  689    HA   HIS  89           HA       HIS  89  19.539 -13.980 -13.637
  690   1HB   HIS  89          2HB       HIS  89  21.461 -11.773 -12.843
  691   2HB   HIS  89          3HB       HIS  89  21.084 -12.295 -14.484
  692    HD1  HIS  89           HD1      HIS  89  17.905 -12.590 -13.367
  693    HD2  HIS  89           HD2      HIS  89  20.308  -9.199 -13.695
  694    HE1  HIS  89           HE1      HIS  89  16.335 -10.606 -13.473
  695    H    HIS  90           H        HIS  90  22.642 -13.167 -13.749
  696    HA   HIS  90           HA       HIS  90  23.575 -15.884 -13.481
  697   1HB   HIS  90          2HB       HIS  90  25.008 -13.294 -14.115
  698   2HB   HIS  90          3HB       HIS  90  25.779 -14.880 -14.127
  699    HD1  HIS  90           HD1      HIS  90  24.216 -12.599 -16.365
  700    HD2  HIS  90           HD2      HIS  90  24.093 -16.743 -15.928
  701    HE1  HIS  90           HE1      HIS  90  23.373 -13.528 -18.566
  702    H    HIS  91           H        HIS  91  25.663 -16.312 -12.269
  703    HA   HIS  91           HA       HIS  91  26.850 -16.442 -10.313
  704   1HB   HIS  91          2HB       HIS  91  27.247 -14.008 -10.731
  705   2HB   HIS  91          3HB       HIS  91  25.826 -13.643  -9.759
  706    HD1  HIS  91           HD1      HIS  91  29.058 -15.645  -9.364
  707    HD2  HIS  91           HD2      HIS  91  26.461 -13.306  -7.093
  708    HE1  HIS  91           HE1      HIS  91  30.086 -15.469  -7.055
  Start of MODEL    4
    1   1H    MET   1          1HT       MET   1  15.780   2.144  -4.573
    2   2H    MET   1          2HT       MET   1  15.448   2.100  -6.239
    3   3H    MET   1          3HT       MET   1  15.232   0.708  -5.291
    4    HA   MET   1           HA       MET   1  13.718   2.783  -4.167
    5   1HB   MET   1          2HB       MET   1  13.975   3.548  -6.651
    6   2HB   MET   1          3HB       MET   1  12.891   2.204  -7.007
    7   1HG   MET   1          2HG       MET   1  11.203   3.116  -5.496
    8   2HG   MET   1          3HG       MET   1  12.297   4.415  -5.018
    9   1HE   MET   1          1HE       MET   1   9.421   3.499  -7.471
   10   2HE   MET   1          2HE       MET   1   9.119   5.232  -7.536
   11   3HE   MET   1          3HE       MET   1   9.427   4.456  -5.983
   12    H    LYS   2           H        LYS   2  13.238   1.025  -2.809
   13    HA   LYS   2           HA       LYS   2  11.061  -0.625  -3.636
   14   1HB   LYS   2          2HB       LYS   2  12.245  -2.818  -3.308
   15   2HB   LYS   2          3HB       LYS   2  12.739  -1.939  -4.751
   16   1HG   LYS   2          2HG       LYS   2  14.718  -1.074  -3.569
   17   2HG   LYS   2          3HG       LYS   2  14.221  -1.916  -2.100
   18   1HD   LYS   2          2HD       LYS   2  14.314  -4.076  -3.401
   19   2HD   LYS   2          3HD       LYS   2  15.019  -3.171  -4.742
   20   1HE   LYS   2          2HE       LYS   2  17.002  -2.747  -3.595
   21   2HE   LYS   2          3HE       LYS   2  16.246  -2.935  -2.010
   22   1HZ   LYS   2          1HZ       LYS   2  17.710  -4.808  -2.693
   23   2HZ   LYS   2          1HZ       LYS   2  16.607  -5.166  -3.935
   24   3HZ   LYS   2          3HZ       LYS   2  16.124  -5.273  -2.309
   25    H    ILE   3           H        ILE   3  11.298  -2.703  -1.816
   26    HA   ILE   3           HA       ILE   3  10.794  -1.295   0.675
   27    HB   ILE   3           HB       ILE   3  10.546  -4.203  -0.126
   28   1HG1  ILE   3          2HG1      ILE   3   8.410  -2.147   0.514
   29   2HG1  ILE   3          3HG1      ILE   3   8.967  -2.480  -1.126
   30   1HG2  ILE   3          1HG2      ILE   3  10.943  -4.230   2.229
   31   2HG2  ILE   3          2HG2      ILE   3   9.971  -2.781   2.483
   32   3HG2  ILE   3          3HG2      ILE   3   9.189  -4.304   2.054
   33   1HD1  ILE   3          1HD1      ILE   3   8.232  -4.774  -0.987
   34   2HD1  ILE   3          2HD1      ILE   3   7.885  -4.610   0.735
   35   3HD1  ILE   3          3HD1      ILE   3   6.895  -3.757  -0.449
   36    H    ILE   4           H        ILE   4  12.269  -0.993   2.204
   37    HA   ILE   4           HA       ILE   4  14.689  -2.704   2.247
   38    HB   ILE   4           HB       ILE   4  14.209   0.131   3.200
   39   1HG1  ILE   4          2HG1      ILE   4  16.045   0.616   1.603
   40   2HG1  ILE   4          3HG1      ILE   4  16.046  -1.073   1.111
   41   1HG2  ILE   4          1HG2      ILE   4  16.822  -0.138   3.589
   42   2HG2  ILE   4          2HG2      ILE   4  15.675  -0.602   4.844
   43   3HG2  ILE   4          3HG2      ILE   4  16.389  -1.836   3.806
   44   1HD1  ILE   4          1HD1      ILE   4  13.432   0.349   1.039
   45   2HD1  ILE   4          2HD1      ILE   4  14.620   0.805  -0.180
   46   3HD1  ILE   4          3HD1      ILE   4  14.084  -0.869  -0.058
   47    H    SER   5           H        SER   5  12.039  -1.382   4.077
   48    HA   SER   5           HA       SER   5  12.181  -3.438   6.064
   49   1HB   SER   5          2HB       SER   5  13.993  -2.027   6.926
   50   2HB   SER   5          3HB       SER   5  12.931  -0.622   6.905
   51    HG   SER   5           HG       SER   5  11.540  -1.908   8.327
   52    H    ILE   6           H        ILE   6  10.401  -3.295   7.597
   53    HA   ILE   6           HA       ILE   6   8.372  -1.259   7.060
   54    HB   ILE   6           HB       ILE   6   7.880  -4.217   6.655
   55   1HG1  ILE   6          2HG1      ILE   6   8.035  -1.811   4.822
   56   2HG1  ILE   6          3HG1      ILE   6   8.892  -3.344   4.684
   57   1HG2  ILE   6          1HG2      ILE   6   5.562  -3.538   6.177
   58   2HG2  ILE   6          2HG2      ILE   6   6.009  -3.069   7.815
   59   3HG2  ILE   6          3HG2      ILE   6   5.968  -1.860   6.532
   60   1HD1  ILE   6          1HD1      ILE   6   6.505  -4.376   4.487
   61   2HD1  ILE   6          2HD1      ILE   6   6.012  -2.731   4.087
   62   3HD1  ILE   6          3HD1      ILE   6   7.201  -3.565   3.085
   63    H    SER   7           H        SER   7   7.951  -0.523   8.997
   64    HA   SER   7           HA       SER   7   7.658  -0.434  11.287
   65   1HB   SER   7          2HB       SER   7   5.711  -1.571  11.983
   66   2HB   SER   7          3HB       SER   7   5.490  -1.334  10.255
   67    HG   SER   7           HG       SER   7   5.185  -3.543  11.335
   68    H    GLU   8           H        GLU   8   6.916  -2.874  12.803
   69    HA   GLU   8           HA       GLU   8   9.324  -4.481  12.854
   70   1HB   GLU   8          2HB       GLU   8   9.063  -2.234  14.579
   71   2HB   GLU   8          3HB       GLU   8   8.872  -3.685  15.558
   72   1HG   GLU   8          2HG       GLU   8  11.150  -3.275  13.602
   73   2HG   GLU   8          3HG       GLU   8  11.267  -2.920  15.324
   74    H    THR   9           H        THR   9   6.183  -3.921  13.243
   75    HA   THR   9           HA       THR   9   5.659  -6.552  14.464
   76    HB   THR   9           HB       THR   9   5.151  -4.674  16.043
   77    HG1  THR   9           HG1      THR   9   2.955  -5.403  16.370
   78   1HG2  THR   9          1HG2      THR   9   2.744  -3.941  14.476
   79   2HG2  THR   9          2HG2      THR   9   3.774  -2.935  15.495
   80   3HG2  THR   9          3HG2      THR   9   4.275  -3.330  13.851
   81    HA   PRO  10           HA       PRO  10   3.678  -6.436  10.352
   82   1HB   PRO  10          2HB       PRO  10   3.880  -9.300  10.305
   83   2HB   PRO  10          3HB       PRO  10   4.762  -8.115   9.334
   84   1HG   PRO  10          2HG       PRO  10   5.834  -9.731  11.321
   85   2HG   PRO  10          3HG       PRO  10   6.590  -8.311  10.595
   86   1HD   PRO  10          2HD       PRO  10   5.328  -8.593  13.252
   87   2HD   PRO  10          3HD       PRO  10   6.542  -7.424  12.692
   88    H    ASN  11           H        ASN  11   2.453  -6.644  13.084
   89    HA   ASN  11           HA       ASN  11  -0.071  -7.879  12.237
   90   1HB   ASN  11          2HB       ASN  11   1.196  -9.536  13.619
   91   2HB   ASN  11          3HB       ASN  11   1.190  -8.375  14.944
   92   1HD2  ASN  11          2HD2      ASN  11  -0.330  -9.157  16.425
   93   2HD2  ASN  11          1HD2      ASN  11  -1.903  -9.655  16.020
   94    H    HIS  12           H        HIS  12  -0.876  -5.770  11.987
   95    HA   HIS  12           HA       HIS  12  -1.797  -4.511  14.441
   96   1HB   HIS  12          2HB       HIS  12   0.488  -3.537  13.954
   97   2HB   HIS  12          3HB       HIS  12  -0.183  -2.882  12.462
   98    HD1  HIS  12           HD1      HIS  12  -0.477  -2.586  16.223
   99    HD2  HIS  12           HD2      HIS  12  -1.793  -0.589  12.808
  100    HE1  HIS  12           HE1      HIS  12  -1.506  -0.409  17.012
  101    H    ASN  13           H        ASN  13  -1.730  -2.282  11.954
  102    HA   ASN  13           HA       ASN  13  -4.118  -3.230  10.564
  103   1HB   ASN  13          2HB       ASN  13  -4.193  -0.502  11.840
  104   2HB   ASN  13          3HB       ASN  13  -5.518  -1.420  11.135
  105   1HD2  ASN  13          2HD2      ASN  13  -6.085  -3.523  12.354
  106   2HD2  ASN  13          1HD2      ASN  13  -5.927  -3.507  14.044
  107    H    THR  14           H        THR  14  -1.609  -0.810  11.030
  108    HA   THR  14           HA       THR  14  -1.574  -0.364   8.125
  109    HB   THR  14           HB       THR  14  -2.763   1.500   9.504
  110    HG1  THR  14           HG1      THR  14  -1.109   1.515   7.386
  111   1HG2  THR  14          1HG2      THR  14  -1.325   3.146  10.513
  112   2HG2  THR  14          2HG2      THR  14  -0.908   1.585  11.224
  113   3HG2  THR  14          3HG2      THR  14   0.121   2.290   9.978
  114    H    MET  15           H        MET  15   0.401  -0.641   7.311
  115    HA   MET  15           HA       MET  15   2.685  -0.667   9.188
  116   1HB   MET  15          2HB       MET  15   3.794  -2.116   7.532
  117   2HB   MET  15          3HB       MET  15   2.265  -2.802   8.075
  118   1HG   MET  15          2HG       MET  15   1.152  -2.184   6.059
  119   2HG   MET  15          3HG       MET  15   2.462  -1.112   5.573
  120   1HE   MET  15          1HE       MET  15   2.599  -5.685   5.834
  121   2HE   MET  15          2HE       MET  15   1.534  -4.566   6.681
  122   3HE   MET  15          3HE       MET  15   3.212  -4.727   7.188
  123    H    LYS  16           H        LYS  16   4.698   0.179   8.510
  124    HA   LYS  16           HA       LYS  16   4.433   2.469   6.672
  125   1HB   LYS  16          2HB       LYS  16   5.150   3.167   8.823
  126   2HB   LYS  16          3HB       LYS  16   6.311   1.845   8.952
  127   1HG   LYS  16          2HG       LYS  16   7.721   2.816   7.254
  128   2HG   LYS  16          3HG       LYS  16   6.497   4.021   6.852
  129   1HD   LYS  16          2HD       LYS  16   6.784   5.161   8.919
  130   2HD   LYS  16          3HD       LYS  16   7.671   3.810   9.627
  131   1HE   LYS  16          2HE       LYS  16   9.401   4.221   7.736
  132   2HE   LYS  16          3HE       LYS  16   8.611   5.787   7.551
  133   1HZ   LYS  16          1HZ       LYS  16  10.154   6.316   9.109
  134   2HZ   LYS  16          1HZ       LYS  16  10.198   4.755   9.779
  135   3HZ   LYS  16          3HZ       LYS  16   8.912   5.806  10.144
  136    H    ILE  17           H        ILE  17   5.449   2.453   4.753
  137    HA   ILE  17           HA       ILE  17   7.299   0.241   4.165
  138    HB   ILE  17           HB       ILE  17   5.728   2.110   2.382
  139   1HG1  ILE  17          2HG1      ILE  17   5.637  -0.904   2.479
  140   2HG1  ILE  17          3HG1      ILE  17   4.706   0.053   3.627
  141   1HG2  ILE  17          1HG2      ILE  17   6.653   0.622   0.541
  142   2HG2  ILE  17          2HG2      ILE  17   7.823   1.724   1.263
  143   3HG2  ILE  17          3HG2      ILE  17   7.819   0.020   1.719
  144   1HD1  ILE  17          1HD1      ILE  17   4.541   0.281   0.607
  145   2HD1  ILE  17          2HD1      ILE  17   3.349  -0.498   1.645
  146   3HD1  ILE  17          3HD1      ILE  17   3.615   1.241   1.763
  147    H    THR  18           H        THR  18   9.379   0.654   4.394
  148    HA   THR  18           HA       THR  18  10.413   3.373   4.192
  149    HB   THR  18           HB       THR  18  11.757   0.751   4.895
  150    HG1  THR  18           HG1      THR  18  11.767   1.845   6.985
  151   1HG2  THR  18          1HG2      THR  18  13.464   2.167   4.029
  152   2HG2  THR  18          2HG2      THR  18  12.769   3.599   4.791
  153   3HG2  THR  18          3HG2      THR  18  13.546   2.363   5.779
  154    H    LEU  19           H        LEU  19  11.382   4.179   2.430
  155    HA   LEU  19           HA       LEU  19  11.962   2.361   0.182
  156   1HB   LEU  19          2HB       LEU  19  11.639   5.375   0.237
  157   2HB   LEU  19          3HB       LEU  19  11.979   4.417  -1.200
  158    HG   LEU  19           HG       LEU  19   9.504   4.217   0.547
  159   1HD1  LEU  19          1HD1      LEU  19   9.269   6.119  -0.858
  160   2HD1  LEU  19          2HD1      LEU  19  10.073   5.319  -2.209
  161   3HD1  LEU  19          3HD1      LEU  19   8.448   4.827  -1.734
  162   1HD2  LEU  19          1HD2      LEU  19   9.759   2.020  -0.186
  163   2HD2  LEU  19          2HD2      LEU  19   8.861   2.706  -1.539
  164   3HD2  LEU  19          3HD2      LEU  19  10.610   2.497  -1.655
  165    H    SER  20           H        SER  20  13.879   2.830  -1.118
  166    HA   SER  20           HA       SER  20  16.233   2.966   0.470
  167   1HB   SER  20          2HB       SER  20  17.258   2.173  -1.388
  168   2HB   SER  20          3HB       SER  20  15.621   1.954  -1.999
  169    HG   SER  20           HG       SER  20  17.550   3.592  -2.873
  170    H    GLU  21           H        GLU  21  14.185   5.380  -0.457
  171    HA   GLU  21           HA       GLU  21  16.256   7.356  -1.026
  172   1HB   GLU  21          2HB       GLU  21  14.112   7.309  -2.333
  173   2HB   GLU  21          3HB       GLU  21  13.268   7.791  -0.858
  174   1HG   GLU  21          2HG       GLU  21  14.679   9.815  -0.708
  175   2HG   GLU  21          3HG       GLU  21  15.531   9.333  -2.172
  176    H    SER  22           H        SER  22  17.244   8.294   0.620
  177    HA   SER  22           HA       SER  22  15.692   9.439   2.799
  178   1HB   SER  22          2HB       SER  22  17.777   7.296   3.221
  179   2HB   SER  22          3HB       SER  22  17.319   8.428   4.490
  180    HG   SER  22           HG       SER  22  15.068   7.602   3.548
  181    H    ARG  23           H        ARG  23  16.450  11.291   1.516
  182    HA   ARG  23           HA       ARG  23  18.788  12.463   2.676
  183   1HB   ARG  23          2HB       ARG  23  19.615  10.872   0.773
  184   2HB   ARG  23          3HB       ARG  23  19.012  12.135  -0.304
  185   1HG   ARG  23          2HG       ARG  23  20.451  13.788   0.717
  186   2HG   ARG  23          3HG       ARG  23  20.930  12.660   1.984
  187   1HD   ARG  23          2HD       ARG  23  22.709  12.713   0.365
  188   2HD   ARG  23          3HD       ARG  23  21.880  11.170   0.185
  189    HE   ARG  23           HE       ARG  23  20.894  11.991  -1.842
  190   1HH1  ARG  23          1HH1      ARG  23  21.621  14.880  -0.502
  191   2HH1  ARG  23          2HH1      ARG  23  22.528  15.529  -1.828
  192   1HH2  ARG  23          1HH2      ARG  23  22.745  12.493  -3.496
  193   2HH2  ARG  23          2HH2      ARG  23  23.167  14.174  -3.530
  194    H    GLU  24           H        GLU  24  15.867  12.573   1.098
  195    HA   GLU  24           HA       GLU  24  15.689  15.421   1.262
  196   1HB   GLU  24          2HB       GLU  24  16.913  14.799  -1.007
  197   2HB   GLU  24          3HB       GLU  24  15.270  14.444  -1.540
  198   1HG   GLU  24          2HG       GLU  24  16.121  17.068  -0.273
  199   2HG   GLU  24          3HG       GLU  24  15.989  16.804  -2.008
  200    H    GLY  25           H        GLY  25  14.336  12.511  -0.256
  201   1HA   GLY  25          1HA       GLY  25  12.231  11.559   0.247
  202   2HA   GLY  25          2HA       GLY  25  11.740  13.082   0.984
  203    H    MET  26           H        MET  26  10.030  11.812  -0.749
  204    HA   MET  26           HA       MET  26  10.318  13.138  -3.352
  205   1HB   MET  26          2HB       MET  26   8.251  11.139  -2.396
  206   2HB   MET  26          3HB       MET  26   8.409  11.752  -4.043
  207   1HG   MET  26          2HG       MET  26  10.846  10.912  -3.924
  208   2HG   MET  26          3HG       MET  26  10.326   9.999  -2.508
  209   1HE   MET  26          1HE       MET  26  11.052   7.718  -3.780
  210   2HE   MET  26          2HE       MET  26   9.554   6.840  -4.063
  211   3HE   MET  26          3HE       MET  26   9.735   7.802  -2.600
  212    H    THR  27           H        THR  27   7.326  12.503  -1.593
  213    HA   THR  27           HA       THR  27   6.826  15.262  -0.961
  214    HB   THR  27           HB       THR  27   4.914  14.128  -2.990
  215    HG1  THR  27           HG1      THR  27   6.324  14.402  -4.494
  216   1HG2  THR  27          1HG2      THR  27   4.173  16.334  -3.176
  217   2HG2  THR  27          2HG2      THR  27   4.612  16.256  -1.469
  218   3HG2  THR  27          3HG2      THR  27   5.710  17.001  -2.629
  219    H    SER  28           H        SER  28   3.874  14.691  -1.364
  220    HA   SER  28           HA       SER  28   3.328  12.487   0.435
  221   1HB   SER  28          2HB       SER  28   2.523  13.705   2.268
  222   2HB   SER  28          3HB       SER  28   3.968  14.607   1.822
  223    HG   SER  28           HG       SER  28   2.463  16.151   1.895
  224    H    ASP  29           H        ASP  29   1.410  11.620  -0.080
  225    HA   ASP  29           HA       ASP  29  -0.832  13.207  -0.952
  226   1HB   ASP  29          2HB       ASP  29   0.825  11.682  -2.921
  227   2HB   ASP  29          3HB       ASP  29  -0.923  11.671  -3.116
  228    H    THR  30           H        THR  30  -2.719  12.147  -0.604
  229    HA   THR  30           HA       THR  30  -2.526   9.411   0.466
  230    HB   THR  30           HB       THR  30  -4.710  11.497   0.656
  231    HG1  THR  30           HG1      THR  30  -3.980  11.731   2.684
  232   1HG2  THR  30          1HG2      THR  30  -4.590   8.598   1.391
  233   2HG2  THR  30          2HG2      THR  30  -5.426   9.697   2.487
  234   3HG2  THR  30          3HG2      THR  30  -5.958   9.546   0.811
  235    H    TYR  31           H        TYR  31  -3.857   7.754  -0.275
  236    HA   TYR  31           HA       TYR  31  -5.383   8.261  -2.750
  237   1HB   TYR  31          2HB       TYR  31  -3.566   5.875  -2.391
  238   2HB   TYR  31          3HB       TYR  31  -4.411   6.380  -3.852
  239    HD1  TYR  31           HD1      TYR  31  -1.281   6.268  -2.437
  240    HD2  TYR  31           HD2      TYR  31  -3.904   9.075  -4.362
  241    HE1  TYR  31           HE1      TYR  31   0.670   7.647  -3.084
  242    HE2  TYR  31           HE2      TYR  31  -1.949  10.457  -5.011
  243    HH   TYR  31           HH       TYR  31   1.353   9.338  -4.436
  244    H    THR  32           H        THR  32  -7.391   7.580  -2.478
  245    HA   THR  32           HA       THR  32  -7.892   5.210  -0.771
  246    HB   THR  32           HB       THR  32 -10.071   6.293  -0.172
  247    HG1  THR  32           HG1      THR  32 -10.493   8.283  -0.851
  248   1HG2  THR  32          1HG2      THR  32  -7.817   8.151   0.569
  249   2HG2  THR  32          2HG2      THR  32  -9.161   7.586   1.561
  250   3HG2  THR  32          3HG2      THR  32  -7.847   6.485   1.153
  251    H    LYS  33           H        LYS  33  -8.089   6.549  -3.836
  252    HA   LYS  33           HA       LYS  33  -9.744   4.370  -4.795
  253   1HB   LYS  33          2HB       LYS  33 -11.244   6.098  -6.026
  254   2HB   LYS  33          3HB       LYS  33 -11.571   5.772  -4.320
  255   1HG   LYS  33          2HG       LYS  33 -10.309   7.746  -3.650
  256   2HG   LYS  33          3HG       LYS  33  -9.842   8.052  -5.323
  257   1HD   LYS  33          2HD       LYS  33 -12.330   8.212  -5.860
  258   2HD   LYS  33          3HD       LYS  33 -12.612   8.220  -4.117
  259   1HE   LYS  33          2HE       LYS  33 -11.214  10.216  -3.866
  260   2HE   LYS  33          3HE       LYS  33 -10.840  10.192  -5.592
  261   1HZ   LYS  33          1HZ       LYS  33 -12.732  11.222  -6.045
  262   2HZ   LYS  33          1HZ       LYS  33 -12.969  11.445  -4.376
  263   3HZ   LYS  33          3HZ       LYS  33 -13.643  10.096  -5.161
  264    H    VAL  34           H        VAL  34  -7.234   4.497  -5.438
  265    HA   VAL  34           HA       VAL  34  -5.590   5.100  -7.000
  266    HB   VAL  34           HB       VAL  34  -7.766   3.953  -8.757
  267   1HG1  VAL  34          1HG1      VAL  34  -5.915   3.116 -10.070
  268   2HG1  VAL  34          2HG1      VAL  34  -5.661   4.842  -9.827
  269   3HG1  VAL  34          3HG1      VAL  34  -4.751   3.676  -8.870
  270   1HG2  VAL  34          1HG2      VAL  34  -5.975   2.728  -6.670
  271   2HG2  VAL  34          2HG2      VAL  34  -7.683   2.415  -6.993
  272   3HG2  VAL  34          3HG2      VAL  34  -6.446   1.784  -8.080
  273    H    ASP  35           H        ASP  35  -5.208   7.221  -7.341
  274    HA   ASP  35           HA       ASP  35  -6.307   8.429  -9.733
  275   1HB   ASP  35          2HB       ASP  35  -7.898   8.875  -7.682
  276   2HB   ASP  35          3HB       ASP  35  -6.667  10.049  -7.230
  277    H    ASP  36           H        ASP  36  -5.566  11.108  -9.000
  278    HA   ASP  36           HA       ASP  36  -3.737  12.488  -9.097
  279   1HB   ASP  36          2HB       ASP  36  -2.670  10.398  -7.186
  280   2HB   ASP  36          3HB       ASP  36  -1.885  11.941  -7.508
  281    H    SER  37           H        SER  37  -1.450   9.986  -8.514
  282    HA   SER  37           HA       SER  37  -0.995   9.193 -11.218
  283   1HB   SER  37          2HB       SER  37  -0.123  11.377 -11.593
  284   2HB   SER  37          3HB       SER  37   0.718  11.392 -10.044
  285    HG   SER  37           HG       SER  37   1.570  10.505 -12.421
  286    H    GLN  38           H        GLN  38  -1.315   7.462  -9.417
  287    HA   GLN  38           HA       GLN  38   1.165   6.812  -8.000
  288   1HB   GLN  38          2HB       GLN  38  -1.485   5.343  -8.044
  289   2HB   GLN  38          3HB       GLN  38  -0.141   5.054  -6.941
  290   1HG   GLN  38          2HG       GLN  38  -0.553   6.953  -5.711
  291   2HG   GLN  38          3HG       GLN  38  -1.218   7.833  -7.084
  292   1HE2  GLN  38          2HE2      GLN  38  -2.081   4.752  -5.395
  293   2HE2  GLN  38          1HE2      GLN  38  -3.728   5.138  -5.248
  294    HA   PRO  39           HA       PRO  39   2.652   4.063 -11.110
  295   1HB   PRO  39          2HB       PRO  39   3.477   2.043  -9.228
  296   2HB   PRO  39          3HB       PRO  39   4.487   3.222 -10.071
  297   1HG   PRO  39          2HG       PRO  39   3.679   3.190  -7.325
  298   2HG   PRO  39          3HG       PRO  39   4.784   4.297  -8.141
  299   1HD   PRO  39          2HD       PRO  39   2.183   4.890  -7.181
  300   2HD   PRO  39          3HD       PRO  39   3.212   5.934  -8.185
  301    H    ALA  40           H        ALA  40   1.601   2.503 -12.311
  302    HA   ALA  40           HA       ALA  40  -0.894   1.539 -11.795
  303   1HB   ALA  40          1HB       ALA  40  -0.327  -0.403 -13.284
  304   2HB   ALA  40          2HB       ALA  40   0.119   1.170 -13.946
  305   3HB   ALA  40          3HB       ALA  40   1.355   0.128 -13.240
  306    H    PHE  41           H        PHE  41   2.163   0.110 -10.815
  307    HA   PHE  41           HA       PHE  41   1.339  -2.288  -9.704
  308   1HB   PHE  41          2HB       PHE  41   3.452  -0.559  -8.430
  309   2HB   PHE  41          3HB       PHE  41   3.414  -2.316  -8.592
  310    HD1  PHE  41           HD1      PHE  41   5.107   0.423  -9.762
  311    HD2  PHE  41           HD2      PHE  41   2.930  -2.955 -11.286
  312    HE1  PHE  41           HE1      PHE  41   6.346   0.589 -11.902
  313    HE2  PHE  41           HE2      PHE  41   4.169  -2.788 -13.424
  314    HZ   PHE  41           HZ       PHE  41   5.877  -1.018 -13.736
  315    H    ILE  42           H        ILE  42   1.255   0.969  -8.298
  316    HA   ILE  42           HA       ILE  42   0.514   0.134  -5.674
  317    HB   ILE  42           HB       ILE  42   0.576   2.741  -7.145
  318   1HG1  ILE  42          2HG1      ILE  42   2.501   1.563  -5.832
  319   2HG1  ILE  42          3HG1      ILE  42   2.230   3.282  -5.567
  320   1HG2  ILE  42          1HG2      ILE  42  -1.479   3.067  -6.015
  321   2HG2  ILE  42          2HG2      ILE  42  -0.938   2.172  -4.595
  322   3HG2  ILE  42          3HG2      ILE  42  -0.274   3.768  -4.937
  323   1HD1  ILE  42          1HD1      ILE  42   0.729   1.383  -3.830
  324   2HD1  ILE  42          2HD1      ILE  42   2.457   1.562  -3.533
  325   3HD1  ILE  42          3HD1      ILE  42   1.399   2.970  -3.449
  326    H    ASN  43           H        ASN  43  -1.279   0.691  -8.627
  327    HA   ASN  43           HA       ASN  43  -3.841   1.099  -7.507
  328   1HB   ASN  43          2HB       ASN  43  -3.032  -0.227 -10.111
  329   2HB   ASN  43          3HB       ASN  43  -4.680   0.201  -9.679
  330   1HD2  ASN  43          2HD2      ASN  43  -2.235   2.402  -8.542
  331   2HD2  ASN  43          1HD2      ASN  43  -2.524   3.620  -9.687
  332    H    ASP  44           H        ASP  44  -1.925  -1.772  -8.253
  333    HA   ASP  44           HA       ASP  44  -3.848  -3.759  -7.812
  334   1HB   ASP  44          2HB       ASP  44  -1.480  -4.091  -8.659
  335   2HB   ASP  44          3HB       ASP  44  -0.947  -3.959  -6.985
  336    H    ILE  45           H        ILE  45  -1.531  -2.352  -5.494
  337    HA   ILE  45           HA       ILE  45  -2.238  -3.641  -3.179
  338    HB   ILE  45           HB       ILE  45  -1.502  -0.742  -3.627
  339   1HG1  ILE  45          2HG1      ILE  45   0.106  -3.092  -2.589
  340   2HG1  ILE  45          3HG1      ILE  45   0.134  -2.536  -4.261
  341   1HG2  ILE  45          1HG2      ILE  45  -1.646  -2.299  -1.027
  342   2HG2  ILE  45          2HG2      ILE  45  -0.926  -0.701  -1.216
  343   3HG2  ILE  45          3HG2      ILE  45  -2.654  -0.922  -1.473
  344   1HD1  ILE  45          1HD1      ILE  45   1.549  -0.858  -3.757
  345   2HD1  ILE  45          2HD1      ILE  45   0.524  -0.317  -2.425
  346   3HD1  ILE  45          3HD1      ILE  45   1.725  -1.582  -2.158
  347    H    LEU  46           H        LEU  46  -3.725  -0.643  -4.415
  348    HA   LEU  46           HA       LEU  46  -5.778  -0.550  -2.450
  349   1HB   LEU  46          2HB       LEU  46  -5.558   0.742  -5.179
  350   2HB   LEU  46          3HB       LEU  46  -6.823   1.111  -4.006
  351    HG   LEU  46           HG       LEU  46  -3.847   1.385  -3.467
  352   1HD1  LEU  46          1HD1      LEU  46  -5.962   3.375  -4.305
  353   2HD1  LEU  46          2HD1      LEU  46  -4.506   3.880  -3.447
  354   3HD1  LEU  46          3HD1      LEU  46  -4.377   3.100  -5.024
  355   1HD2  LEU  46          1HD2      LEU  46  -6.351   1.780  -1.861
  356   2HD2  LEU  46          2HD2      LEU  46  -4.788   1.137  -1.357
  357   3HD2  LEU  46          3HD2      LEU  46  -4.995   2.874  -1.579
  358    H    LYS  47           H        LYS  47  -5.572  -1.952  -5.684
  359    HA   LYS  47           HA       LYS  47  -8.377  -2.662  -5.745
  360   1HB   LYS  47          2HB       LYS  47  -6.033  -3.092  -7.575
  361   2HB   LYS  47          3HB       LYS  47  -7.523  -4.007  -7.815
  362   1HG   LYS  47          2HG       LYS  47  -8.787  -1.832  -7.809
  363   2HG   LYS  47          3HG       LYS  47  -7.241  -0.987  -7.760
  364   1HD   LYS  47          2HD       LYS  47  -6.639  -2.368  -9.866
  365   2HD   LYS  47          3HD       LYS  47  -8.368  -2.709  -9.968
  366   1HE   LYS  47          2HE       LYS  47  -8.876  -0.326 -10.069
  367   2HE   LYS  47          3HE       LYS  47  -7.178   0.079  -9.835
  368   1HZ   LYS  47          1HZ       LYS  47  -8.479  -1.156 -12.176
  369   2HZ   LYS  47          1HZ       LYS  47  -6.814  -1.355 -11.907
  370   3HZ   LYS  47          3HZ       LYS  47  -7.464   0.201 -12.115
  371    H    VAL  48           H        VAL  48  -5.673  -3.943  -4.227
  372    HA   VAL  48           HA       VAL  48  -6.364  -6.743  -4.493
  373    HB   VAL  48           HB       VAL  48  -4.317  -5.195  -2.924
  374   1HG1  VAL  48          1HG1      VAL  48  -5.245  -8.029  -2.418
  375   2HG1  VAL  48          2HG1      VAL  48  -3.618  -7.492  -2.004
  376   3HG1  VAL  48          3HG1      VAL  48  -5.016  -6.734  -1.242
  377   1HG2  VAL  48          1HG2      VAL  48  -2.785  -6.359  -4.248
  378   2HG2  VAL  48          2HG2      VAL  48  -3.892  -7.703  -4.530
  379   3HG2  VAL  48          3HG2      VAL  48  -4.136  -6.168  -5.363
  380    H    GLU  49           H        GLU  49  -8.094  -7.564  -3.522
  381    HA   GLU  49           HA       GLU  49  -9.707  -6.334  -1.644
  382   1HB   GLU  49          2HB       GLU  49  -9.240  -9.240  -2.289
  383   2HB   GLU  49          3HB       GLU  49 -10.399  -8.750  -1.058
  384   1HG   GLU  49          2HG       GLU  49 -11.612  -7.392  -2.692
  385   2HG   GLU  49          3HG       GLU  49 -10.416  -7.769  -3.929
  386    H    GLY  50           H        GLY  50  -9.162  -5.607   0.317
  387   1HA   GLY  50          1HA       GLY  50  -8.741  -6.747   2.610
  388   2HA   GLY  50          2HA       GLY  50  -7.168  -7.090   1.901
  389    H    VAL  51           H        VAL  51  -6.817  -4.645   0.485
  390    HA   VAL  51           HA       VAL  51  -5.923  -2.969   2.664
  391    HB   VAL  51           HB       VAL  51  -5.869  -2.261  -0.270
  392   1HG1  VAL  51          1HG1      VAL  51  -5.179  -0.438   1.110
  393   2HG1  VAL  51          2HG1      VAL  51  -4.277  -1.504   2.188
  394   3HG1  VAL  51          3HG1      VAL  51  -3.685  -1.192   0.558
  395   1HG2  VAL  51          1HG2      VAL  51  -3.631  -3.378  -0.305
  396   2HG2  VAL  51          2HG2      VAL  51  -3.957  -4.018   1.307
  397   3HG2  VAL  51          3HG2      VAL  51  -4.953  -4.519  -0.060
  398    H    LYS  52           H        LYS  52  -6.606  -0.860   3.127
  399    HA   LYS  52           HA       LYS  52  -9.330  -0.232   2.167
  400   1HB   LYS  52          2HB       LYS  52  -9.229  -0.612   4.561
  401   2HB   LYS  52          3HB       LYS  52  -7.904   0.540   4.724
  402   1HG   LYS  52          2HG       LYS  52  -9.278   2.383   4.375
  403   2HG   LYS  52          3HG       LYS  52 -10.459   1.458   3.452
  404   1HD   LYS  52          2HD       LYS  52 -11.392   2.028   5.641
  405   2HD   LYS  52          3HD       LYS  52 -11.144   0.288   5.538
  406   1HE   LYS  52          2HE       LYS  52  -8.957   2.016   6.662
  407   2HE   LYS  52          3HE       LYS  52 -10.338   1.606   7.677
  408   1HZ   LYS  52          1HZ       LYS  52  -8.823  -0.095   8.057
  409   2HZ   LYS  52          1HZ       LYS  52  -8.373  -0.206   6.423
  410   3HZ   LYS  52          3HZ       LYS  52  -9.893  -0.773   6.929
  411    H    SER  53           H        SER  53  -6.105   1.128   2.716
  412    HA   SER  53           HA       SER  53  -6.448   3.087   0.672
  413   1HB   SER  53          2HB       SER  53  -7.792   4.390   2.061
  414   2HB   SER  53          3HB       SER  53  -6.943   3.899   3.518
  415    HG   SER  53           HG       SER  53  -5.609   5.492   3.233
  416    H    ILE  54           H        ILE  54  -4.652   4.831   0.901
  417    HA   ILE  54           HA       ILE  54  -2.217   3.710   2.127
  418    HB   ILE  54           HB       ILE  54  -2.561   4.563  -0.760
  419   1HG1  ILE  54          2HG1      ILE  54  -1.379   2.027   0.411
  420   2HG1  ILE  54          3HG1      ILE  54  -3.076   2.173  -0.049
  421   1HG2  ILE  54          1HG2      ILE  54  -0.505   5.580   0.012
  422   2HG2  ILE  54          2HG2      ILE  54  -0.032   4.107   0.858
  423   3HG2  ILE  54          3HG2      ILE  54  -0.070   4.139  -0.906
  424   1HD1  ILE  54          1HD1      ILE  54  -0.658   2.443  -1.852
  425   2HD1  ILE  54          2HD1      ILE  54  -1.920   1.216  -1.932
  426   3HD1  ILE  54          3HD1      ILE  54  -2.292   2.887  -2.350
  427    H    PHE  55           H        PHE  55  -0.570   5.288   2.501
  428    HA   PHE  55           HA       PHE  55  -1.384   8.103   2.200
  429   1HB   PHE  55          2HB       PHE  55  -1.969   7.172   4.510
  430   2HB   PHE  55          3HB       PHE  55  -0.233   7.039   4.779
  431    HD1  PHE  55           HD1      PHE  55   1.067   8.939   5.351
  432    HD2  PHE  55           HD2      PHE  55  -2.941   9.434   3.900
  433    HE1  PHE  55           HE1      PHE  55   1.161  11.353   5.920
  434    HE2  PHE  55           HE2      PHE  55  -2.850  11.847   4.465
  435    HZ   PHE  55           HZ       PHE  55  -0.799  12.807   5.475
  436    H    HIS  56           H        HIS  56   0.184   8.885   0.931
  437    HA   HIS  56           HA       HIS  56   2.942   7.955   1.305
  438   1HB   HIS  56          2HB       HIS  56   1.689   8.243  -0.990
  439   2HB   HIS  56          3HB       HIS  56   2.126   9.939  -0.794
  440    HD1  HIS  56           HD1      HIS  56   3.379   7.149  -2.457
  441    HD2  HIS  56           HD2      HIS  56   5.172   9.868   0.152
  442    HE1  HIS  56           HE1      HIS  56   5.878   6.996  -2.864
  443    H    VAL  57           H        VAL  57   4.435   9.139   2.308
  444    HA   VAL  57           HA       VAL  57   4.377  12.014   2.381
  445    HB   VAL  57           HB       VAL  57   2.698  11.261   4.168
  446   1HG1  VAL  57          1HG1      VAL  57   3.536  10.333   6.197
  447   2HG1  VAL  57          2HG1      VAL  57   4.256   9.361   4.915
  448   3HG1  VAL  57          3HG1      VAL  57   5.211  10.607   5.719
  449   1HG2  VAL  57          1HG2      VAL  57   3.347  13.050   5.603
  450   2HG2  VAL  57          2HG2      VAL  57   5.059  12.818   5.243
  451   3HG2  VAL  57          3HG2      VAL  57   3.981  13.484   4.016
  452    H    MET  58           H        MET  58   6.257  12.883   3.607
  453    HA   MET  58           HA       MET  58   8.579  12.900   3.647
  454   1HB   MET  58          2HB       MET  58   7.630  12.067   5.926
  455   2HB   MET  58          3HB       MET  58   8.293  10.508   5.446
  456   1HG   MET  58          2HG       MET  58  10.468  11.890   4.935
  457   2HG   MET  58          3HG       MET  58   9.739  13.088   6.002
  458   1HE   MET  58          1HE       MET  58  10.943  13.216   8.076
  459   2HE   MET  58          2HE       MET  58  12.224  12.518   7.089
  460   3HE   MET  58          3HE       MET  58  11.956  11.915   8.722
  461    H    ASP  59           H        ASP  59   9.899  10.189   4.456
  462    HA   ASP  59           HA       ASP  59  10.327   9.298   1.679
  463   1HB   ASP  59          2HB       ASP  59  12.369   8.162   2.791
  464   2HB   ASP  59          3HB       ASP  59  12.400   9.915   2.613
  465    H    PHE  60           H        PHE  60   7.964   8.431   2.997
  466    HA   PHE  60           HA       PHE  60   8.298   5.577   2.744
  467   1HB   PHE  60          2HB       PHE  60   7.669   4.922   4.958
  468   2HB   PHE  60          3HB       PHE  60   9.018   6.041   5.115
  469    HD1  PHE  60           HD1      PHE  60   5.395   5.573   5.605
  470    HD2  PHE  60           HD2      PHE  60   8.687   8.307   5.983
  471    HE1  PHE  60           HE1      PHE  60   4.014   7.035   7.055
  472    HE2  PHE  60           HE2      PHE  60   7.305   9.769   7.429
  473    HZ   PHE  60           HZ       PHE  60   4.968   9.134   7.968
  474    H    ILE  61           H        ILE  61   6.179   4.420   3.192
  475    HA   ILE  61           HA       ILE  61   3.837   6.155   2.758
  476    HB   ILE  61           HB       ILE  61   4.348   3.666   1.116
  477   1HG1  ILE  61          2HG1      ILE  61   4.498   5.622  -0.701
  478   2HG1  ILE  61          3HG1      ILE  61   5.112   6.526   0.682
  479   1HG2  ILE  61          1HG2      ILE  61   2.357   4.149   0.054
  480   2HG2  ILE  61          2HG2      ILE  61   1.985   4.788   1.654
  481   3HG2  ILE  61          3HG2      ILE  61   2.487   5.881   0.364
  482   1HD1  ILE  61          1HD1      ILE  61   7.090   5.616  -0.108
  483   2HD1  ILE  61          2HD1      ILE  61   6.600   4.341   1.007
  484   3HD1  ILE  61          3HD1      ILE  61   6.300   4.165  -0.722
  485    H    SER  62           H        SER  62   2.053   5.499   3.829
  486    HA   SER  62           HA       SER  62   2.270   3.030   5.407
  487   1HB   SER  62          2HB       SER  62   1.193   4.128   7.052
  488   2HB   SER  62          3HB       SER  62   1.502   5.590   6.121
  489    HG   SER  62           HG       SER  62  -0.562   5.708   5.812
  490    H    VAL  63           H        VAL  63   0.466   1.594   5.558
  491    HA   VAL  63           HA       VAL  63  -1.577   1.815   3.465
  492    HB   VAL  63           HB       VAL  63   0.041  -0.720   3.836
  493   1HG1  VAL  63          1HG1      VAL  63  -2.096   0.216   1.912
  494   2HG1  VAL  63          2HG1      VAL  63  -1.050  -1.156   1.550
  495   3HG1  VAL  63          3HG1      VAL  63  -2.119  -1.207   2.953
  496   1HG2  VAL  63          1HG2      VAL  63   0.361   1.577   1.897
  497   2HG2  VAL  63          2HG2      VAL  63   1.601   0.776   2.864
  498   3HG2  VAL  63          3HG2      VAL  63   0.887  -0.052   1.480
  499    H    ASP  64           H        ASP  64  -3.404   1.719   4.580
  500    HA   ASP  64           HA       ASP  64  -3.541   0.023   6.977
  501   1HB   ASP  64          2HB       ASP  64  -5.552   1.262   7.559
  502   2HB   ASP  64          3HB       ASP  64  -4.238   2.378   7.221
  503    H    LYS  65           H        LYS  65  -5.020  -1.595   7.206
  504    HA   LYS  65           HA       LYS  65  -6.557  -2.347   4.791
  505   1HB   LYS  65          2HB       LYS  65  -6.107  -4.696   5.305
  506   2HB   LYS  65          3HB       LYS  65  -4.592  -3.821   5.092
  507   1HG   LYS  65          2HG       LYS  65  -4.272  -3.664   7.488
  508   2HG   LYS  65          3HG       LYS  65  -5.877  -4.330   7.791
  509   1HD   LYS  65          2HD       LYS  65  -5.041  -6.380   6.428
  510   2HD   LYS  65          3HD       LYS  65  -3.432  -5.732   6.725
  511   1HE   LYS  65          2HE       LYS  65  -5.465  -6.672   8.752
  512   2HE   LYS  65          3HE       LYS  65  -3.812  -7.239   8.522
  513   1HZ   LYS  65          1HZ       LYS  65  -3.178  -5.762  10.026
  514   2HZ   LYS  65          1HZ       LYS  65  -4.749  -5.123  10.142
  515   3HZ   LYS  65          3HZ       LYS  65  -3.664  -4.511   8.990
  516    H    GLU  66           H        GLU  66  -8.080  -4.327   5.604
  517    HA   GLU  66           HA       GLU  66  -9.805  -3.083   7.607
  518   1HB   GLU  66          2HB       GLU  66 -10.404  -5.619   6.097
  519   2HB   GLU  66          3HB       GLU  66 -11.533  -4.430   6.751
  520   1HG   GLU  66          2HG       GLU  66 -10.310  -2.787   5.085
  521   2HG   GLU  66          3HG       GLU  66  -9.843  -4.278   4.270
  522    H    ASN  67           H        ASN  67  -9.988  -3.793   9.647
  523    HA   ASN  67           HA       ASN  67  -8.246  -5.512  10.901
  524   1HB   ASN  67          2HB       ASN  67 -10.091  -3.940  11.870
  525   2HB   ASN  67          3HB       ASN  67 -11.113  -5.374  11.790
  526   1HD2  ASN  67          2HD2      ASN  67  -9.808  -7.448  12.725
  527   2HD2  ASN  67          1HD2      ASN  67  -9.039  -7.163  14.212
  528    H    ASP  68           H        ASP  68 -11.229  -6.250   9.203
  529    HA   ASP  68           HA       ASP  68 -11.562  -8.937  10.000
  530   1HB   ASP  68          2HB       ASP  68 -12.271  -8.032   7.229
  531   2HB   ASP  68          3HB       ASP  68 -13.162  -9.093   8.315
  532    H    ALA  69           H        ALA  69  -9.592  -7.424   7.513
  533    HA   ALA  69           HA       ALA  69  -8.751  -9.987   6.400
  534   1HB   ALA  69          1HB       ALA  69  -8.900  -8.432   4.691
  535   2HB   ALA  69          2HB       ALA  69  -8.330  -7.106   5.705
  536   3HB   ALA  69          3HB       ALA  69  -7.190  -8.305   5.096
  537    H    ASN  70           H        ASN  70  -6.388 -10.369   6.099
  538    HA   ASN  70           HA       ASN  70  -4.938  -9.744   8.598
  539   1HB   ASN  70          2HB       ASN  70  -4.560 -12.028   6.642
  540   2HB   ASN  70          3HB       ASN  70  -3.644 -11.788   8.129
  541   1HD2  ASN  70          2HD2      ASN  70  -5.223 -11.488  10.154
  542   2HD2  ASN  70          1HD2      ASN  70  -6.511 -12.592  10.219
  543    H    TRP  71           H        TRP  71  -2.445 -10.003   8.178
  544    HA   TRP  71           HA       TRP  71  -1.783  -8.091   6.047
  545   1HB   TRP  71          2HB       TRP  71  -0.633  -8.767   8.698
  546   2HB   TRP  71          3HB       TRP  71   0.523  -8.341   7.432
  547    HD1  TRP  71           HD1      TRP  71  -1.376  -6.744  10.023
  548    HE1  TRP  71           HE1      TRP  71  -1.791  -4.248   9.526
  549    HE3  TRP  71           HE3      TRP  71  -0.173  -6.630   5.066
  550    HZ2  TRP  71           HZ2      TRP  71  -1.636  -2.446   7.308
  551    HZ3  TRP  71           HZ3      TRP  71  -0.315  -4.515   3.784
  552    HH2  TRP  71           HH2      TRP  71  -1.044  -2.425   4.899
  553    H    GLU  72           H        GLU  72  -0.760 -11.223   7.360
  554    HA   GLU  72           HA       GLU  72   1.319 -11.796   5.596
  555   1HB   GLU  72          2HB       GLU  72   0.779 -14.203   6.106
  556   2HB   GLU  72          3HB       GLU  72   0.984 -13.175   7.522
  557   1HG   GLU  72          2HG       GLU  72  -0.981 -14.337   8.043
  558   2HG   GLU  72          3HG       GLU  72  -1.604 -12.841   7.360
  559    H    THR  73           H        THR  73  -2.079 -11.700   4.986
  560    HA   THR  73           HA       THR  73  -1.917 -13.365   2.602
  561    HB   THR  73           HB       THR  73  -3.948 -13.363   4.066
  562    HG1  THR  73           HG1      THR  73  -3.874 -13.738   1.686
  563   1HG2  THR  73          1HG2      THR  73  -4.592 -10.680   2.854
  564   2HG2  THR  73          2HG2      THR  73  -5.386 -11.499   4.197
  565   3HG2  THR  73          3HG2      THR  73  -3.780 -10.808   4.416
  566    H    VAL  74           H        VAL  74  -2.416  -9.992   3.467
  567    HA   VAL  74           HA       VAL  74  -2.527  -9.066   0.756
  568    HB   VAL  74           HB       VAL  74  -2.840  -7.980   3.441
  569   1HG1  VAL  74          1HG1      VAL  74  -0.784  -6.758   2.897
  570   2HG1  VAL  74          2HG1      VAL  74  -1.477  -6.252   1.357
  571   3HG1  VAL  74          3HG1      VAL  74  -2.173  -5.672   2.870
  572   1HG2  VAL  74          1HG2      VAL  74  -3.768  -7.047   0.709
  573   2HG2  VAL  74          2HG2      VAL  74  -4.610  -8.224   1.715
  574   3HG2  VAL  74          3HG2      VAL  74  -4.445  -6.556   2.263
  575    H    LEU  75           H        LEU  75  -0.015  -9.279   3.247
  576    HA   LEU  75           HA       LEU  75   1.965  -7.672   2.223
  577   1HB   LEU  75          2HB       LEU  75   1.844  -9.940   4.028
  578   2HB   LEU  75          3HB       LEU  75   3.344  -9.937   3.103
  579    HG   LEU  75           HG       LEU  75   2.262  -7.506   4.548
  580   1HD1  LEU  75          1HD1      LEU  75   2.803  -8.907   6.326
  581   2HD1  LEU  75          2HD1      LEU  75   4.078  -9.730   5.429
  582   3HD1  LEU  75          3HD1      LEU  75   4.343  -8.096   6.042
  583   1HD2  LEU  75          1HD2      LEU  75   3.751  -6.643   3.010
  584   2HD2  LEU  75          2HD2      LEU  75   4.895  -7.083   4.275
  585   3HD2  LEU  75          3HD2      LEU  75   4.663  -8.149   2.892
  586    HA   PRO  76           HA       PRO  76   3.757 -11.467  -0.391
  587   1HB   PRO  76          2HB       PRO  76   1.376 -12.807  -1.318
  588   2HB   PRO  76          3HB       PRO  76   2.734 -13.483  -0.406
  589   1HG   PRO  76          2HG       PRO  76   0.111 -12.615   0.536
  590   2HG   PRO  76          3HG       PRO  76   1.288 -13.680   1.305
  591   1HD   PRO  76          2HD       PRO  76   0.758 -11.163   2.222
  592   2HD   PRO  76          3HD       PRO  76   2.345 -11.943   2.410
  593    H    LYS  77           H        LYS  77   0.665  -9.829  -0.892
  594    HA   LYS  77           HA       LYS  77   1.044  -9.564  -3.758
  595   1HB   LYS  77          2HB       LYS  77  -0.979  -8.500  -1.789
  596   2HB   LYS  77          3HB       LYS  77  -0.931  -7.924  -3.453
  597   1HG   LYS  77          2HG       LYS  77  -2.438  -9.693  -3.627
  598   2HG   LYS  77          3HG       LYS  77  -0.921 -10.496  -4.037
  599   1HD   LYS  77          2HD       LYS  77  -0.684 -11.231  -1.683
  600   2HD   LYS  77          3HD       LYS  77  -2.221 -10.457  -1.296
  601   1HE   LYS  77          2HE       LYS  77  -1.837 -12.693  -3.310
  602   2HE   LYS  77          3HE       LYS  77  -2.524 -12.874  -1.695
  603   1HZ   LYS  77          1HZ       LYS  77  -4.024 -10.903  -2.651
  604   2HZ   LYS  77          1HZ       LYS  77  -4.437 -12.545  -2.796
  605   3HZ   LYS  77          3HZ       LYS  77  -3.699 -11.736  -4.092
  606    H    VAL  78           H        VAL  78   1.327  -7.529  -0.876
  607    HA   VAL  78           HA       VAL  78   1.854  -5.063  -2.028
  608    HB   VAL  78           HB       VAL  78   2.873  -6.338   0.516
  609   1HG1  VAL  78          1HG1      VAL  78   4.571  -4.768   0.192
  610   2HG1  VAL  78          2HG1      VAL  78   3.524  -3.674  -0.714
  611   3HG1  VAL  78          3HG1      VAL  78   3.367  -3.798   1.038
  612   1HG2  VAL  78          1HG2      VAL  78   0.986  -4.005   0.126
  613   2HG2  VAL  78          2HG2      VAL  78   0.420  -5.674   0.150
  614   3HG2  VAL  78          3HG2      VAL  78   1.214  -4.994   1.568
  615    H    GLU  79           H        GLU  79   4.300  -7.481  -1.024
  616    HA   GLU  79           HA       GLU  79   6.561  -6.164  -1.945
  617   1HB   GLU  79          2HB       GLU  79   6.770  -8.149  -0.593
  618   2HB   GLU  79          3HB       GLU  79   5.981  -9.130  -1.827
  619   1HG   GLU  79          2HG       GLU  79   7.816  -8.898  -3.334
  620   2HG   GLU  79          3HG       GLU  79   8.531  -7.597  -2.383
  621    H    ALA  80           H        ALA  80   4.214  -8.073  -3.744
  622    HA   ALA  80           HA       ALA  80   5.592  -8.512  -6.120
  623   1HB   ALA  80          1HB       ALA  80   2.709  -7.736  -6.252
  624   2HB   ALA  80          2HB       ALA  80   3.554  -9.063  -7.049
  625   3HB   ALA  80          3HB       ALA  80   3.151  -9.176  -5.335
  626    H    VAL  81           H        VAL  81   4.055  -5.581  -4.937
  627    HA   VAL  81           HA       VAL  81   3.897  -4.091  -7.299
  628    HB   VAL  81           HB       VAL  81   4.590  -3.018  -4.550
  629   1HG1  VAL  81          1HG1      VAL  81   4.584  -1.579  -6.789
  630   2HG1  VAL  81          2HG1      VAL  81   2.838  -1.638  -6.552
  631   3HG1  VAL  81          3HG1      VAL  81   3.872  -0.943  -5.306
  632   1HG2  VAL  81          1HG2      VAL  81   2.538  -4.627  -4.820
  633   2HG2  VAL  81          2HG2      VAL  81   2.322  -3.097  -3.976
  634   3HG2  VAL  81          3HG2      VAL  81   1.797  -3.261  -5.651
  635    H    PHE  82           H        PHE  82   6.479  -3.771  -4.842
  636    HA   PHE  82           HA       PHE  82   8.235  -2.529  -6.801
  637   1HB   PHE  82          2HB       PHE  82   9.126  -3.289  -4.039
  638   2HB   PHE  82          3HB       PHE  82   9.561  -1.881  -5.007
  639    HD1  PHE  82           HD1      PHE  82   8.282   0.144  -4.899
  640    HD2  PHE  82           HD2      PHE  82   6.819  -3.446  -3.044
  641    HE1  PHE  82           HE1      PHE  82   6.482   1.443  -3.792
  642    HE2  PHE  82           HE2      PHE  82   5.021  -2.146  -1.942
  643    HZ   PHE  82           HZ       PHE  82   4.854   0.295  -2.316
  644    H    GLU  83           H        GLU  83   7.479  -5.371  -7.172
  645    HA   GLU  83           HA       GLU  83  10.117  -6.370  -7.742
  646   1HB   GLU  83          2HB       GLU  83   9.605  -6.900  -5.242
  647   2HB   GLU  83          3HB       GLU  83   8.516  -8.124  -5.897
  648   1HG   GLU  83          2HG       GLU  83  10.386  -9.083  -7.203
  649   2HG   GLU  83          3HG       GLU  83  11.471  -7.866  -6.533
  650    H    LEU  84           H        LEU  84   9.308  -6.448  -9.863
  651    HA   LEU  84           HA       LEU  84   7.953  -8.893 -10.536
  652   1HB   LEU  84          2HB       LEU  84   6.135  -7.538 -11.847
  653   2HB   LEU  84          3HB       LEU  84   5.909  -7.864 -10.129
  654    HG   LEU  84           HG       LEU  84   6.835  -5.631  -9.587
  655   1HD1  LEU  84          1HD1      LEU  84   8.316  -5.162 -11.389
  656   2HD1  LEU  84          2HD1      LEU  84   7.063  -5.451 -12.598
  657   3HD1  LEU  84          3HD1      LEU  84   6.995  -4.012 -11.580
  658   1HD2  LEU  84          1HD2      LEU  84   4.585  -5.591 -11.622
  659   2HD2  LEU  84          2HD2      LEU  84   4.408  -5.904  -9.895
  660   3HD2  LEU  84          3HD2      LEU  84   4.928  -4.316 -10.454
  661    H    GLU  85           H        GLU  85  10.308  -6.879 -11.187
  662    HA   GLU  85           HA       GLU  85  11.349  -6.013 -13.097
  663   1HB   GLU  85          2HB       GLU  85  10.901  -8.921 -13.817
  664   2HB   GLU  85          3HB       GLU  85  12.155  -7.873 -14.474
  665   1HG   GLU  85          2HG       GLU  85  11.861  -8.542 -11.531
  666   2HG   GLU  85          3HG       GLU  85  12.964  -9.366 -12.628
  667    H    HIS  86           H        HIS  86   9.233  -4.791 -13.635
  668    HA   HIS  86           HA       HIS  86   7.485  -5.743 -15.630
  669   1HB   HIS  86          2HB       HIS  86   7.032  -3.754 -14.201
  670   2HB   HIS  86          3HB       HIS  86   8.275  -2.868 -15.083
  671    HD1  HIS  86           HD1      HIS  86   6.438  -1.213 -16.015
  672    HD2  HIS  86           HD2      HIS  86   5.939  -5.184 -17.190
  673    HE1  HIS  86           HE1      HIS  86   4.754  -1.196 -17.909
  674    H    HIS  87           H        HIS  87   9.696  -3.044 -16.196
  675    HA   HIS  87           HA       HIS  87  10.063  -3.911 -18.959
  676   1HB   HIS  87          2HB       HIS  87  11.479  -1.658 -18.872
  677   2HB   HIS  87          3HB       HIS  87   9.720  -1.635 -18.985
  678    HD1  HIS  87           HD1      HIS  87  12.400  -1.609 -16.270
  679    HD2  HIS  87           HD2      HIS  87   8.513  -0.254 -16.922
  680    HE1  HIS  87           HE1      HIS  87  11.765  -0.251 -14.228
  681    H    HIS  88           H        HIS  88  12.534  -3.018 -19.600
  682    HA   HIS  88           HA       HIS  88  14.456  -4.313 -17.793
  683   1HB   HIS  88          2HB       HIS  88  15.444  -5.554 -19.699
  684   2HB   HIS  88          3HB       HIS  88  13.797  -6.073 -19.345
  685    HD1  HIS  88           HD1      HIS  88  11.955  -5.481 -21.055
  686    HD2  HIS  88           HD2      HIS  88  15.731  -4.101 -22.154
  687    HE1  HIS  88           HE1      HIS  88  11.772  -4.736 -23.467
  688    H    HIS  89           H        HIS  89  13.597  -1.737 -19.707
  689    HA   HIS  89           HA       HIS  89  15.919  -0.957 -21.026
  690   1HB   HIS  89          2HB       HIS  89  14.016   0.901 -19.577
  691   2HB   HIS  89          3HB       HIS  89  15.066   1.304 -20.933
  692    HD1  HIS  89           HD1      HIS  89  14.572  -0.341 -23.151
  693    HD2  HIS  89           HD2      HIS  89  11.478   0.227 -20.416
  694    HE1  HIS  89           HE1      HIS  89  12.430  -0.983 -24.346
  695    H    HIS  90           H        HIS  90  17.851  -0.169 -20.412
  696    HA   HIS  90           HA       HIS  90  18.716  -0.396 -17.729
  697   1HB   HIS  90          2HB       HIS  90  19.989   1.062 -20.056
  698   2HB   HIS  90          3HB       HIS  90  20.794   0.672 -18.535
  699    HD1  HIS  90           HD1      HIS  90  18.998  -2.176 -18.621
  700    HD2  HIS  90           HD2      HIS  90  21.935  -0.815 -21.246
  701    HE1  HIS  90           HE1      HIS  90  19.886  -4.218 -19.816
  702    H    HIS  91           H        HIS  91  18.157   0.880 -16.110
  703    HA   HIS  91           HA       HIS  91  17.491   2.724 -14.913
  704   1HB   HIS  91          2HB       HIS  91  19.512   4.049 -16.735
  705   2HB   HIS  91          3HB       HIS  91  18.939   4.682 -15.192
  706    HD1  HIS  91           HD1      HIS  91  19.295   2.875 -13.106
  707    HD2  HIS  91           HD2      HIS  91  21.759   2.457 -16.440
  708    HE1  HIS  91           HE1      HIS  91  21.279   1.489 -12.358
  Start of MODEL    5
    1   1H    MET   1          1HT       MET   1  13.153   3.263  -6.441
    2   2H    MET   1          2HT       MET   1  13.947   2.130  -5.455
    3   3H    MET   1          3HT       MET   1  14.138   3.794  -5.167
    4    HA   MET   1           HA       MET   1  12.512   3.623  -3.679
    5   1HB   MET   1          2HB       MET   1  10.999   3.172  -6.264
    6   2HB   MET   1          3HB       MET   1  10.180   3.382  -4.716
    7   1HG   MET   1          2HG       MET   1  10.842   5.604  -4.511
    8   2HG   MET   1          3HG       MET   1  12.260   5.384  -5.536
    9   1HE   MET   1          1HE       MET   1  11.563   7.708  -6.568
   10   2HE   MET   1          2HE       MET   1  10.077   7.764  -5.624
   11   3HE   MET   1          3HE       MET   1  10.017   8.032  -7.363
   12    H    LYS   2           H        LYS   2  13.449   1.689  -2.733
   13    HA   LYS   2           HA       LYS   2  11.769  -0.713  -3.157
   14   1HB   LYS   2          2HB       LYS   2  14.736  -0.561  -2.576
   15   2HB   LYS   2          3HB       LYS   2  13.789  -2.047  -2.517
   16   1HG   LYS   2          2HG       LYS   2  13.653  -0.343  -4.984
   17   2HG   LYS   2          3HG       LYS   2  15.063  -1.372  -4.731
   18   1HD   LYS   2          2HD       LYS   2  12.364  -2.589  -4.313
   19   2HD   LYS   2          3HD       LYS   2  12.881  -2.286  -5.972
   20   1HE   LYS   2          2HE       LYS   2  14.772  -3.635  -4.066
   21   2HE   LYS   2          3HE       LYS   2  13.487  -4.575  -4.822
   22   1HZ   LYS   2          1HZ       LYS   2  14.267  -3.789  -6.987
   23   2HZ   LYS   2          1HZ       LYS   2  15.473  -4.655  -6.159
   24   3HZ   LYS   2          3HZ       LYS   2  15.539  -2.959  -6.232
   25    H    ILE   3           H        ILE   3  11.918  -2.226  -1.222
   26    HA   ILE   3           HA       ILE   3  11.211  -0.711   1.140
   27    HB   ILE   3           HB       ILE   3  11.347  -3.709   0.732
   28   1HG1  ILE   3          2HG1      ILE   3   8.931  -1.875   0.602
   29   2HG1  ILE   3          3HG1      ILE   3   9.801  -2.419  -0.833
   30   1HG2  ILE   3          1HG2      ILE   3  10.115  -1.919   2.845
   31   2HG2  ILE   3          2HG2      ILE   3   9.669  -3.613   2.648
   32   3HG2  ILE   3          3HG2      ILE   3  11.323  -3.184   3.080
   33   1HD1  ILE   3          1HD1      ILE   3   9.197  -4.672  -0.494
   34   2HD1  ILE   3          2HD1      ILE   3   8.793  -4.401   1.202
   35   3HD1  ILE   3          3HD1      ILE   3   7.732  -3.789  -0.064
   36    H    ILE   4           H        ILE   4  12.513  -0.245   2.785
   37    HA   ILE   4           HA       ILE   4  15.109  -1.648   2.984
   38    HB   ILE   4           HB       ILE   4  14.616   0.950   4.374
   39   1HG1  ILE   4          2HG1      ILE   4  13.681   1.274   2.076
   40   2HG1  ILE   4          3HG1      ILE   4  15.134   2.230   2.351
   41   1HG2  ILE   4          1HG2      ILE   4  17.017   1.254   3.595
   42   2HG2  ILE   4          2HG2      ILE   4  16.754  -0.089   4.707
   43   3HG2  ILE   4          3HG2      ILE   4  16.944  -0.398   2.981
   44   1HD1  ILE   4          1HD1      ILE   4  16.488   0.695   1.094
   45   2HD1  ILE   4          2HD1      ILE   4  15.188  -0.493   1.027
   46   3HD1  ILE   4          3HD1      ILE   4  15.051   1.013   0.123
   47    H    SER   5           H        SER   5  12.115  -1.067   4.505
   48    HA   SER   5           HA       SER   5  12.651  -2.872   6.640
   49   1HB   SER   5          2HB       SER   5  12.007  -0.863   8.335
   50   2HB   SER   5          3HB       SER   5  13.664  -1.360   8.009
   51    HG   SER   5           HG       SER   5  13.690   0.242   6.347
   52    H    ILE   6           H        ILE   6  10.757  -3.684   7.419
   53    HA   ILE   6           HA       ILE   6   8.300  -2.604   6.243
   54    HB   ILE   6           HB       ILE   6   8.897  -5.217   7.646
   55   1HG1  ILE   6          2HG1      ILE   6   8.320  -6.117   5.361
   56   2HG1  ILE   6          3HG1      ILE   6   8.265  -4.458   4.775
   57   1HG2  ILE   6          1HG2      ILE   6   6.522  -5.744   6.734
   58   2HG2  ILE   6          2HG2      ILE   6   6.637  -4.783   8.206
   59   3HG2  ILE   6          3HG2      ILE   6   6.316  -3.996   6.660
   60   1HD1  ILE   6          1HD1      ILE   6  10.485  -5.860   4.558
   61   2HD1  ILE   6          2HD1      ILE   6  10.558  -4.157   5.004
   62   3HD1  ILE   6          3HD1      ILE   6  10.703  -5.400   6.246
   63    H    SER   7           H        SER   7   7.775  -0.854   7.505
   64    HA   SER   7           HA       SER   7   7.076   0.324   9.364
   65   1HB   SER   7          2HB       SER   7   5.085  -0.546  10.257
   66   2HB   SER   7          3HB       SER   7   5.190  -1.294   8.669
   67    HG   SER   7           HG       SER   7   6.519  -2.860  10.281
   68    H    GLU   8           H        GLU   8   6.202  -0.974  11.849
   69    HA   GLU   8           HA       GLU   8   8.830  -1.494  13.069
   70   1HB   GLU   8          2HB       GLU   8   6.378  -0.143  14.218
   71   2HB   GLU   8          3HB       GLU   8   7.838  -0.522  15.119
   72   1HG   GLU   8          2HG       GLU   8   9.171   0.945  13.785
   73   2HG   GLU   8          3HG       GLU   8   7.875   1.154  12.609
   74    H    THR   9           H        THR   9   7.054  -2.009  15.523
   75    HA   THR   9           HA       THR   9   6.258  -4.761  14.818
   76    HB   THR   9           HB       THR   9   7.474  -5.650  16.490
   77    HG1  THR   9           HG1      THR   9   6.154  -4.627  18.064
   78   1HG2  THR   9          1HG2      THR   9   9.557  -4.581  16.806
   79   2HG2  THR   9          2HG2      THR   9   8.984  -3.978  15.253
   80   3HG2  THR   9          3HG2      THR   9   8.840  -2.974  16.695
   81    HA   PRO  10           HA       PRO  10   3.396  -3.231  18.332
   82   1HB   PRO  10          2HB       PRO  10   3.371  -0.344  18.363
   83   2HB   PRO  10          3HB       PRO  10   3.838  -1.456  19.658
   84   1HG   PRO  10          2HG       PRO  10   5.546   0.207  18.252
   85   2HG   PRO  10          3HG       PRO  10   6.021  -1.179  19.241
   86   1HD   PRO  10          2HD       PRO  10   5.873  -0.945  16.289
   87   2HD   PRO  10          3HD       PRO  10   6.880  -2.010  17.294
   88    H    ASN  11           H        ASN  11   3.603  -2.646  15.196
   89    HA   ASN  11           HA       ASN  11   1.045  -1.258  14.816
   90   1HB   ASN  11          2HB       ASN  11   1.719  -1.717  12.337
   91   2HB   ASN  11          3HB       ASN  11   2.584  -0.483  13.248
   92   1HD2  ASN  11          2HD2      ASN  11   2.833  -4.079  12.877
   93   2HD2  ASN  11          1HD2      ASN  11   4.518  -4.070  12.675
   94    H    HIS  12           H        HIS  12  -0.428  -2.246  13.114
   95    HA   HIS  12           HA       HIS  12  -0.395  -5.050  12.652
   96   1HB   HIS  12          2HB       HIS  12  -0.911  -5.197  15.036
   97   2HB   HIS  12          3HB       HIS  12  -2.263  -4.084  14.832
   98    HD1  HIS  12           HD1      HIS  12  -4.419  -5.329  14.741
   99    HD2  HIS  12           HD2      HIS  12  -1.341  -7.482  12.938
  100    HE1  HIS  12           HE1      HIS  12  -5.454  -7.472  13.874
  101    H    ASN  13           H        ASN  13  -2.436  -2.177  13.074
  102    HA   ASN  13           HA       ASN  13  -4.291  -3.098  11.017
  103   1HB   ASN  13          2HB       ASN  13  -4.407  -0.362  12.226
  104   2HB   ASN  13          3HB       ASN  13  -5.724  -1.426  11.733
  105   1HD2  ASN  13          2HD2      ASN  13  -5.668  -3.640  13.106
  106   2HD2  ASN  13          1HD2      ASN  13  -5.461  -3.421  14.777
  107    H    THR  14           H        THR  14  -1.485  -1.129  11.276
  108    HA   THR  14           HA       THR  14  -1.673  -0.481   8.440
  109    HB   THR  14           HB       THR  14  -2.717   1.440   9.730
  110    HG1  THR  14           HG1      THR  14  -1.126   1.407   7.708
  111   1HG2  THR  14          1HG2      THR  14   0.099   2.166  10.511
  112   2HG2  THR  14          2HG2      THR  14  -1.422   2.803  11.134
  113   3HG2  THR  14          3HG2      THR  14  -0.895   1.183  11.588
  114    H    MET  15           H        MET  15   0.227  -0.839   7.507
  115    HA   MET  15           HA       MET  15   2.630  -0.965   9.223
  116   1HB   MET  15          2HB       MET  15   1.683  -2.548   6.887
  117   2HB   MET  15          3HB       MET  15   3.415  -2.227   6.979
  118   1HG   MET  15          2HG       MET  15   3.680  -3.421   8.948
  119   2HG   MET  15          3HG       MET  15   2.015  -3.153   9.457
  120   1HE   MET  15          1HE       MET  15   4.008  -4.335   6.527
  121   2HE   MET  15          2HE       MET  15   2.486  -4.374   5.640
  122   3HE   MET  15          3HE       MET  15   3.317  -5.880   6.017
  123    H    LYS  16           H        LYS  16   4.281   0.361   8.861
  124    HA   LYS  16           HA       LYS  16   4.046   2.339   6.715
  125   1HB   LYS  16          2HB       LYS  16   4.548   2.793   9.253
  126   2HB   LYS  16          3HB       LYS  16   6.198   2.364   8.803
  127   1HG   LYS  16          2HG       LYS  16   5.965   4.043   6.891
  128   2HG   LYS  16          3HG       LYS  16   4.492   4.598   7.688
  129   1HD   LYS  16          2HD       LYS  16   7.126   4.402   9.162
  130   2HD   LYS  16          3HD       LYS  16   6.665   5.850   8.268
  131   1HE   LYS  16          2HE       LYS  16   5.144   4.593  10.571
  132   2HE   LYS  16          3HE       LYS  16   5.999   6.133  10.589
  133   1HZ   LYS  16          1HZ       LYS  16   3.919   6.869  10.148
  134   2HZ   LYS  16          1HZ       LYS  16   3.442   5.437   9.366
  135   3HZ   LYS  16          3HZ       LYS  16   4.410   6.570   8.554
  136    H    ILE  17           H        ILE  17   5.149   2.095   4.868
  137    HA   ILE  17           HA       ILE  17   7.336   0.145   4.757
  138    HB   ILE  17           HB       ILE  17   6.031   1.674   2.492
  139   1HG1  ILE  17          2HG1      ILE  17   5.516  -1.156   3.462
  140   2HG1  ILE  17          3HG1      ILE  17   4.452   0.210   3.789
  141   1HG2  ILE  17          1HG2      ILE  17   7.771  -0.816   2.566
  142   2HG2  ILE  17          2HG2      ILE  17   7.042  -0.127   1.117
  143   3HG2  ILE  17          3HG2      ILE  17   8.281   0.772   1.994
  144   1HD1  ILE  17          1HD1      ILE  17   3.619  -1.016   1.847
  145   2HD1  ILE  17          2HD1      ILE  17   4.214   0.560   1.327
  146   3HD1  ILE  17          3HD1      ILE  17   5.190  -0.883   1.059
  147    H    THR  18           H        THR  18   9.386   0.707   4.752
  148    HA   THR  18           HA       THR  18  10.128   3.530   4.673
  149    HB   THR  18           HB       THR  18  12.035   1.222   4.993
  150    HG1  THR  18           HG1      THR  18  11.136   0.767   6.813
  151   1HG2  THR  18          1HG2      THR  18  13.141   2.925   6.489
  152   2HG2  THR  18          2HG2      THR  18  13.063   3.394   4.791
  153   3HG2  THR  18          3HG2      THR  18  11.935   4.096   5.951
  154    H    LEU  19           H        LEU  19  11.244   4.517   3.070
  155    HA   LEU  19           HA       LEU  19  11.909   2.885   0.689
  156   1HB   LEU  19          2HB       LEU  19  11.237   5.834   0.736
  157   2HB   LEU  19          3HB       LEU  19  11.435   4.809  -0.685
  158    HG   LEU  19           HG       LEU  19   9.290   4.470   1.438
  159   1HD1  LEU  19          1HD1      LEU  19   9.344   5.760  -1.278
  160   2HD1  LEU  19          2HD1      LEU  19   7.856   5.025  -0.683
  161   3HD1  LEU  19          3HD1      LEU  19   8.609   6.344   0.214
  162   1HD2  LEU  19          1HD2      LEU  19   8.377   2.954  -0.498
  163   2HD2  LEU  19          2HD2      LEU  19  10.057   2.924  -1.032
  164   3HD2  LEU  19          3HD2      LEU  19   9.628   2.313   0.566
  165    H    SER  20           H        SER  20  13.780   3.509  -0.529
  166    HA   SER  20           HA       SER  20  16.025   4.143   1.097
  167   1HB   SER  20          2HB       SER  20  17.329   3.840  -0.880
  168   2HB   SER  20          3HB       SER  20  16.028   2.656  -0.954
  169    HG   SER  20           HG       SER  20  14.900   4.434  -2.163
  170    H    GLU  21           H        GLU  21  13.679   6.149   0.089
  171    HA   GLU  21           HA       GLU  21  15.361   8.368  -0.766
  172   1HB   GLU  21          2HB       GLU  21  12.401   7.903  -0.540
  173   2HB   GLU  21          3HB       GLU  21  13.019   9.550  -0.645
  174   1HG   GLU  21          2HG       GLU  21  12.442   8.599  -2.880
  175   2HG   GLU  21          3HG       GLU  21  14.141   9.048  -2.752
  176    H    SER  22           H        SER  22  14.761  10.566   0.338
  177    HA   SER  22           HA       SER  22  14.242  10.348   3.198
  178   1HB   SER  22          2HB       SER  22  16.761   9.972   2.721
  179   2HB   SER  22          3HB       SER  22  16.794  11.688   2.332
  180    HG   SER  22           HG       SER  22  16.626  10.433   4.746
  181    H    ARG  23           H        ARG  23  12.404  11.637   2.604
  182    HA   ARG  23           HA       ARG  23  11.272  13.572   1.965
  183   1HB   ARG  23          2HB       ARG  23  11.915  15.476   3.440
  184   2HB   ARG  23          3HB       ARG  23  11.809  13.953   4.318
  185   1HG   ARG  23          2HG       ARG  23  14.201  13.689   4.318
  186   2HG   ARG  23          3HG       ARG  23  14.410  15.042   3.208
  187   1HD   ARG  23          2HD       ARG  23  13.612  16.605   4.890
  188   2HD   ARG  23          3HD       ARG  23  13.224  15.281   5.986
  189    HE   ARG  23           HE       ARG  23  15.882  16.339   5.408
  190   1HH1  ARG  23          1HH1      ARG  23  14.353  15.341   8.026
  191   2HH1  ARG  23          2HH1      ARG  23  15.426  14.064   8.491
  192   1HH2  ARG  23          1HH2      ARG  23  17.110  14.018   5.459
  193   2HH2  ARG  23          2HH2      ARG  23  16.977  13.301   7.029
  194    H    GLU  24           H        GLU  24  12.422  16.266   1.963
  195    HA   GLU  24           HA       GLU  24  13.013  17.702   0.228
  196   1HB   GLU  24          2HB       GLU  24  15.308  16.226   1.317
  197   2HB   GLU  24          3HB       GLU  24  15.625  16.923  -0.268
  198   1HG   GLU  24          2HG       GLU  24  16.232  18.585   1.352
  199   2HG   GLU  24          3HG       GLU  24  14.721  19.118   0.620
  200    H    GLY  25           H        GLY  25  11.689  15.286  -0.768
  201   1HA   GLY  25          1HA       GLY  25  12.319  15.549  -3.538
  202   2HA   GLY  25          2HA       GLY  25  12.932  14.027  -2.902
  203    H    MET  26           H        MET  26  10.990  13.305  -1.110
  204    HA   MET  26           HA       MET  26   8.785  12.591  -2.900
  205   1HB   MET  26          2HB       MET  26   9.587  11.614  -0.151
  206   2HB   MET  26          3HB       MET  26   8.157  11.047  -1.014
  207   1HG   MET  26          2HG       MET  26  10.963  10.915  -2.146
  208   2HG   MET  26          3HG       MET  26  10.184   9.577  -1.303
  209   1HE   MET  26          1HE       MET  26   8.335   8.126  -2.175
  210   2HE   MET  26          2HE       MET  26   9.920   7.787  -2.866
  211   3HE   MET  26          3HE       MET  26   8.491   7.735  -3.894
  212    H    THR  27           H        THR  27   7.082  13.894  -2.962
  213    HA   THR  27           HA       THR  27   6.479  15.790  -0.895
  214    HB   THR  27           HB       THR  27   4.557  15.017  -3.079
  215    HG1  THR  27           HG1      THR  27   5.749  16.324  -4.470
  216   1HG2  THR  27          1HG2      THR  27   5.333  17.786  -2.204
  217   2HG2  THR  27          2HG2      THR  27   3.806  17.222  -2.883
  218   3HG2  THR  27          3HG2      THR  27   4.225  16.835  -1.216
  219    H    SER  28           H        SER  28   3.476  15.017  -1.626
  220    HA   SER  28           HA       SER  28   3.074  12.683   0.040
  221   1HB   SER  28          2HB       SER  28   1.867  13.756   1.805
  222   2HB   SER  28          3HB       SER  28   3.395  14.614   1.650
  223    HG   SER  28           HG       SER  28   1.083  15.426   0.246
  224    H    ASP  29           H        ASP  29   1.247  11.651  -0.533
  225    HA   ASP  29           HA       ASP  29  -1.014  13.075  -1.665
  226   1HB   ASP  29          2HB       ASP  29   0.877  11.463  -3.323
  227   2HB   ASP  29          3HB       ASP  29  -0.845  11.338  -3.675
  228    H    THR  30           H        THR  30  -2.836  12.078  -1.097
  229    HA   THR  30           HA       THR  30  -2.641   9.373   0.040
  230    HB   THR  30           HB       THR  30  -3.718  10.646   1.631
  231    HG1  THR  30           HG1      THR  30  -6.048  10.328   1.255
  232   1HG2  THR  30          1HG2      THR  30  -4.920  12.179  -0.682
  233   2HG2  THR  30          2HG2      THR  30  -5.439  12.411   0.988
  234   3HG2  THR  30          3HG2      THR  30  -3.775  12.765   0.525
  235    H    TYR  31           H        TYR  31  -4.093   7.730  -0.548
  236    HA   TYR  31           HA       TYR  31  -5.575   8.158  -3.067
  237   1HB   TYR  31          2HB       TYR  31  -3.844   5.763  -2.387
  238   2HB   TYR  31          3HB       TYR  31  -4.856   5.921  -3.821
  239    HD1  TYR  31           HD1      TYR  31  -1.609   6.454  -2.495
  240    HD2  TYR  31           HD2      TYR  31  -4.452   8.088  -5.265
  241    HE1  TYR  31           HE1      TYR  31   0.221   7.654  -3.661
  242    HE2  TYR  31           HE2      TYR  31  -2.623   9.295  -6.430
  243    HH   TYR  31           HH       TYR  31  -0.090  10.142  -5.502
  244    H    THR  32           H        THR  32  -7.645   7.780  -2.713
  245    HA   THR  32           HA       THR  32  -8.403   5.688  -0.763
  246    HB   THR  32           HB       THR  32 -10.556   7.054  -0.558
  247    HG1  THR  32           HG1      THR  32 -10.241   9.272  -1.115
  248   1HG2  THR  32          1HG2      THR  32  -9.627   8.437   1.157
  249   2HG2  THR  32          2HG2      THR  32  -8.604   7.003   1.088
  250   3HG2  THR  32          3HG2      THR  32  -8.063   8.510   0.347
  251    H    LYS  33           H        LYS  33  -8.407   6.623  -3.995
  252    HA   LYS  33           HA       LYS  33 -10.077   4.387  -4.737
  253   1HB   LYS  33          2HB       LYS  33 -11.593   5.810  -6.166
  254   2HB   LYS  33          3HB       LYS  33 -11.853   5.965  -4.431
  255   1HG   LYS  33          2HG       LYS  33 -10.923   8.101  -4.338
  256   2HG   LYS  33          3HG       LYS  33  -9.941   7.847  -5.781
  257   1HD   LYS  33          2HD       LYS  33 -11.716   9.350  -6.404
  258   2HD   LYS  33          3HD       LYS  33 -12.095   7.784  -7.118
  259   1HE   LYS  33          2HE       LYS  33 -13.159   8.471  -4.388
  260   2HE   LYS  33          3HE       LYS  33 -13.972   9.091  -5.825
  261   1HZ   LYS  33          1HZ       LYS  33 -14.815   6.915  -5.002
  262   2HZ   LYS  33          1HZ       LYS  33 -13.321   6.226  -5.421
  263   3HZ   LYS  33          3HZ       LYS  33 -14.314   6.902  -6.621
  264    H    VAL  34           H        VAL  34  -7.426   4.685  -5.193
  265    HA   VAL  34           HA       VAL  34  -5.786   4.713  -6.797
  266    HB   VAL  34           HB       VAL  34  -8.144   4.216  -8.640
  267   1HG1  VAL  34          1HG1      VAL  34  -5.152   3.984  -8.958
  268   2HG1  VAL  34          2HG1      VAL  34  -6.231   2.950  -9.894
  269   3HG1  VAL  34          3HG1      VAL  34  -6.325   4.703 -10.061
  270   1HG2  VAL  34          1HG2      VAL  34  -7.857   2.607  -6.686
  271   2HG2  VAL  34          2HG2      VAL  34  -7.738   1.867  -8.282
  272   3HG2  VAL  34          3HG2      VAL  34  -6.276   2.201  -7.353
  273    H    ASP  35           H        ASP  35  -5.024   5.829  -8.855
  274    HA   ASP  35           HA       ASP  35  -6.419   8.215  -9.671
  275   1HB   ASP  35          2HB       ASP  35  -4.122   8.366  -7.751
  276   2HB   ASP  35          3HB       ASP  35  -4.297   9.618  -8.977
  277    H    ASP  36           H        ASP  36  -2.968   8.399  -9.649
  278    HA   ASP  36           HA       ASP  36  -2.441   6.889 -12.002
  279   1HB   ASP  36          2HB       ASP  36  -3.829   8.667 -13.029
  280   2HB   ASP  36          3HB       ASP  36  -2.701   9.874 -12.416
  281    H    SER  37           H        SER  37  -1.508   9.928 -10.365
  282    HA   SER  37           HA       SER  37   1.169  10.024 -11.017
  283   1HB   SER  37          2HB       SER  37   0.042  10.678  -8.288
  284   2HB   SER  37          3HB       SER  37   1.503  11.339  -9.016
  285    HG   SER  37           HG       SER  37  -0.809  11.556 -10.523
  286    H    GLN  38           H        GLN  38  -0.425   7.635  -9.203
  287    HA   GLN  38           HA       GLN  38   2.000   6.731  -7.829
  288   1HB   GLN  38          2HB       GLN  38   0.580   5.293  -6.597
  289   2HB   GLN  38          3HB       GLN  38  -0.361   6.769  -6.799
  290   1HG   GLN  38          2HG       GLN  38  -1.106   5.478  -9.046
  291   2HG   GLN  38          3HG       GLN  38  -0.772   4.088  -8.019
  292   1HE2  GLN  38          2HE2      GLN  38  -1.607   5.173  -5.498
  293   2HE2  GLN  38          1HE2      GLN  38  -3.281   5.439  -5.569
  294    HA   PRO  39           HA       PRO  39   3.160   3.833 -10.953
  295   1HB   PRO  39          2HB       PRO  39   3.679   1.688  -9.106
  296   2HB   PRO  39          3HB       PRO  39   4.852   2.745  -9.898
  297   1HG   PRO  39          2HG       PRO  39   3.966   2.762  -7.170
  298   2HG   PRO  39          3HG       PRO  39   5.244   3.715  -7.931
  299   1HD   PRO  39          2HD       PRO  39   2.746   4.669  -7.021
  300   2HD   PRO  39          3HD       PRO  39   3.923   5.557  -8.006
  301    H    ALA  40           H        ALA  40   2.009   2.350 -12.189
  302    HA   ALA  40           HA       ALA  40  -0.614   1.695 -11.699
  303   1HB   ALA  40          1HB       ALA  40   0.615   1.325 -13.859
  304   2HB   ALA  40          2HB       ALA  40   1.325  -0.123 -13.142
  305   3HB   ALA  40          3HB       ALA  40  -0.420  -0.023 -13.382
  306    H    PHE  41           H        PHE  41   2.290  -0.020 -10.733
  307    HA   PHE  41           HA       PHE  41   1.195  -2.365  -9.703
  308   1HB   PHE  41          2HB       PHE  41   3.519  -0.953  -8.412
  309   2HB   PHE  41          3HB       PHE  41   3.263  -2.683  -8.632
  310    HD1  PHE  41           HD1      PHE  41   2.620  -3.098 -11.368
  311    HD2  PHE  41           HD2      PHE  41   5.316  -0.197  -9.698
  312    HE1  PHE  41           HE1      PHE  41   3.845  -2.994 -13.521
  313    HE2  PHE  41           HE2      PHE  41   6.541  -0.100 -11.855
  314    HZ   PHE  41           HZ       PHE  41   5.805  -1.498 -13.764
  315    H    ILE  42           H        ILE  42   1.297   0.874  -8.324
  316    HA   ILE  42           HA       ILE  42   0.536   0.031  -5.671
  317    HB   ILE  42           HB       ILE  42   0.935   2.655  -7.052
  318   1HG1  ILE  42          2HG1      ILE  42   2.674   1.270  -5.728
  319   2HG1  ILE  42          3HG1      ILE  42   2.547   2.987  -5.362
  320   1HG2  ILE  42          1HG2      ILE  42   0.106   3.765  -4.904
  321   2HG2  ILE  42          2HG2      ILE  42  -1.143   3.148  -5.985
  322   3HG2  ILE  42          3HG2      ILE  42  -0.701   2.240  -4.540
  323   1HD1  ILE  42          1HD1      ILE  42   1.673   2.618  -3.280
  324   2HD1  ILE  42          2HD1      ILE  42   0.779   1.186  -3.793
  325   3HD1  ILE  42          3HD1      ILE  42   2.506   1.074  -3.456
  326    H    ASN  43           H        ASN  43  -1.120   0.817  -8.625
  327    HA   ASN  43           HA       ASN  43  -3.649   1.491  -7.556
  328   1HB   ASN  43          2HB       ASN  43  -2.961   0.117 -10.168
  329   2HB   ASN  43          3HB       ASN  43  -4.516   0.831  -9.770
  330   1HD2  ASN  43          2HD2      ASN  43  -2.858   3.020  -8.240
  331   2HD2  ASN  43          1HD2      ASN  43  -2.393   4.071  -9.488
  332    H    ASP  44           H        ASP  44  -2.082  -1.578  -8.364
  333    HA   ASP  44           HA       ASP  44  -4.273  -3.290  -7.974
  334   1HB   ASP  44          2HB       ASP  44  -1.945  -3.867  -8.882
  335   2HB   ASP  44          3HB       ASP  44  -1.441  -3.986  -7.196
  336    H    ILE  45           H        ILE  45  -1.749  -2.262  -5.669
  337    HA   ILE  45           HA       ILE  45  -2.529  -3.556  -3.384
  338    HB   ILE  45           HB       ILE  45  -1.592  -0.682  -3.630
  339   1HG1  ILE  45          2HG1      ILE  45  -0.105  -3.292  -3.180
  340   2HG1  ILE  45          3HG1      ILE  45  -0.057  -2.316  -4.647
  341   1HG2  ILE  45          1HG2      ILE  45  -0.876  -0.919  -1.302
  342   2HG2  ILE  45          2HG2      ILE  45  -2.610  -1.209  -1.416
  343   3HG2  ILE  45          3HG2      ILE  45  -1.498  -2.569  -1.254
  344   1HD1  ILE  45          1HD1      ILE  45   0.558  -0.642  -2.383
  345   2HD1  ILE  45          2HD1      ILE  45   1.592  -2.069  -2.348
  346   3HD1  ILE  45          3HD1      ILE  45   1.572  -1.030  -3.772
  347    H    LEU  46           H        LEU  46  -3.741  -0.386  -4.480
  348    HA   LEU  46           HA       LEU  46  -5.668  -0.058  -2.446
  349   1HB   LEU  46          2HB       LEU  46  -5.528   1.051  -5.260
  350   2HB   LEU  46          3HB       LEU  46  -6.725   1.555  -4.066
  351    HG   LEU  46           HG       LEU  46  -3.795   1.609  -3.375
  352   1HD1  LEU  46          1HD1      LEU  46  -3.735   3.966  -4.127
  353   2HD1  LEU  46          2HD1      LEU  46  -3.999   2.865  -5.478
  354   3HD1  LEU  46          3HD1      LEU  46  -5.350   3.782  -4.809
  355   1HD2  LEU  46          1HD2      LEU  46  -5.358   1.948  -1.544
  356   2HD2  LEU  46          2HD2      LEU  46  -4.627   3.505  -1.933
  357   3HD2  LEU  46          3HD2      LEU  46  -6.264   3.136  -2.481
  358    H    LYS  47           H        LYS  47  -5.784  -1.614  -5.609
  359    HA   LYS  47           HA       LYS  47  -8.614  -2.225  -5.375
  360   1HB   LYS  47          2HB       LYS  47  -6.500  -2.893  -7.426
  361   2HB   LYS  47          3HB       LYS  47  -8.152  -3.503  -7.522
  362   1HG   LYS  47          2HG       LYS  47  -8.914  -1.066  -7.310
  363   2HG   LYS  47          3HG       LYS  47  -7.235  -0.618  -7.597
  364   1HD   LYS  47          2HD       LYS  47  -7.833  -0.664  -9.794
  365   2HD   LYS  47          3HD       LYS  47  -7.651  -2.410  -9.624
  366   1HE   LYS  47          2HE       LYS  47 -10.121  -2.399  -8.848
  367   2HE   LYS  47          3HE       LYS  47 -10.188  -0.774  -9.530
  368   1HZ   LYS  47          1HZ       LYS  47  -9.097  -2.992 -11.128
  369   2HZ   LYS  47          1HZ       LYS  47  -9.823  -1.548 -11.651
  370   3HZ   LYS  47          3HZ       LYS  47 -10.776  -2.795 -11.002
  371    H    VAL  48           H        VAL  48  -5.801  -3.557  -4.113
  372    HA   VAL  48           HA       VAL  48  -6.535  -6.346  -4.334
  373    HB   VAL  48           HB       VAL  48  -4.333  -4.824  -2.976
  374   1HG1  VAL  48          1HG1      VAL  48  -5.204  -7.660  -2.379
  375   2HG1  VAL  48          2HG1      VAL  48  -3.546  -7.116  -2.133
  376   3HG1  VAL  48          3HG1      VAL  48  -4.862  -6.365  -1.231
  377   1HG2  VAL  48          1HG2      VAL  48  -4.358  -5.723  -5.411
  378   2HG2  VAL  48          2HG2      VAL  48  -2.947  -6.086  -4.418
  379   3HG2  VAL  48          3HG2      VAL  48  -4.184  -7.314  -4.673
  380    H    GLU  49           H        GLU  49  -8.055  -7.284  -3.165
  381    HA   GLU  49           HA       GLU  49  -9.564  -6.089  -1.165
  382   1HB   GLU  49          2HB       GLU  49  -9.042  -8.992  -1.808
  383   2HB   GLU  49          3HB       GLU  49 -10.151  -8.502  -0.528
  384   1HG   GLU  49          2HG       GLU  49 -11.424  -8.839  -2.577
  385   2HG   GLU  49          3HG       GLU  49 -11.402  -7.118  -2.197
  386    H    GLY  50           H        GLY  50  -9.204  -5.607   0.901
  387   1HA   GLY  50          1HA       GLY  50  -8.453  -6.609   3.090
  388   2HA   GLY  50          2HA       GLY  50  -6.910  -6.871   2.283
  389    H    VAL  51           H        VAL  51  -6.816  -4.439   0.823
  390    HA   VAL  51           HA       VAL  51  -5.861  -2.669   2.904
  391    HB   VAL  51           HB       VAL  51  -6.034  -2.086  -0.058
  392   1HG1  VAL  51          1HG1      VAL  51  -4.110  -1.151   2.099
  393   2HG1  VAL  51          2HG1      VAL  51  -4.132  -0.619   0.417
  394   3HG1  VAL  51          3HG1      VAL  51  -5.469  -0.207   1.489
  395   1HG2  VAL  51          1HG2      VAL  51  -3.654  -2.977  -0.082
  396   2HG2  VAL  51          2HG2      VAL  51  -3.969  -3.655   1.515
  397   3HG2  VAL  51          3HG2      VAL  51  -4.901  -4.205   0.121
  398    H    LYS  52           H        LYS  52  -6.596  -0.593   3.354
  399    HA   LYS  52           HA       LYS  52  -9.389  -0.056   2.552
  400   1HB   LYS  52          2HB       LYS  52  -9.040  -0.415   4.968
  401   2HB   LYS  52          3HB       LYS  52  -7.870   0.905   4.992
  402   1HG   LYS  52          2HG       LYS  52  -9.660   2.445   4.156
  403   2HG   LYS  52          3HG       LYS  52 -10.817   1.119   4.289
  404   1HD   LYS  52          2HD       LYS  52  -9.126   1.897   6.658
  405   2HD   LYS  52          3HD       LYS  52 -10.592   2.801   6.279
  406   1HE   LYS  52          2HE       LYS  52 -10.837  -0.165   6.274
  407   2HE   LYS  52          3HE       LYS  52 -10.601   0.598   7.845
  408   1HZ   LYS  52          1HZ       LYS  52 -12.494   1.961   7.510
  409   2HZ   LYS  52          1HZ       LYS  52 -12.961   0.368   7.143
  410   3HZ   LYS  52          3HZ       LYS  52 -12.653   1.476   5.892
  411    H    SER  53           H        SER  53  -6.156   1.332   2.852
  412    HA   SER  53           HA       SER  53  -6.607   3.233   0.784
  413   1HB   SER  53          2HB       SER  53  -7.945   4.357   2.542
  414   2HB   SER  53          3HB       SER  53  -6.539   4.365   3.598
  415    HG   SER  53           HG       SER  53  -5.812   6.025   2.550
  416    H    ILE  54           H        ILE  54  -4.777   5.022   0.945
  417    HA   ILE  54           HA       ILE  54  -2.335   3.987   2.190
  418    HB   ILE  54           HB       ILE  54  -2.509   4.535  -0.789
  419   1HG1  ILE  54          2HG1      ILE  54  -2.027   1.946   0.729
  420   2HG1  ILE  54          3HG1      ILE  54  -3.532   2.372  -0.084
  421   1HG2  ILE  54          1HG2      ILE  54  -0.226   3.722   1.041
  422   2HG2  ILE  54          2HG2      ILE  54  -0.141   3.664  -0.721
  423   3HG2  ILE  54          3HG2      ILE  54  -0.352   5.210   0.101
  424   1HD1  ILE  54          1HD1      ILE  54  -0.833   1.840  -1.326
  425   2HD1  ILE  54          2HD1      ILE  54  -2.363   1.025  -1.648
  426   3HD1  ILE  54          3HD1      ILE  54  -2.115   2.678  -2.202
  427    H    PHE  55           H        PHE  55  -0.933   5.580   2.765
  428    HA   PHE  55           HA       PHE  55  -1.552   8.337   1.877
  429   1HB   PHE  55          2HB       PHE  55  -2.385   8.126   4.131
  430   2HB   PHE  55          3HB       PHE  55  -0.894   7.351   4.665
  431    HD1  PHE  55           HD1      PHE  55   0.457   8.735   5.962
  432    HD2  PHE  55           HD2      PHE  55  -1.758  10.450   2.702
  433    HE1  PHE  55           HE1      PHE  55   1.436  10.956   6.464
  434    HE2  PHE  55           HE2      PHE  55  -0.775  12.667   3.205
  435    HZ   PHE  55           HZ       PHE  55   0.823  12.921   5.083
  436    H    HIS  56           H        HIS  56   0.106   9.006   0.683
  437    HA   HIS  56           HA       HIS  56   2.804   7.989   1.207
  438   1HB   HIS  56          2HB       HIS  56   2.073   7.955  -1.109
  439   2HB   HIS  56          3HB       HIS  56   1.682   9.673  -1.043
  440    HD1  HIS  56           HD1      HIS  56   3.441  10.292  -2.852
  441    HD2  HIS  56           HD2      HIS  56   5.078   8.435   0.500
  442    HE1  HIS  56           HE1      HIS  56   5.949  10.617  -3.004
  443    H    VAL  57           H        VAL  57   4.355   9.146   2.150
  444    HA   VAL  57           HA       VAL  57   4.433  12.017   2.108
  445    HB   VAL  57           HB       VAL  57   2.706  11.315   3.936
  446   1HG1  VAL  57          1HG1      VAL  57   4.315   9.576   4.870
  447   2HG1  VAL  57          2HG1      VAL  57   5.274  10.922   5.487
  448   3HG1  VAL  57          3HG1      VAL  57   3.623  10.683   6.056
  449   1HG2  VAL  57          1HG2      VAL  57   5.036  13.202   4.341
  450   2HG2  VAL  57          2HG2      VAL  57   3.411  13.590   3.777
  451   3HG2  VAL  57          3HG2      VAL  57   3.674  13.129   5.458
  452    H    MET  58           H        MET  58   6.401  12.837   3.103
  453    HA   MET  58           HA       MET  58   8.710  12.691   3.196
  454   1HB   MET  58          2HB       MET  58   7.606  11.936   5.523
  455   2HB   MET  58          3HB       MET  58   8.460  10.444   5.135
  456   1HG   MET  58          2HG       MET  58  10.561  11.661   4.901
  457   2HG   MET  58          3HG       MET  58   9.733  13.195   5.153
  458   1HE   MET  58          1HE       MET  58  12.231  12.600   6.925
  459   2HE   MET  58          2HE       MET  58  11.557  13.215   8.432
  460   3HE   MET  58          3HE       MET  58  11.154  14.004   6.910
  461    H    ASP  59           H        ASP  59   9.949  10.038   4.150
  462    HA   ASP  59           HA       ASP  59  10.171   8.876   1.455
  463   1HB   ASP  59          2HB       ASP  59  12.230   7.822   2.324
  464   2HB   ASP  59          3HB       ASP  59  12.271   9.577   2.451
  465    H    PHE  60           H        PHE  60   7.917   8.331   3.342
  466    HA   PHE  60           HA       PHE  60   8.122   5.411   3.222
  467   1HB   PHE  60          2HB       PHE  60   7.494   5.041   5.484
  468   2HB   PHE  60          3HB       PHE  60   8.801   6.220   5.542
  469    HD1  PHE  60           HD1      PHE  60   8.461   8.393   6.460
  470    HD2  PHE  60           HD2      PHE  60   5.088   5.858   5.636
  471    HE1  PHE  60           HE1      PHE  60   6.974   9.964   7.673
  472    HE2  PHE  60           HE2      PHE  60   3.610   7.433   6.846
  473    HZ   PHE  60           HZ       PHE  60   4.552   9.483   7.869
  474    H    ILE  61           H        ILE  61   5.954   4.387   3.764
  475    HA   ILE  61           HA       ILE  61   3.695   6.124   3.009
  476    HB   ILE  61           HB       ILE  61   4.113   3.378   1.813
  477   1HG1  ILE  61          2HG1      ILE  61   4.711   6.089   0.568
  478   2HG1  ILE  61          3HG1      ILE  61   5.929   4.925   1.082
  479   1HG2  ILE  61          1HG2      ILE  61   2.334   5.706   1.021
  480   2HG2  ILE  61          2HG2      ILE  61   2.342   4.101   0.292
  481   3HG2  ILE  61          3HG2      ILE  61   1.796   4.313   1.956
  482   1HD1  ILE  61          1HD1      ILE  61   3.854   4.547  -1.093
  483   2HD1  ILE  61          2HD1      ILE  61   5.601   4.651  -1.298
  484   3HD1  ILE  61          3HD1      ILE  61   4.891   3.252  -0.491
  485    H    SER  62           H        SER  62   1.832   5.689   4.079
  486    HA   SER  62           HA       SER  62   1.922   3.518   6.063
  487   1HB   SER  62          2HB       SER  62  -0.252   5.544   6.114
  488   2HB   SER  62          3HB       SER  62   0.640   4.813   7.446
  489    HG   SER  62           HG       SER  62   1.519   6.820   5.642
  490    H    VAL  63           H        VAL  63   1.033   1.691   5.356
  491    HA   VAL  63           HA       VAL  63  -1.287   1.797   3.549
  492    HB   VAL  63           HB       VAL  63   0.424  -0.561   4.405
  493   1HG1  VAL  63          1HG1      VAL  63  -1.801  -1.266   3.694
  494   2HG1  VAL  63          2HG1      VAL  63  -1.704  -0.242   2.261
  495   3HG1  VAL  63          3HG1      VAL  63  -0.647  -1.644   2.415
  496   1HG2  VAL  63          1HG2      VAL  63   0.436   1.098   1.861
  497   2HG2  VAL  63          2HG2      VAL  63   1.701   1.086   3.090
  498   3HG2  VAL  63          3HG2      VAL  63   1.391  -0.360   2.131
  499    H    ASP  64           H        ASP  64  -3.220   1.846   4.568
  500    HA   ASP  64           HA       ASP  64  -3.451   0.380   7.122
  501   1HB   ASP  64          2HB       ASP  64  -5.364   1.752   7.648
  502   2HB   ASP  64          3HB       ASP  64  -4.042   2.807   7.166
  503    H    LYS  65           H        LYS  65  -4.751  -1.306   7.347
  504    HA   LYS  65           HA       LYS  65  -6.471  -2.055   5.059
  505   1HB   LYS  65          2HB       LYS  65  -5.981  -4.430   5.689
  506   2HB   LYS  65          3HB       LYS  65  -4.568  -3.549   5.110
  507   1HG   LYS  65          2HG       LYS  65  -3.685  -3.307   7.301
  508   2HG   LYS  65          3HG       LYS  65  -5.225  -3.717   8.056
  509   1HD   LYS  65          2HD       LYS  65  -4.957  -6.012   6.868
  510   2HD   LYS  65          3HD       LYS  65  -3.269  -5.545   6.666
  511   1HE   LYS  65          2HE       LYS  65  -3.051  -5.236   9.097
  512   2HE   LYS  65          3HE       LYS  65  -4.744  -5.670   9.314
  513   1HZ   LYS  65          1HZ       LYS  65  -3.061  -7.497   9.663
  514   2HZ   LYS  65          1HZ       LYS  65  -2.805  -7.473   7.983
  515   3HZ   LYS  65          3HZ       LYS  65  -4.339  -7.854   8.607
  516    H    GLU  66           H        GLU  66  -7.834  -4.110   6.035
  517    HA   GLU  66           HA       GLU  66  -9.425  -2.883   8.174
  518   1HB   GLU  66          2HB       GLU  66 -10.187  -5.352   6.623
  519   2HB   GLU  66          3HB       GLU  66 -11.236  -4.172   7.411
  520   1HG   GLU  66          2HG       GLU  66 -10.553  -2.462   5.758
  521   2HG   GLU  66          3HG       GLU  66  -9.513  -3.645   4.968
  522    H    ASN  67           H        ASN  67  -9.354  -3.647  10.198
  523    HA   ASN  67           HA       ASN  67  -7.525  -5.432  11.188
  524   1HB   ASN  67          2HB       ASN  67  -9.030  -3.906  12.514
  525   2HB   ASN  67          3HB       ASN  67 -10.312  -5.097  12.311
  526   1HD2  ASN  67          2HD2      ASN  67  -6.793  -5.572  13.007
  527   2HD2  ASN  67          1HD2      ASN  67  -7.056  -6.442  14.442
  528    H    ASP  68           H        ASP  68 -10.478  -6.119   9.530
  529    HA   ASP  68           HA       ASP  68 -10.847  -8.812  10.370
  530   1HB   ASP  68          2HB       ASP  68 -11.708  -7.411   7.832
  531   2HB   ASP  68          3HB       ASP  68 -12.314  -8.966   8.392
  532    H    ALA  69           H        ALA  69  -8.991  -7.294   7.782
  533    HA   ALA  69           HA       ALA  69  -8.269  -9.862   6.612
  534   1HB   ALA  69          1HB       ALA  69  -7.633  -6.994   5.947
  535   2HB   ALA  69          2HB       ALA  69  -6.799  -8.332   5.157
  536   3HB   ALA  69          3HB       ALA  69  -8.548  -8.164   4.998
  537    H    ASN  70           H        ASN  70  -5.970 -10.390   6.243
  538    HA   ASN  70           HA       ASN  70  -4.334  -9.704   8.609
  539   1HB   ASN  70          2HB       ASN  70  -3.915 -12.133   6.882
  540   2HB   ASN  70          3HB       ASN  70  -3.418 -11.870   8.552
  541   1HD2  ASN  70          2HD2      ASN  70  -4.802 -12.726  10.129
  542   2HD2  ASN  70          1HD2      ASN  70  -6.404 -13.210   9.841
  543    H    TRP  71           H        TRP  71  -1.898 -10.086   8.112
  544    HA   TRP  71           HA       TRP  71  -1.239  -8.406   5.805
  545   1HB   TRP  71          2HB       TRP  71   0.209  -9.252   8.294
  546   2HB   TRP  71          3HB       TRP  71   1.112  -8.623   6.918
  547    HD1  TRP  71           HD1      TRP  71  -0.442  -7.464   9.953
  548    HE1  TRP  71           HE1      TRP  71  -0.973  -4.945   9.859
  549    HE3  TRP  71           HE3      TRP  71   0.043  -6.645   4.935
  550    HZ2  TRP  71           HZ2      TRP  71  -1.181  -2.859   7.913
  551    HZ3  TRP  71           HZ3      TRP  71  -0.329  -4.383   3.989
  552    HH2  TRP  71           HH2      TRP  71  -0.937  -2.492   5.472
  553    H    GLU  72           H        GLU  72  -0.263 -11.535   7.202
  554    HA   GLU  72           HA       GLU  72   1.609 -12.349   5.351
  555   1HB   GLU  72          2HB       GLU  72   0.870 -14.691   5.924
  556   2HB   GLU  72          3HB       GLU  72   1.222 -13.664   7.312
  557   1HG   GLU  72          2HG       GLU  72  -1.096 -13.289   7.750
  558   2HG   GLU  72          3HG       GLU  72  -1.572 -13.967   6.194
  559    H    THR  73           H        THR  73  -1.806 -12.004   4.872
  560    HA   THR  73           HA       THR  73  -1.820 -13.668   2.470
  561    HB   THR  73           HB       THR  73  -3.759 -13.499   4.153
  562    HG1  THR  73           HG1      THR  73  -5.244 -13.654   2.421
  563   1HG2  THR  73          1HG2      THR  73  -5.278 -11.661   3.930
  564   2HG2  THR  73          2HG2      THR  73  -3.682 -10.955   4.169
  565   3HG2  THR  73          3HG2      THR  73  -4.392 -11.006   2.555
  566    H    VAL  74           H        VAL  74  -2.166 -10.285   3.396
  567    HA   VAL  74           HA       VAL  74  -2.404  -9.342   0.695
  568    HB   VAL  74           HB       VAL  74  -2.598  -8.269   3.396
  569   1HG1  VAL  74          1HG1      VAL  74  -1.959  -5.954   2.798
  570   2HG1  VAL  74          2HG1      VAL  74  -0.568  -7.036   2.781
  571   3HG1  VAL  74          3HG1      VAL  74  -1.318  -6.537   1.264
  572   1HG2  VAL  74          1HG2      VAL  74  -4.215  -6.790   2.266
  573   2HG2  VAL  74          2HG2      VAL  74  -3.638  -7.354   0.699
  574   3HG2  VAL  74          3HG2      VAL  74  -4.459  -8.471   1.791
  575    H    LEU  75           H        LEU  75   0.208  -9.566   3.073
  576    HA   LEU  75           HA       LEU  75   2.140  -7.962   1.966
  577   1HB   LEU  75          2HB       LEU  75   2.104 -10.186   3.799
  578   2HB   LEU  75          3HB       LEU  75   3.517 -10.292   2.754
  579    HG   LEU  75           HG       LEU  75   2.735  -7.710   4.117
  580   1HD1  LEU  75          1HD1      LEU  75   4.393  -8.280   5.860
  581   2HD1  LEU  75          2HD1      LEU  75   3.069  -9.445   5.847
  582   3HD1  LEU  75          3HD1      LEU  75   4.622  -9.866   5.123
  583   1HD2  LEU  75          1HD2      LEU  75   5.347  -8.790   2.999
  584   2HD2  LEU  75          2HD2      LEU  75   4.314  -7.601   2.208
  585   3HD2  LEU  75          3HD2      LEU  75   5.125  -7.196   3.722
  586    HA   PRO  76           HA       PRO  76   3.745 -11.769  -0.762
  587   1HB   PRO  76          2HB       PRO  76   1.294 -13.062  -1.559
  588   2HB   PRO  76          3HB       PRO  76   2.692 -13.767  -0.731
  589   1HG   PRO  76          2HG       PRO  76   0.138 -12.878   0.361
  590   2HG   PRO  76          3HG       PRO  76   1.354 -13.951   1.066
  591   1HD   PRO  76          2HD       PRO  76   0.881 -11.420   1.995
  592   2HD   PRO  76          3HD       PRO  76   2.463 -12.219   2.125
  593    H    LYS  77           H        LYS  77   0.665 -10.072  -1.082
  594    HA   LYS  77           HA       LYS  77   0.912  -9.781  -3.962
  595   1HB   LYS  77          2HB       LYS  77  -1.032  -8.876  -1.868
  596   2HB   LYS  77          3HB       LYS  77  -1.010  -8.054  -3.426
  597   1HG   LYS  77          2HG       LYS  77  -1.668  -9.955  -4.597
  598   2HG   LYS  77          3HG       LYS  77  -1.044 -11.056  -3.368
  599   1HD   LYS  77          2HD       LYS  77  -2.857 -10.278  -1.823
  600   2HD   LYS  77          3HD       LYS  77  -3.516  -9.312  -3.144
  601   1HE   LYS  77          2HE       LYS  77  -3.009 -12.257  -3.535
  602   2HE   LYS  77          3HE       LYS  77  -4.485 -11.709  -2.738
  603   1HZ   LYS  77          1HZ       LYS  77  -4.499 -12.001  -5.269
  604   2HZ   LYS  77          1HZ       LYS  77  -3.635 -10.539  -5.310
  605   3HZ   LYS  77          3HZ       LYS  77  -5.188 -10.592  -4.622
  606    H    VAL  78           H        VAL  78   1.370  -7.798  -1.059
  607    HA   VAL  78           HA       VAL  78   1.901  -5.325  -2.255
  608    HB   VAL  78           HB       VAL  78   3.039  -6.518   0.290
  609   1HG1  VAL  78          1HG1      VAL  78   4.478  -4.711  -0.238
  610   2HG1  VAL  78          2HG1      VAL  78   3.161  -3.736  -0.890
  611   3HG1  VAL  78          3HG1      VAL  78   3.284  -4.005   0.850
  612   1HG2  VAL  78          1HG2      VAL  78   1.262  -4.751   1.154
  613   2HG2  VAL  78          2HG2      VAL  78   0.548  -5.003  -0.439
  614   3HG2  VAL  78          3HG2      VAL  78   0.749  -6.364   0.667
  615    H    GLU  79           H        GLU  79   4.252  -7.825  -1.231
  616    HA   GLU  79           HA       GLU  79   6.581  -6.587  -2.073
  617   1HB   GLU  79          2HB       GLU  79   6.383  -8.771  -0.816
  618   2HB   GLU  79          3HB       GLU  79   6.046  -9.549  -2.361
  619   1HG   GLU  79          2HG       GLU  79   8.196  -8.943  -3.239
  620   2HG   GLU  79          3HG       GLU  79   8.510  -7.849  -1.893
  621    H    ALA  80           H        ALA  80   4.295  -8.509  -3.960
  622    HA   ALA  80           HA       ALA  80   5.664  -8.766  -6.357
  623   1HB   ALA  80          1HB       ALA  80   3.611  -9.294  -7.323
  624   2HB   ALA  80          2HB       ALA  80   3.301  -9.613  -5.617
  625   3HB   ALA  80          3HB       ALA  80   2.733  -8.114  -6.350
  626    H    VAL  81           H        VAL  81   4.002  -5.973  -5.032
  627    HA   VAL  81           HA       VAL  81   3.808  -4.377  -7.329
  628    HB   VAL  81           HB       VAL  81   4.329  -3.443  -4.493
  629   1HG1  VAL  81          1HG1      VAL  81   2.672  -2.034  -6.570
  630   2HG1  VAL  81          2HG1      VAL  81   3.471  -1.365  -5.150
  631   3HG1  VAL  81          3HG1      VAL  81   4.422  -1.834  -6.559
  632   1HG2  VAL  81          1HG2      VAL  81   1.922  -3.474  -4.197
  633   2HG2  VAL  81          2HG2      VAL  81   1.673  -3.968  -5.871
  634   3HG2  VAL  81          3HG2      VAL  81   2.422  -5.077  -4.722
  635    H    PHE  82           H        PHE  82   6.296  -4.097  -4.767
  636    HA   PHE  82           HA       PHE  82   8.040  -2.624  -6.563
  637   1HB   PHE  82          2HB       PHE  82   8.931  -3.609  -3.878
  638   2HB   PHE  82          3HB       PHE  82   9.292  -2.086  -4.691
  639    HD1  PHE  82           HD1      PHE  82   7.119  -3.779  -2.364
  640    HD2  PHE  82           HD2      PHE  82   7.404  -0.375  -4.972
  641    HE1  PHE  82           HE1      PHE  82   5.254  -2.689  -1.148
  642    HE2  PHE  82           HE2      PHE  82   5.538   0.710  -3.756
  643    HZ   PHE  82           HZ       PHE  82   4.463  -0.448  -1.846
  644    H    GLU  83           H        GLU  83   7.347  -5.539  -7.022
  645    HA   GLU  83           HA       GLU  83  10.031  -6.388  -7.704
  646   1HB   GLU  83          2HB       GLU  83   8.345  -8.016  -5.783
  647   2HB   GLU  83          3HB       GLU  83   9.791  -8.604  -6.597
  648   1HG   GLU  83          2HG       GLU  83  11.014  -6.605  -5.550
  649   2HG   GLU  83          3HG       GLU  83   9.587  -6.396  -4.538
  650    H    LEU  84           H        LEU  84   9.392  -6.385  -9.818
  651    HA   LEU  84           HA       LEU  84   7.940  -8.705 -10.713
  652   1HB   LEU  84          2HB       LEU  84   6.467  -6.990 -12.194
  653   2HB   LEU  84          3HB       LEU  84   5.918  -7.665 -10.670
  654    HG   LEU  84           HG       LEU  84   6.788  -5.664  -9.479
  655   1HD1  LEU  84          1HD1      LEU  84   7.555  -3.722 -10.700
  656   2HD1  LEU  84          2HD1      LEU  84   8.535  -5.095 -11.210
  657   3HD1  LEU  84          3HD1      LEU  84   7.236  -4.508 -12.246
  658   1HD2  LEU  84          1HD2      LEU  84   4.427  -5.888 -10.514
  659   2HD2  LEU  84          2HD2      LEU  84   4.960  -4.275 -10.042
  660   3HD2  LEU  84          3HD2      LEU  84   5.003  -4.756 -11.738
  661    H    GLU  85           H        GLU  85   7.740  -6.082 -12.902
  662    HA   GLU  85           HA       GLU  85   8.740  -5.825 -14.965
  663   1HB   GLU  85          2HB       GLU  85  10.978  -5.764 -12.953
  664   2HB   GLU  85          3HB       GLU  85  11.318  -5.568 -14.672
  665   1HG   GLU  85          2HG       GLU  85   9.247  -3.907 -13.217
  666   2HG   GLU  85          3HG       GLU  85  10.929  -3.409 -13.383
  667    H    HIS  86           H        HIS  86  11.218  -6.719 -15.941
  668    HA   HIS  86           HA       HIS  86  10.533  -9.448 -16.609
  669   1HB   HIS  86          2HB       HIS  86  12.944  -7.784 -17.396
  670   2HB   HIS  86          3HB       HIS  86  12.487  -9.332 -18.105
  671    HD1  HIS  86           HD1      HIS  86  11.338  -8.985 -20.288
  672    HD2  HIS  86           HD2      HIS  86  10.388  -5.966 -17.573
  673    HE1  HIS  86           HE1      HIS  86   9.711  -7.440 -21.469
  674    H    HIS  87           H        HIS  87  11.807 -11.295 -16.185
  675    HA   HIS  87           HA       HIS  87  13.194 -11.203 -13.638
  676   1HB   HIS  87          2HB       HIS  87  11.677 -13.071 -14.178
  677   2HB   HIS  87          3HB       HIS  87  12.708 -13.515 -15.538
  678    HD1  HIS  87           HD1      HIS  87  15.459 -13.583 -14.527
  679    HD2  HIS  87           HD2      HIS  87  12.285 -14.737 -12.081
  680    HE1  HIS  87           HE1      HIS  87  16.449 -15.038 -12.709
  681    H    HIS  88           H        HIS  88  13.998 -12.255 -16.943
  682    HA   HIS  88           HA       HIS  88  15.973 -12.300 -18.091
  683   1HB   HIS  88          2HB       HIS  88  16.050  -9.892 -17.065
  684   2HB   HIS  88          3HB       HIS  88  17.284 -10.579 -16.007
  685    HD1  HIS  88           HD1      HIS  88  17.740 -12.510 -18.877
  686    HD2  HIS  88           HD2      HIS  88  18.589  -8.517 -18.044
  687    HE1  HIS  88           HE1      HIS  88  19.488 -11.786 -20.558
  688    H    HIS  89           H        HIS  89  16.929 -14.208 -18.051
  689    HA   HIS  89           HA       HIS  89  17.729 -15.518 -15.630
  690   1HB   HIS  89          2HB       HIS  89  18.717 -16.453 -18.287
  691   2HB   HIS  89          3HB       HIS  89  18.063 -17.380 -16.938
  692    HD1  HIS  89           HD1      HIS  89  15.360 -16.779 -16.490
  693    HD2  HIS  89           HD2      HIS  89  16.869 -16.185 -20.330
  694    HE1  HIS  89           HE1      HIS  89  13.359 -16.681 -18.039
  695    H    HIS  90           H        HIS  90  19.429 -14.758 -14.519
  696    HA   HIS  90           HA       HIS  90  22.061 -14.919 -15.586
  697   1HB   HIS  90          2HB       HIS  90  21.254 -12.758 -16.625
  698   2HB   HIS  90          3HB       HIS  90  21.129 -12.100 -14.995
  699    HD1  HIS  90           HD1      HIS  90  23.908 -14.434 -15.249
  700    HD2  HIS  90           HD2      HIS  90  23.355 -10.371 -15.999
  701    HE1  HIS  90           HE1      HIS  90  26.218 -13.402 -15.339
  702    H    HIS  91           H        HIS  91  19.955 -14.993 -13.107
  703    HA   HIS  91           HA       HIS  91  21.327 -13.789 -10.947
  704   1HB   HIS  91          2HB       HIS  91  18.917 -14.768 -11.064
  705   2HB   HIS  91          3HB       HIS  91  19.691 -16.288 -10.614
  706    HD1  HIS  91           HD1      HIS  91  20.558 -16.526  -8.222
  707    HD2  HIS  91           HD2      HIS  91  19.153 -12.690  -9.060
  708    HE1  HIS  91           HE1      HIS  91  20.486 -15.289  -6.010
  Start of MODEL    6
    1   1H    MET   1          1HT       MET   1  13.746   2.873  -7.083
    2   2H    MET   1          2HT       MET   1  13.939   1.325  -6.410
    3   3H    MET   1          3HT       MET   1  14.909   2.614  -5.877
    4    HA   MET   1           HA       MET   1  13.454   3.016  -4.276
    5   1HB   MET   1          2HB       MET   1  11.778   3.589  -6.720
    6   2HB   MET   1          3HB       MET   1  11.115   3.790  -5.099
    7   1HG   MET   1          2HG       MET   1  12.009   5.925  -5.783
    8   2HG   MET   1          3HG       MET   1  13.092   5.265  -4.560
    9   1HE   MET   1          1HE       MET   1  15.473   6.174  -5.028
   10   2HE   MET   1          2HE       MET   1  16.373   5.038  -6.030
   11   3HE   MET   1          3HE       MET   1  15.263   4.433  -4.805
   12    H    LYS   2           H        LYS   2  13.134   1.189  -3.119
   13    HA   LYS   2           HA       LYS   2  10.715  -0.351  -3.648
   14   1HB   LYS   2          2HB       LYS   2  12.049  -2.517  -3.356
   15   2HB   LYS   2          3HB       LYS   2  12.208  -1.699  -4.909
   16   1HG   LYS   2          2HG       LYS   2  14.330  -0.757  -4.294
   17   2HG   LYS   2          3HG       LYS   2  14.142  -1.274  -2.618
   18   1HD   LYS   2          2HD       LYS   2  14.244  -3.626  -3.299
   19   2HD   LYS   2          3HD       LYS   2  14.336  -3.152  -4.995
   20   1HE   LYS   2          2HE       LYS   2  16.441  -1.845  -4.385
   21   2HE   LYS   2          3HE       LYS   2  16.393  -2.670  -2.828
   22   1HZ   LYS   2          1HZ       LYS   2  17.790  -3.784  -4.523
   23   2HZ   LYS   2          1HZ       LYS   2  16.391  -4.066  -5.445
   24   3HZ   LYS   2          3HZ       LYS   2  16.555  -4.769  -3.907
   25    H    ILE   3           H        ILE   3  11.187  -2.416  -1.820
   26    HA   ILE   3           HA       ILE   3  10.822  -0.986   0.668
   27    HB   ILE   3           HB       ILE   3  10.778  -3.923  -0.054
   28   1HG1  ILE   3          2HG1      ILE   3   8.564  -2.092   0.918
   29   2HG1  ILE   3          3HG1      ILE   3   8.899  -2.377  -0.790
   30   1HG2  ILE   3          1HG2      ILE   3  10.546  -2.527   2.611
   31   2HG2  ILE   3          2HG2      ILE   3   9.735  -4.065   2.323
   32   3HG2  ILE   3          3HG2      ILE   3  11.490  -3.958   2.196
   33   1HD1  ILE   3          1HD1      ILE   3   7.103  -3.863   0.296
   34   2HD1  ILE   3          2HD1      ILE   3   8.365  -4.687  -0.621
   35   3HD1  ILE   3          3HD1      ILE   3   8.432  -4.653   1.141
   36    H    ILE   4           H        ILE   4  12.262  -0.691   2.249
   37    HA   ILE   4           HA       ILE   4  14.918  -1.959   1.975
   38    HB   ILE   4           HB       ILE   4  14.027   0.692   3.099
   39   1HG1  ILE   4          2HG1      ILE   4  15.869   1.504   1.663
   40   2HG1  ILE   4          3HG1      ILE   4  16.251  -0.158   1.213
   41   1HG2  ILE   4          1HG2      ILE   4  15.405  -0.043   4.871
   42   2HG2  ILE   4          2HG2      ILE   4  16.489  -0.911   3.785
   43   3HG2  ILE   4          3HG2      ILE   4  16.512   0.851   3.829
   44   1HD1  ILE   4          1HD1      ILE   4  13.438   0.765   0.821
   45   2HD1  ILE   4          2HD1      ILE   4  14.659   1.369  -0.295
   46   3HD1  ILE   4          3HD1      ILE   4  14.394  -0.365  -0.138
   47    H    SER   5           H        SER   5  12.483  -0.948   4.376
   48    HA   SER   5           HA       SER   5  12.734  -3.342   5.893
   49   1HB   SER   5          2HB       SER   5  13.665  -2.214   7.970
   50   2HB   SER   5          3HB       SER   5  14.826  -2.512   6.681
   51    HG   SER   5           HG       SER   5  13.434  -0.100   6.622
   52    H    ILE   6           H        ILE   6  11.194  -3.498   7.528
   53    HA   ILE   6           HA       ILE   6   9.073  -1.481   7.402
   54    HB   ILE   6           HB       ILE   6   9.036  -4.150   8.831
   55   1HG1  ILE   6          2HG1      ILE   6   8.074  -3.522   6.018
   56   2HG1  ILE   6          3HG1      ILE   6   9.584  -4.357   6.377
   57   1HG2  ILE   6          1HG2      ILE   6   6.499  -3.674   8.046
   58   2HG2  ILE   6          2HG2      ILE   6   7.134  -3.093   9.584
   59   3HG2  ILE   6          3HG2      ILE   6   7.058  -2.010   8.195
   60   1HD1  ILE   6          1HD1      ILE   6   8.122  -5.985   7.764
   61   2HD1  ILE   6          2HD1      ILE   6   6.761  -5.293   6.881
   62   3HD1  ILE   6          3HD1      ILE   6   8.054  -6.116   6.008
   63    H    SER   7           H        SER   7   7.858  -1.354   9.673
   64    HA   SER   7           HA       SER   7   9.836  -0.257  11.531
   65   1HB   SER   7          2HB       SER   7   7.798   1.044  10.800
   66   2HB   SER   7          3HB       SER   7   6.818  -0.113  11.692
   67    HG   SER   7           HG       SER   7   7.357   1.717  12.955
   68    H    GLU   8           H        GLU   8   8.395  -0.439  13.895
   69    HA   GLU   8           HA       GLU   8   8.876  -3.218  14.612
   70   1HB   GLU   8          2HB       GLU   8   9.058  -0.676  15.919
   71   2HB   GLU   8          3HB       GLU   8   7.991  -1.730  16.840
   72   1HG   GLU   8          2HG       GLU   8  10.300  -2.032  17.603
   73   2HG   GLU   8          3HG       GLU   8   9.740  -3.500  16.807
   74    H    THR   9           H        THR   9   6.424  -1.401  13.595
   75    HA   THR   9           HA       THR   9   4.345  -3.112  14.832
   76    HB   THR   9           HB       THR   9   4.242  -0.740  15.601
   77    HG1  THR   9           HG1      THR   9   2.267  -1.497  15.640
   78   1HG2  THR   9          1HG2      THR   9   4.333   1.014  14.164
   79   2HG2  THR   9          2HG2      THR   9   4.952  -0.155  12.998
   80   3HG2  THR   9          3HG2      THR   9   3.234   0.244  13.020
   81    HA   PRO  10           HA       PRO  10   4.725  -3.397  10.058
   82   1HB   PRO  10          2HB       PRO  10   4.461  -6.237  10.364
   83   2HB   PRO  10          3HB       PRO  10   5.850  -5.324   9.763
   84   1HG   PRO  10          2HG       PRO  10   5.455  -6.578  12.336
   85   2HG   PRO  10          3HG       PRO  10   6.929  -5.908  11.628
   86   1HD   PRO  10          2HD       PRO  10   5.503  -4.797  13.757
   87   2HD   PRO  10          3HD       PRO  10   6.705  -3.948  12.765
   88    H    ASN  11           H        ASN  11   2.490  -3.998  12.498
   89    HA   ASN  11           HA       ASN  11   0.352  -4.427  10.529
   90   1HB   ASN  11          2HB       ASN  11  -0.643  -5.844  12.555
   91   2HB   ASN  11          3HB       ASN  11   0.380  -6.578  11.331
   92   1HD2  ASN  11          2HD2      ASN  11   1.042  -8.194  13.002
   93   2HD2  ASN  11          1HD2      ASN  11   2.192  -7.762  14.173
   94    H    HIS  12           H        HIS  12  -1.704  -4.573  12.472
   95    HA   HIS  12           HA       HIS  12  -2.994  -3.340  13.918
   96   1HB   HIS  12          2HB       HIS  12  -0.781  -1.311  14.195
   97   2HB   HIS  12          3HB       HIS  12  -2.080  -1.682  15.325
   98    HD1  HIS  12           HD1      HIS  12   0.865  -1.832  16.245
   99    HD2  HIS  12           HD2      HIS  12  -1.274  -5.105  14.800
  100    HE1  HIS  12           HE1      HIS  12   2.019  -3.896  17.149
  101    H    ASN  13           H        ASN  13  -4.138  -3.040  11.902
  102    HA   ASN  13           HA       ASN  13  -5.409  -1.741  10.520
  103   1HB   ASN  13          2HB       ASN  13  -4.238   0.756  11.705
  104   2HB   ASN  13          3HB       ASN  13  -5.873   0.463  11.122
  105   1HD2  ASN  13          2HD2      ASN  13  -7.234  -1.064  12.500
  106   2HD2  ASN  13          1HD2      ASN  13  -6.936  -1.114  14.171
  107    H    THR  14           H        THR  14  -2.265  -0.122  10.991
  108    HA   THR  14           HA       THR  14  -1.745  -0.380   8.125
  109    HB   THR  14           HB       THR  14  -2.924   1.790   8.385
  110    HG1  THR  14           HG1      THR  14  -0.159   1.828   7.774
  111   1HG2  THR  14          1HG2      THR  14  -2.017   3.556   9.713
  112   2HG2  THR  14          2HG2      THR  14  -2.039   2.138  10.761
  113   3HG2  THR  14          3HG2      THR  14  -0.528   2.662  10.018
  114    H    MET  15           H        MET  15   0.459   0.039   7.547
  115    HA   MET  15           HA       MET  15   2.353   0.092   9.812
  116   1HB   MET  15          2HB       MET  15   3.721  -1.622   8.549
  117   2HB   MET  15          3HB       MET  15   2.224  -2.228   9.256
  118   1HG   MET  15          2HG       MET  15   1.364  -2.737   7.233
  119   2HG   MET  15          3HG       MET  15   1.816  -1.173   6.560
  120   1HE   MET  15          1HE       MET  15   3.546  -5.130   5.648
  121   2HE   MET  15          2HE       MET  15   1.906  -4.503   5.793
  122   3HE   MET  15          3HE       MET  15   2.836  -4.862   7.245
  123    H    LYS  16           H        LYS  16   4.555   0.655   9.154
  124    HA   LYS  16           HA       LYS  16   4.500   2.730   7.089
  125   1HB   LYS  16          2HB       LYS  16   5.502   2.868   9.538
  126   2HB   LYS  16          3HB       LYS  16   6.915   2.161   8.757
  127   1HG   LYS  16          2HG       LYS  16   6.531   4.040   6.961
  128   2HG   LYS  16          3HG       LYS  16   5.603   4.818   8.241
  129   1HD   LYS  16          2HD       LYS  16   8.452   3.838   8.582
  130   2HD   LYS  16          3HD       LYS  16   8.029   5.500   8.176
  131   1HE   LYS  16          2HE       LYS  16   7.214   3.993  10.679
  132   2HE   LYS  16          3HE       LYS  16   8.355   5.333  10.585
  133   1HZ   LYS  16          1HZ       LYS  16   5.505   5.388  10.691
  134   2HZ   LYS  16          1HZ       LYS  16   6.097   6.267   9.364
  135   3HZ   LYS  16          3HZ       LYS  16   6.616   6.646  10.935
  136    H    ILE  17           H        ILE  17   6.357   2.954   5.630
  137    HA   ILE  17           HA       ILE  17   7.702   0.425   4.940
  138    HB   ILE  17           HB       ILE  17   6.042   2.146   3.089
  139   1HG1  ILE  17          2HG1      ILE  17   6.061  -0.851   3.559
  140   2HG1  ILE  17          3HG1      ILE  17   4.968   0.261   4.384
  141   1HG2  ILE  17          1HG2      ILE  17   6.939   0.524   1.311
  142   2HG2  ILE  17          2HG2      ILE  17   8.055   1.773   1.864
  143   3HG2  ILE  17          3HG2      ILE  17   8.209   0.126   2.469
  144   1HD1  ILE  17          1HD1      ILE  17   5.172  -0.059   1.375
  145   2HD1  ILE  17          2HD1      ILE  17   3.908  -0.760   2.386
  146   3HD1  ILE  17          3HD1      ILE  17   4.045   0.991   2.235
  147    H    THR  18           H        THR  18   9.808   0.876   5.066
  148    HA   THR  18           HA       THR  18  10.793   3.581   4.635
  149    HB   THR  18           HB       THR  18  12.385   1.069   5.203
  150    HG1  THR  18           HG1      THR  18  12.268   2.073   7.393
  151   1HG2  THR  18          1HG2      THR  18  13.633   3.067   4.376
  152   2HG2  THR  18          2HG2      THR  18  12.978   3.995   5.726
  153   3HG2  THR  18          3HG2      THR  18  14.059   2.634   6.032
  154    H    LEU  19           H        LEU  19  11.325   4.305   2.697
  155    HA   LEU  19           HA       LEU  19  12.020   2.383   0.568
  156   1HB   LEU  19          2HB       LEU  19  11.176   5.285   0.364
  157   2HB   LEU  19          3HB       LEU  19  11.468   4.197  -0.991
  158    HG   LEU  19           HG       LEU  19   9.399   3.669   1.164
  159   1HD1  LEU  19          1HD1      LEU  19   9.255   5.162  -1.442
  160   2HD1  LEU  19          2HD1      LEU  19   7.856   4.240  -0.892
  161   3HD1  LEU  19          3HD1      LEU  19   8.499   5.546   0.105
  162   1HD2  LEU  19          1HD2      LEU  19  10.188   2.371  -1.443
  163   2HD2  LEU  19          2HD2      LEU  19   9.914   1.618   0.127
  164   3HD2  LEU  19          3HD2      LEU  19   8.547   2.197  -0.822
  165    H    SER  20           H        SER  20  13.644   3.212  -1.038
  166    HA   SER  20           HA       SER  20  16.093   3.868   0.280
  167   1HB   SER  20          2HB       SER  20  15.269   3.529  -2.595
  168   2HB   SER  20          3HB       SER  20  16.879   4.108  -2.177
  169    HG   SER  20           HG       SER  20  16.932   1.879  -2.315
  170    H    GLU  21           H        GLU  21  14.018   5.855   0.657
  171    HA   GLU  21           HA       GLU  21  14.762   8.139  -0.968
  172   1HB   GLU  21          2HB       GLU  21  12.643   7.487   1.003
  173   2HB   GLU  21          3HB       GLU  21  13.131   9.178   0.914
  174   1HG   GLU  21          2HG       GLU  21  12.509   7.605  -1.584
  175   2HG   GLU  21          3HG       GLU  21  11.233   8.390  -0.657
  176    H    SER  22           H        SER  22  14.655  10.227   0.696
  177    HA   SER  22           HA       SER  22  16.543   9.893   2.867
  178   1HB   SER  22          2HB       SER  22  17.989  10.211   0.886
  179   2HB   SER  22          3HB       SER  22  17.142  11.715   0.539
  180    HG   SER  22           HG       SER  22  17.877  12.525   2.510
  181    H    ARG  23           H        ARG  23  14.393  11.709   1.036
  182    HA   ARG  23           HA       ARG  23  12.643  13.062   1.932
  183   1HB   ARG  23          2HB       ARG  23  13.562  12.615   4.286
  184   2HB   ARG  23          3HB       ARG  23  14.587  14.030   4.036
  185   1HG   ARG  23          2HG       ARG  23  12.498  15.345   3.504
  186   2HG   ARG  23          3HG       ARG  23  11.557  13.939   4.001
  187   1HD   ARG  23          2HD       ARG  23  12.401  14.053   6.236
  188   2HD   ARG  23          3HD       ARG  23  13.639  15.219   5.780
  189    HE   ARG  23           HE       ARG  23  10.850  16.038   5.417
  190   1HH1  ARG  23          1HH1      ARG  23  13.691  16.020   7.400
  191   2HH1  ARG  23          2HH1      ARG  23  13.297  17.496   8.216
  192   1HH2  ARG  23          1HH2      ARG  23  10.364  18.008   6.439
  193   2HH2  ARG  23          2HH2      ARG  23  11.410  18.616   7.678
  194    H    GLU  24           H        GLU  24  12.299  15.338   1.639
  195    HA   GLU  24           HA       GLU  24  12.798  17.472   0.874
  196   1HB   GLU  24          2HB       GLU  24  15.149  16.991   1.952
  197   2HB   GLU  24          3HB       GLU  24  15.642  16.716   0.280
  198   1HG   GLU  24          2HG       GLU  24  14.439  18.990  -0.189
  199   2HG   GLU  24          3HG       GLU  24  14.604  19.240   1.548
  200    H    GLY  25           H        GLY  25  12.057  15.016  -0.600
  201   1HA   GLY  25          1HA       GLY  25  12.469  16.065  -3.296
  202   2HA   GLY  25          2HA       GLY  25  13.054  14.432  -2.993
  203    H    MET  26           H        MET  26  11.064  13.493  -1.276
  204    HA   MET  26           HA       MET  26   8.879  13.107  -3.181
  205   1HB   MET  26          2HB       MET  26   9.940  11.644  -0.819
  206   2HB   MET  26          3HB       MET  26   8.213  11.494  -1.144
  207   1HG   MET  26          2HG       MET  26   8.826  10.938  -3.546
  208   2HG   MET  26          3HG       MET  26  10.501  10.822  -3.005
  209   1HE   MET  26          1HE       MET  26  10.959   8.787  -3.673
  210   2HE   MET  26          2HE       MET  26   9.518   7.919  -4.195
  211   3HE   MET  26          3HE       MET  26  10.525   7.249  -2.914
  212    H    THR  27           H        THR  27   6.998  14.122  -3.033
  213    HA   THR  27           HA       THR  27   6.432  15.916  -0.852
  214    HB   THR  27           HB       THR  27   5.800  16.482  -3.158
  215    HG1  THR  27           HG1      THR  27   3.422  16.711  -2.621
  216   1HG2  THR  27          1HG2      THR  27   4.345  15.221  -4.468
  217   2HG2  THR  27          2HG2      THR  27   5.226  13.955  -3.617
  218   3HG2  THR  27          3HG2      THR  27   3.615  14.424  -3.076
  219    H    SER  28           H        SER  28   3.439  15.101  -1.343
  220    HA   SER  28           HA       SER  28   3.238  12.621   0.150
  221   1HB   SER  28          2HB       SER  28   2.298  13.473   2.128
  222   2HB   SER  28          3HB       SER  28   3.640  14.568   1.814
  223    HG   SER  28           HG       SER  28   0.884  14.962   1.578
  224    H    ASP  29           H        ASP  29   1.364  11.586  -0.298
  225    HA   ASP  29           HA       ASP  29  -1.016  13.023  -1.117
  226   1HB   ASP  29          2HB       ASP  29   0.746  11.631  -3.085
  227   2HB   ASP  29          3HB       ASP  29  -0.998  11.482  -3.281
  228    H    THR  30           H        THR  30  -2.851  11.829  -0.895
  229    HA   THR  30           HA       THR  30  -2.518   9.091   0.158
  230    HB   THR  30           HB       THR  30  -3.660  10.196   1.828
  231    HG1  THR  30           HG1      THR  30  -6.079   9.983   0.798
  232   1HG2  THR  30          1HG2      THR  30  -4.733  11.905  -0.404
  233   2HG2  THR  30          2HG2      THR  30  -5.516  11.911   1.175
  234   3HG2  THR  30          3HG2      THR  30  -3.826  12.393   1.028
  235    H    TYR  31           H        TYR  31  -3.844   7.413  -0.590
  236    HA   TYR  31           HA       TYR  31  -5.369   7.964  -3.062
  237   1HB   TYR  31          2HB       TYR  31  -3.705   5.474  -2.668
  238   2HB   TYR  31          3HB       TYR  31  -4.433   6.077  -4.156
  239    HD1  TYR  31           HD1      TYR  31  -1.394   5.743  -2.533
  240    HD2  TYR  31           HD2      TYR  31  -3.721   8.710  -4.595
  241    HE1  TYR  31           HE1      TYR  31   0.671   7.026  -3.019
  242    HE2  TYR  31           HE2      TYR  31  -1.652   9.993  -5.080
  243    HH   TYR  31           HH       TYR  31   0.867   9.398  -5.305
  244    H    THR  32           H        THR  32  -7.426   7.555  -2.594
  245    HA   THR  32           HA       THR  32  -8.060   5.145  -0.995
  246    HB   THR  32           HB       THR  32  -9.825   6.278   0.087
  247    HG1  THR  32           HG1      THR  32 -10.832   7.424  -1.422
  248   1HG2  THR  32          1HG2      THR  32  -7.378   7.005   0.633
  249   2HG2  THR  32          2HG2      THR  32  -7.835   8.525  -0.136
  250   3HG2  THR  32          3HG2      THR  32  -8.711   7.956   1.286
  251    H    LYS  33           H        LYS  33  -8.194   6.442  -4.021
  252    HA   LYS  33           HA       LYS  33 -10.314   4.607  -4.818
  253   1HB   LYS  33          2HB       LYS  33 -10.473   7.589  -5.310
  254   2HB   LYS  33          3HB       LYS  33 -11.440   6.402  -6.182
  255   1HG   LYS  33          2HG       LYS  33 -12.219   5.565  -3.890
  256   2HG   LYS  33          3HG       LYS  33 -11.502   7.035  -3.229
  257   1HD   LYS  33          2HD       LYS  33 -13.643   6.928  -5.376
  258   2HD   LYS  33          3HD       LYS  33 -13.898   7.374  -3.689
  259   1HE   LYS  33          2HE       LYS  33 -11.966   9.121  -4.208
  260   2HE   LYS  33          3HE       LYS  33 -12.523   8.902  -5.867
  261   1HZ   LYS  33          1HZ       LYS  33 -14.394  10.009  -5.455
  262   2HZ   LYS  33          1HZ       LYS  33 -13.624  10.573  -4.050
  263   3HZ   LYS  33          3HZ       LYS  33 -14.658   9.227  -3.973
  264    H    VAL  34           H        VAL  34  -7.384   5.017  -5.179
  265    HA   VAL  34           HA       VAL  34  -5.798   4.828  -6.834
  266    HB   VAL  34           HB       VAL  34  -8.204   3.825  -8.381
  267   1HG1  VAL  34          1HG1      VAL  34  -6.519   4.177  -9.999
  268   2HG1  VAL  34          2HG1      VAL  34  -5.231   3.713  -8.887
  269   3HG1  VAL  34          3HG1      VAL  34  -6.315   2.487  -9.545
  270   1HG2  VAL  34          1HG2      VAL  34  -6.090   2.251  -6.890
  271   2HG2  VAL  34          2HG2      VAL  34  -7.635   2.700  -6.169
  272   3HG2  VAL  34          3HG2      VAL  34  -7.595   1.644  -7.581
  273    H    ASP  35           H        ASP  35  -5.242   5.496  -9.148
  274    HA   ASP  35           HA       ASP  35  -5.073   7.089 -10.786
  275   1HB   ASP  35          2HB       ASP  35  -7.691   6.710 -10.758
  276   2HB   ASP  35          3HB       ASP  35  -7.701   8.317 -10.038
  277    H    ASP  36           H        ASP  36  -3.430   8.270  -9.972
  278    HA   ASP  36           HA       ASP  36  -3.940  10.916  -9.083
  279   1HB   ASP  36          2HB       ASP  36  -4.210   9.203  -7.008
  280   2HB   ASP  36          3HB       ASP  36  -2.474   9.479  -6.942
  281    H    SER  37           H        SER  37  -2.329   9.085 -10.896
  282    HA   SER  37           HA       SER  37  -0.345   9.336 -12.030
  283   1HB   SER  37          2HB       SER  37   0.824  11.284 -11.838
  284   2HB   SER  37          3HB       SER  37  -0.589  11.775 -10.914
  285    HG   SER  37           HG       SER  37   0.861  12.112  -9.417
  286    H    GLN  38           H        GLN  38  -0.863   7.776  -9.361
  287    HA   GLN  38           HA       GLN  38   1.834   7.321  -8.386
  288   1HB   GLN  38          2HB       GLN  38  -0.114   5.276  -7.651
  289   2HB   GLN  38          3HB       GLN  38   0.824   6.349  -6.620
  290   1HG   GLN  38          2HG       GLN  38  -1.311   7.096  -6.153
  291   2HG   GLN  38          3HG       GLN  38  -0.899   8.167  -7.486
  292   1HE2  GLN  38          2HE2      GLN  38  -3.122   5.758  -6.420
  293   2HE2  GLN  38          1HE2      GLN  38  -3.959   5.568  -7.884
  294    HA   PRO  39           HA       PRO  39   2.881   3.885 -10.927
  295   1HB   PRO  39          2HB       PRO  39   3.454   1.950  -8.865
  296   2HB   PRO  39          3HB       PRO  39   4.596   2.944  -9.777
  297   1HG   PRO  39          2HG       PRO  39   4.002   3.190  -7.080
  298   2HG   PRO  39          3HG       PRO  39   4.834   4.388  -8.079
  299   1HD   PRO  39          2HD       PRO  39   2.044   4.395  -7.082
  300   2HD   PRO  39          3HD       PRO  39   3.074   5.756  -7.574
  301    H    ALA  40           H        ALA  40   1.644   2.507 -12.082
  302    HA   ALA  40           HA       ALA  40  -0.906   1.707 -11.453
  303   1HB   ALA  40          1HB       ALA  40  -0.606  -0.090 -13.159
  304   2HB   ALA  40          2HB       ALA  40  -0.043   1.490 -13.705
  305   3HB   ALA  40          3HB       ALA  40   1.120   0.273 -13.182
  306    H    PHE  41           H        PHE  41   2.125   0.101 -10.678
  307    HA   PHE  41           HA       PHE  41   1.198  -2.364  -9.778
  308   1HB   PHE  41          2HB       PHE  41   3.439  -0.796  -8.494
  309   2HB   PHE  41          3HB       PHE  41   3.259  -2.549  -8.580
  310    HD1  PHE  41           HD1      PHE  41   4.865   0.208 -10.040
  311    HD2  PHE  41           HD2      PHE  41   2.910  -3.474 -11.081
  312    HE1  PHE  41           HE1      PHE  41   6.046   0.195 -12.220
  313    HE2  PHE  41           HE2      PHE  41   4.093  -3.486 -13.259
  314    HZ   PHE  41           HZ       PHE  41   5.660  -1.651 -13.830
  315    H    ILE  42           H        ILE  42   1.148   0.785  -8.200
  316    HA   ILE  42           HA       ILE  42   0.406  -0.253  -5.615
  317    HB   ILE  42           HB       ILE  42   0.540   2.499  -6.831
  318   1HG1  ILE  42          2HG1      ILE  42   2.531   1.129  -5.863
  319   2HG1  ILE  42          3HG1      ILE  42   2.342   2.804  -5.347
  320   1HG2  ILE  42          1HG2      ILE  42  -1.406   2.716  -5.480
  321   2HG2  ILE  42          2HG2      ILE  42  -0.742   1.680  -4.216
  322   3HG2  ILE  42          3HG2      ILE  42  -0.085   3.297  -4.470
  323   1HD1  ILE  42          1HD1      ILE  42   0.955   0.695  -3.748
  324   2HD1  ILE  42          2HD1      ILE  42   2.704   0.838  -3.580
  325   3HD1  ILE  42          3HD1      ILE  42   1.668   2.219  -3.219
  326    H    ASN  43           H        ASN  43  -1.261   0.510  -8.543
  327    HA   ASN  43           HA       ASN  43  -3.825   1.093  -7.494
  328   1HB   ASN  43          2HB       ASN  43  -3.115  -0.288 -10.099
  329   2HB   ASN  43          3HB       ASN  43  -4.658   0.452  -9.707
  330   1HD2  ASN  43          2HD2      ASN  43  -2.267   2.364  -8.298
  331   2HD2  ASN  43          1HD2      ASN  43  -2.091   3.506  -9.540
  332    H    ASP  44           H        ASP  44  -2.121  -1.878  -8.315
  333    HA   ASP  44           HA       ASP  44  -4.193  -3.734  -7.942
  334   1HB   ASP  44          2HB       ASP  44  -1.246  -4.064  -7.313
  335   2HB   ASP  44          3HB       ASP  44  -2.404  -5.371  -7.535
  336    H    ILE  45           H        ILE  45  -1.741  -2.566  -5.636
  337    HA   ILE  45           HA       ILE  45  -2.495  -3.923  -3.356
  338    HB   ILE  45           HB       ILE  45  -1.452  -1.103  -3.688
  339   1HG1  ILE  45          2HG1      ILE  45  -0.110  -3.674  -2.791
  340   2HG1  ILE  45          3HG1      ILE  45  -0.021  -3.022  -4.428
  341   1HG2  ILE  45          1HG2      ILE  45  -0.826  -1.288  -1.267
  342   2HG2  ILE  45          2HG2      ILE  45  -2.567  -1.201  -1.531
  343   3HG2  ILE  45          3HG2      ILE  45  -1.808  -2.750  -1.166
  344   1HD1  ILE  45          1HD1      ILE  45   1.710  -2.410  -2.337
  345   2HD1  ILE  45          2HD1      ILE  45   1.541  -1.502  -3.839
  346   3HD1  ILE  45          3HD1      ILE  45   0.635  -1.014  -2.407
  347    H    LEU  46           H        LEU  46  -3.752  -0.789  -4.495
  348    HA   LEU  46           HA       LEU  46  -5.623  -0.427  -2.409
  349   1HB   LEU  46          2HB       LEU  46  -5.497   0.650  -5.231
  350   2HB   LEU  46          3HB       LEU  46  -6.730   1.143  -4.069
  351    HG   LEU  46           HG       LEU  46  -3.823   1.252  -3.295
  352   1HD1  LEU  46          1HD1      LEU  46  -3.912   2.462  -5.414
  353   2HD1  LEU  46          2HD1      LEU  46  -5.345   3.343  -4.884
  354   3HD1  LEU  46          3HD1      LEU  46  -3.794   3.620  -4.090
  355   1HD2  LEU  46          1HD2      LEU  46  -6.317   2.812  -2.540
  356   2HD2  LEU  46          2HD2      LEU  46  -5.489   1.613  -1.547
  357   3HD2  LEU  46          3HD2      LEU  46  -4.705   3.151  -1.912
  358    H    LYS  47           H        LYS  47  -5.823  -2.071  -5.528
  359    HA   LYS  47           HA       LYS  47  -8.662  -2.600  -5.262
  360   1HB   LYS  47          2HB       LYS  47  -6.797  -2.575  -7.381
  361   2HB   LYS  47          3HB       LYS  47  -7.359  -4.240  -7.245
  362   1HG   LYS  47          2HG       LYS  47  -8.949  -3.252  -8.672
  363   2HG   LYS  47          3HG       LYS  47  -9.736  -3.201  -7.095
  364   1HD   LYS  47          2HD       LYS  47  -8.797  -0.856  -6.819
  365   2HD   LYS  47          3HD       LYS  47  -8.309  -0.934  -8.513
  366   1HE   LYS  47          2HE       LYS  47 -10.682  -1.412  -9.135
  367   2HE   LYS  47          3HE       LYS  47 -11.136  -1.195  -7.444
  368   1HZ   LYS  47          1HZ       LYS  47 -11.174   0.777  -9.185
  369   2HZ   LYS  47          1HZ       LYS  47  -9.560   0.924  -8.678
  370   3HZ   LYS  47          3HZ       LYS  47 -10.822   1.025  -7.545
  371    H    VAL  48           H        VAL  48  -5.833  -4.005  -4.038
  372    HA   VAL  48           HA       VAL  48  -6.693  -6.756  -4.083
  373    HB   VAL  48           HB       VAL  48  -4.458  -5.275  -2.703
  374   1HG1  VAL  48          1HG1      VAL  48  -5.400  -8.112  -2.247
  375   2HG1  VAL  48          2HG1      VAL  48  -3.722  -7.637  -1.982
  376   3HG1  VAL  48          3HG1      VAL  48  -5.010  -6.884  -1.041
  377   1HG2  VAL  48          1HG2      VAL  48  -3.113  -6.259  -4.295
  378   2HG2  VAL  48          2HG2      VAL  48  -4.112  -7.708  -4.394
  379   3HG2  VAL  48          3HG2      VAL  48  -4.618  -6.231  -5.211
  380    H    GLU  49           H        GLU  49  -8.101  -7.686  -2.785
  381    HA   GLU  49           HA       GLU  49  -9.695  -6.406  -0.929
  382   1HB   GLU  49          2HB       GLU  49 -10.143  -8.759  -0.042
  383   2HB   GLU  49          3HB       GLU  49 -10.438  -8.497  -1.759
  384   1HG   GLU  49          2HG       GLU  49  -7.710  -9.409  -0.937
  385   2HG   GLU  49          3HG       GLU  49  -9.019 -10.587  -0.896
  386    H    GLY  50           H        GLY  50  -9.642  -6.007   1.214
  387   1HA   GLY  50          1HA       GLY  50  -8.865  -6.448   3.456
  388   2HA   GLY  50          2HA       GLY  50  -7.315  -6.941   2.780
  389    H    VAL  51           H        VAL  51  -7.113  -4.754   0.913
  390    HA   VAL  51           HA       VAL  51  -6.004  -2.765   2.686
  391    HB   VAL  51           HB       VAL  51  -6.236  -2.714  -0.335
  392   1HG1  VAL  51          1HG1      VAL  51  -4.276  -1.318   1.510
  393   2HG1  VAL  51          2HG1      VAL  51  -4.452  -1.088  -0.230
  394   3HG1  VAL  51          3HG1      VAL  51  -5.724  -0.546   0.865
  395   1HG2  VAL  51          1HG2      VAL  51  -4.122  -3.848   1.519
  396   2HG2  VAL  51          2HG2      VAL  51  -5.037  -4.712   0.285
  397   3HG2  VAL  51          3HG2      VAL  51  -3.831  -3.516  -0.188
  398    H    LYS  52           H        LYS  52  -6.749  -0.756   3.117
  399    HA   LYS  52           HA       LYS  52  -9.485  -0.122   2.216
  400   1HB   LYS  52          2HB       LYS  52  -9.266  -0.215   4.622
  401   2HB   LYS  52          3HB       LYS  52  -7.854   0.837   4.582
  402   1HG   LYS  52          2HG       LYS  52  -9.145   2.729   3.935
  403   2HG   LYS  52          3HG       LYS  52 -10.534   1.732   3.504
  404   1HD   LYS  52          2HD       LYS  52 -11.158   2.590   5.596
  405   2HD   LYS  52          3HD       LYS  52 -10.491   1.012   6.015
  406   1HE   LYS  52          2HE       LYS  52  -9.479   2.517   7.546
  407   2HE   LYS  52          3HE       LYS  52  -8.244   2.232   6.321
  408   1HZ   LYS  52          1HZ       LYS  52  -9.549   4.295   5.256
  409   2HZ   LYS  52          1HZ       LYS  52  -8.192   4.463   6.265
  410   3HZ   LYS  52          3HZ       LYS  52  -9.757   4.638   6.903
  411    H    SER  53           H        SER  53  -6.395   1.526   2.926
  412    HA   SER  53           HA       SER  53  -6.534   3.056   0.480
  413   1HB   SER  53          2HB       SER  53  -6.958   4.415   3.149
  414   2HB   SER  53          3HB       SER  53  -6.496   5.269   1.681
  415    HG   SER  53           HG       SER  53  -8.421   4.802   0.791
  416    H    ILE  54           H        ILE  54  -4.740   4.900   0.702
  417    HA   ILE  54           HA       ILE  54  -2.426   3.861   2.205
  418    HB   ILE  54           HB       ILE  54  -2.422   4.556  -0.748
  419   1HG1  ILE  54          2HG1      ILE  54  -1.799   1.925   0.632
  420   2HG1  ILE  54          3HG1      ILE  54  -3.363   2.300  -0.094
  421   1HG2  ILE  54          1HG2      ILE  54  -0.335   5.289   0.119
  422   2HG2  ILE  54          2HG2      ILE  54  -0.230   3.929   1.238
  423   3HG2  ILE  54          3HG2      ILE  54  -0.009   3.668  -0.492
  424   1HD1  ILE  54          1HD1      ILE  54  -0.694   2.243  -1.537
  425   2HD1  ILE  54          2HD1      ILE  54  -1.987   1.055  -1.693
  426   3HD1  ILE  54          3HD1      ILE  54  -2.231   2.702  -2.271
  427    H    PHE  55           H        PHE  55  -0.800   5.430   2.612
  428    HA   PHE  55           HA       PHE  55  -1.476   8.221   1.961
  429   1HB   PHE  55          2HB       PHE  55  -2.444   7.969   4.125
  430   2HB   PHE  55          3HB       PHE  55  -1.054   7.064   4.719
  431    HD1  PHE  55           HD1      PHE  55   0.207   8.266   6.247
  432    HD2  PHE  55           HD2      PHE  55  -1.514  10.329   2.892
  433    HE1  PHE  55           HE1      PHE  55   1.268  10.376   6.998
  434    HE2  PHE  55           HE2      PHE  55  -0.451  12.440   3.645
  435    HZ   PHE  55           HZ       PHE  55   0.941  12.462   5.700
  436    H    HIS  56           H        HIS  56   0.245   8.886   0.847
  437    HA   HIS  56           HA       HIS  56   2.936   7.948   1.584
  438   1HB   HIS  56          2HB       HIS  56   2.419   7.701  -0.753
  439   2HB   HIS  56          3HB       HIS  56   1.855   9.365  -0.860
  440    HD1  HIS  56           HD1      HIS  56   3.611  10.165  -2.545
  441    HD2  HIS  56           HD2      HIS  56   5.295   8.468   0.868
  442    HE1  HIS  56           HE1      HIS  56   6.091  10.673  -2.640
  443    H    VAL  57           H        VAL  57   4.424   9.255   2.495
  444    HA   VAL  57           HA       VAL  57   4.353  12.117   2.257
  445    HB   VAL  57           HB       VAL  57   2.563  11.647   3.975
  446   1HG1  VAL  57          1HG1      VAL  57   3.325  10.982   6.225
  447   2HG1  VAL  57          2HG1      VAL  57   3.650   9.710   5.046
  448   3HG1  VAL  57          3HG1      VAL  57   4.959  10.751   5.606
  449   1HG2  VAL  57          1HG2      VAL  57   4.136  13.734   3.795
  450   2HG2  VAL  57          2HG2      VAL  57   3.160  13.522   5.248
  451   3HG2  VAL  57          3HG2      VAL  57   4.869  13.090   5.264
  452    H    MET  58           H        MET  58   6.163  13.146   3.348
  453    HA   MET  58           HA       MET  58   8.445  13.241   3.670
  454   1HB   MET  58          2HB       MET  58   7.340  12.416   5.901
  455   2HB   MET  58          3HB       MET  58   8.131  10.891   5.518
  456   1HG   MET  58          2HG       MET  58   9.825  11.893   6.719
  457   2HG   MET  58          3HG       MET  58  10.223  12.512   5.116
  458   1HE   MET  58          1HE       MET  58  10.869  13.363   8.029
  459   2HE   MET  58          2HE       MET  58   9.305  13.589   8.810
  460   3HE   MET  58          3HE       MET  58  10.325  14.986   8.476
  461    H    ASP  59           H        ASP  59   9.804  10.625   4.647
  462    HA   ASP  59           HA       ASP  59  10.371   9.601   1.940
  463   1HB   ASP  59          2HB       ASP  59  12.512   8.862   2.848
  464   2HB   ASP  59          3HB       ASP  59  12.277  10.576   3.166
  465    H    PHE  60           H        PHE  60   8.039   8.644   3.115
  466    HA   PHE  60           HA       PHE  60   8.542   5.820   3.095
  467   1HB   PHE  60          2HB       PHE  60   7.862   5.257   5.324
  468   2HB   PHE  60          3HB       PHE  60   9.145   6.455   5.468
  469    HD1  PHE  60           HD1      PHE  60   8.690   8.709   6.258
  470    HD2  PHE  60           HD2      PHE  60   5.506   5.867   5.759
  471    HE1  PHE  60           HE1      PHE  60   7.165  10.189   7.536
  472    HE2  PHE  60           HE2      PHE  60   3.983   7.348   7.037
  473    HZ   PHE  60           HZ       PHE  60   4.812   9.510   7.923
  474    H    ILE  61           H        ILE  61   6.433   4.601   3.623
  475    HA   ILE  61           HA       ILE  61   4.067   6.214   2.897
  476    HB   ILE  61           HB       ILE  61   4.788   3.559   1.623
  477   1HG1  ILE  61          2HG1      ILE  61   4.695   6.318   0.359
  478   2HG1  ILE  61          3HG1      ILE  61   6.187   5.536   0.880
  479   1HG2  ILE  61          1HG2      ILE  61   2.499   5.504   1.170
  480   2HG2  ILE  61          2HG2      ILE  61   2.832   4.095   0.166
  481   3HG2  ILE  61          3HG2      ILE  61   2.373   3.884   1.854
  482   1HD1  ILE  61          1HD1      ILE  61   5.647   3.606  -0.614
  483   2HD1  ILE  61          2HD1      ILE  61   4.238   4.492  -1.197
  484   3HD1  ILE  61          3HD1      ILE  61   5.860   5.116  -1.499
  485    H    SER  62           H        SER  62   2.152   5.532   3.771
  486    HA   SER  62           HA       SER  62   2.319   3.309   5.715
  487   1HB   SER  62          2HB       SER  62   1.992   5.307   6.949
  488   2HB   SER  62          3HB       SER  62   0.816   5.924   5.791
  489    HG   SER  62           HG       SER  62  -0.136   5.028   7.704
  490    H    VAL  63           H        VAL  63   1.269   1.567   5.017
  491    HA   VAL  63           HA       VAL  63  -1.065   1.876   3.242
  492    HB   VAL  63           HB       VAL  63   0.534  -0.601   3.958
  493   1HG1  VAL  63          1HG1      VAL  63  -0.672  -1.604   2.042
  494   2HG1  VAL  63          2HG1      VAL  63  -1.790  -1.099   3.309
  495   3HG1  VAL  63          3HG1      VAL  63  -1.604  -0.117   1.856
  496   1HG2  VAL  63          1HG2      VAL  63   1.524  -0.369   1.746
  497   2HG2  VAL  63          2HG2      VAL  63   0.524   1.043   1.406
  498   3HG2  VAL  63          3HG2      VAL  63   1.783   1.131   2.637
  499    H    ASP  64           H        ASP  64  -2.943   2.013   4.285
  500    HA   ASP  64           HA       ASP  64  -3.309   0.560   6.819
  501   1HB   ASP  64          2HB       ASP  64  -5.297   2.525   5.755
  502   2HB   ASP  64          3HB       ASP  64  -4.911   2.130   7.421
  503    H    LYS  65           H        LYS  65  -5.038  -0.801   7.170
  504    HA   LYS  65           HA       LYS  65  -6.577  -1.646   4.785
  505   1HB   LYS  65          2HB       LYS  65  -6.509  -3.962   5.923
  506   2HB   LYS  65          3HB       LYS  65  -5.041  -3.408   5.125
  507   1HG   LYS  65          2HG       LYS  65  -3.930  -3.022   7.124
  508   2HG   LYS  65          3HG       LYS  65  -5.423  -2.735   8.017
  509   1HD   LYS  65          2HD       LYS  65  -4.370  -4.894   8.644
  510   2HD   LYS  65          3HD       LYS  65  -5.970  -5.116   7.937
  511   1HE   LYS  65          2HE       LYS  65  -5.033  -5.773   5.820
  512   2HE   LYS  65          3HE       LYS  65  -3.410  -5.299   6.325
  513   1HZ   LYS  65          1HZ       LYS  65  -3.114  -7.281   7.230
  514   2HZ   LYS  65          1HZ       LYS  65  -4.626  -7.771   6.629
  515   3HZ   LYS  65          3HZ       LYS  65  -4.503  -7.109   8.188
  516    H    GLU  66           H        GLU  66  -8.218  -3.504   6.087
  517    HA   GLU  66           HA       GLU  66 -10.210  -1.812   7.204
  518   1HB   GLU  66          2HB       GLU  66 -10.060  -4.825   7.455
  519   2HB   GLU  66          3HB       GLU  66 -11.503  -3.813   7.506
  520   1HG   GLU  66          2HG       GLU  66 -10.855  -3.061   5.128
  521   2HG   GLU  66          3HG       GLU  66  -9.739  -4.426   5.130
  522    H    ASN  67           H        ASN  67 -11.104  -3.599   9.336
  523    HA   ASN  67           HA       ASN  67 -10.020  -2.331  11.574
  524   1HB   ASN  67          2HB       ASN  67 -10.914  -4.575  12.720
  525   2HB   ASN  67          3HB       ASN  67 -12.010  -3.334  12.120
  526   1HD2  ASN  67          2HD2      ASN  67 -13.165  -3.770  10.096
  527   2HD2  ASN  67          1HD2      ASN  67 -13.246  -5.340   9.454
  528    H    ASP  68           H        ASP  68  -9.270  -5.543  10.233
  529    HA   ASP  68           HA       ASP  68  -6.550  -5.353  11.234
  530   1HB   ASP  68          2HB       ASP  68  -6.682  -7.554  12.407
  531   2HB   ASP  68          3HB       ASP  68  -7.614  -6.282  13.194
  532    H    ALA  69           H        ALA  69  -9.029  -7.366   9.681
  533    HA   ALA  69           HA       ALA  69  -8.894  -8.919   7.982
  534   1HB   ALA  69          1HB       ALA  69  -8.479  -6.655   6.877
  535   2HB   ALA  69          2HB       ALA  69  -6.769  -7.083   6.867
  536   3HB   ALA  69          3HB       ALA  69  -7.931  -8.070   5.980
  537    H    ASN  70           H        ASN  70  -6.223  -8.984   6.400
  538    HA   ASN  70           HA       ASN  70  -4.557 -10.495   8.285
  539   1HB   ASN  70          2HB       ASN  70  -4.394 -12.094   6.069
  540   2HB   ASN  70          3HB       ASN  70  -5.388 -12.438   7.480
  541   1HD2  ASN  70          2HD2      ASN  70  -7.138 -13.452   6.353
  542   2HD2  ASN  70          1HD2      ASN  70  -8.124 -12.620   5.249
  543    H    TRP  71           H        TRP  71  -2.427 -10.236   7.930
  544    HA   TRP  71           HA       TRP  71  -1.635  -8.429   5.772
  545   1HB   TRP  71          2HB       TRP  71  -0.422  -9.343   8.352
  546   2HB   TRP  71          3HB       TRP  71   0.643  -8.741   7.085
  547    HD1  TRP  71           HD1      TRP  71  -1.157  -7.522   9.949
  548    HE1  TRP  71           HE1      TRP  71  -1.624  -4.990   9.800
  549    HE3  TRP  71           HE3      TRP  71  -0.198  -6.747   4.996
  550    HZ2  TRP  71           HZ2      TRP  71  -1.587  -2.913   7.838
  551    HZ3  TRP  71           HZ3      TRP  71  -0.421  -4.483   4.014
  552    HH2  TRP  71           HH2      TRP  71  -1.114  -2.567   5.425
  553    H    GLU  72           H        GLU  72  -0.792 -11.651   7.019
  554    HA   GLU  72           HA       GLU  72   1.253 -12.313   5.258
  555   1HB   GLU  72          2HB       GLU  72   0.766 -13.711   7.156
  556   2HB   GLU  72          3HB       GLU  72  -0.845 -14.075   6.537
  557   1HG   GLU  72          2HG       GLU  72  -0.019 -15.438   4.818
  558   2HG   GLU  72          3HG       GLU  72   1.584 -14.704   4.873
  559    H    THR  73           H        THR  73  -2.135 -12.006   4.592
  560    HA   THR  73           HA       THR  73  -1.993 -13.604   2.163
  561    HB   THR  73           HB       THR  73  -4.051 -13.450   3.668
  562    HG1  THR  73           HG1      THR  73  -4.078 -14.242   1.526
  563   1HG2  THR  73          1HG2      THR  73  -4.423 -10.826   2.199
  564   2HG2  THR  73          2HG2      THR  73  -5.520 -11.555   3.369
  565   3HG2  THR  73          3HG2      THR  73  -3.951 -10.949   3.893
  566    H    VAL  74           H        VAL  74  -2.326 -10.226   3.103
  567    HA   VAL  74           HA       VAL  74  -2.398  -9.215   0.429
  568    HB   VAL  74           HB       VAL  74  -2.628  -8.205   3.141
  569   1HG1  VAL  74          1HG1      VAL  74  -1.767  -5.925   2.661
  570   2HG1  VAL  74          2HG1      VAL  74  -0.476  -7.124   2.709
  571   3HG1  VAL  74          3HG1      VAL  74  -1.064  -6.524   1.160
  572   1HG2  VAL  74          1HG2      VAL  74  -4.209  -6.767   2.127
  573   2HG2  VAL  74          2HG2      VAL  74  -3.393  -6.833   0.564
  574   3HG2  VAL  74          3HG2      VAL  74  -4.276  -8.238   1.156
  575    H    LEU  75           H        LEU  75   0.135  -9.597   2.872
  576    HA   LEU  75           HA       LEU  75   2.174  -8.083   1.826
  577   1HB   LEU  75          2HB       LEU  75   1.958 -10.287   3.659
  578   2HB   LEU  75          3HB       LEU  75   3.390 -10.494   2.652
  579    HG   LEU  75           HG       LEU  75   3.986  -8.088   3.159
  580   1HD1  LEU  75          1HD1      LEU  75   2.854  -7.351   5.410
  581   2HD1  LEU  75          2HD1      LEU  75   2.016  -7.057   3.886
  582   3HD1  LEU  75          3HD1      LEU  75   1.554  -8.426   4.897
  583   1HD2  LEU  75          1HD2      LEU  75   4.788  -8.606   5.462
  584   2HD2  LEU  75          2HD2      LEU  75   3.745 -10.029   5.479
  585   3HD2  LEU  75          3HD2      LEU  75   5.084  -9.929   4.334
  586    HA   PRO  76           HA       PRO  76   3.695 -11.922  -0.880
  587   1HB   PRO  76          2HB       PRO  76   1.253 -13.176  -1.756
  588   2HB   PRO  76          3HB       PRO  76   2.600 -13.900  -0.864
  589   1HG   PRO  76          2HG       PRO  76   0.015 -12.986   0.106
  590   2HG   PRO  76          3HG       PRO  76   1.200 -14.043   0.881
  591   1HD   PRO  76          2HD       PRO  76   0.668 -11.472   1.712
  592   2HD   PRO  76          3HD       PRO  76   2.208 -12.305   2.003
  593    H    LYS  77           H        LYS  77   0.631 -10.224  -1.287
  594    HA   LYS  77           HA       LYS  77   0.911  -9.953  -4.160
  595   1HB   LYS  77          2HB       LYS  77  -1.030  -8.898  -2.107
  596   2HB   LYS  77          3HB       LYS  77  -1.036  -8.289  -3.762
  597   1HG   LYS  77          2HG       LYS  77  -2.630 -10.120  -3.599
  598   2HG   LYS  77          3HG       LYS  77  -1.262 -10.644  -4.580
  599   1HD   LYS  77          2HD       LYS  77  -0.524 -12.139  -3.003
  600   2HD   LYS  77          3HD       LYS  77  -1.051 -11.134  -1.653
  601   1HE   LYS  77          2HE       LYS  77  -3.060 -12.477  -3.457
  602   2HE   LYS  77          3HE       LYS  77  -2.344 -13.340  -2.097
  603   1HZ   LYS  77          1HZ       LYS  77  -3.200 -10.740  -1.329
  604   2HZ   LYS  77          1HZ       LYS  77  -3.634 -12.252  -0.684
  605   3HZ   LYS  77          3HZ       LYS  77  -4.482 -11.615  -2.013
  606    H    VAL  78           H        VAL  78   1.312  -7.922  -1.291
  607    HA   VAL  78           HA       VAL  78   1.875  -5.479  -2.545
  608    HB   VAL  78           HB       VAL  78   2.852  -6.604   0.092
  609   1HG1  VAL  78          1HG1      VAL  78   4.364  -4.851  -0.334
  610   2HG1  VAL  78          2HG1      VAL  78   3.159  -3.893  -1.194
  611   3HG1  VAL  78          3HG1      VAL  78   3.076  -4.047   0.562
  612   1HG2  VAL  78          1HG2      VAL  78   0.790  -4.452  -0.267
  613   2HG2  VAL  78          2HG2      VAL  78   0.322  -6.133  -0.518
  614   3HG2  VAL  78          3HG2      VAL  78   0.966  -5.622   1.042
  615    H    GLU  79           H        GLU  79   4.057  -8.125  -1.598
  616    HA   GLU  79           HA       GLU  79   6.505  -6.944  -2.170
  617   1HB   GLU  79          2HB       GLU  79   5.515  -9.774  -2.252
  618   2HB   GLU  79          3HB       GLU  79   7.146  -9.401  -2.812
  619   1HG   GLU  79          2HG       GLU  79   7.681  -8.358  -0.665
  620   2HG   GLU  79          3HG       GLU  79   6.035  -8.625  -0.098
  621    H    ALA  80           H        ALA  80   4.316  -8.676  -4.367
  622    HA   ALA  80           HA       ALA  80   5.859  -8.726  -6.666
  623   1HB   ALA  80          1HB       ALA  80   3.814  -8.969  -7.892
  624   2HB   ALA  80          2HB       ALA  80   3.587  -9.767  -6.335
  625   3HB   ALA  80          3HB       ALA  80   2.888  -8.172  -6.618
  626    H    VAL  81           H        VAL  81   4.084  -6.038  -5.262
  627    HA   VAL  81           HA       VAL  81   4.007  -4.300  -7.449
  628    HB   VAL  81           HB       VAL  81   4.411  -3.462  -4.570
  629   1HG1  VAL  81          1HG1      VAL  81   4.375  -1.860  -6.712
  630   2HG1  VAL  81          2HG1      VAL  81   2.635  -2.069  -6.530
  631   3HG1  VAL  81          3HG1      VAL  81   3.585  -1.399  -5.206
  632   1HG2  VAL  81          1HG2      VAL  81   2.128  -3.806  -4.160
  633   2HG2  VAL  81          2HG2      VAL  81   1.725  -3.860  -5.875
  634   3HG2  VAL  81          3HG2      VAL  81   2.542  -5.224  -5.115
  635    H    PHE  82           H        PHE  82   6.395  -4.154  -4.771
  636    HA   PHE  82           HA       PHE  82   8.167  -2.559  -6.451
  637   1HB   PHE  82          2HB       PHE  82   8.920  -3.549  -3.725
  638   2HB   PHE  82          3HB       PHE  82   9.318  -2.021  -4.510
  639    HD1  PHE  82           HD1      PHE  82   7.098  -3.682  -2.253
  640    HD2  PHE  82           HD2      PHE  82   7.353  -0.402  -5.015
  641    HE1  PHE  82           HE1      PHE  82   5.126  -2.628  -1.184
  642    HE2  PHE  82           HE2      PHE  82   5.381   0.651  -3.944
  643    HZ   PHE  82           HZ       PHE  82   4.267  -0.466  -2.032
  644    H    GLU  83           H        GLU  83   8.035  -5.817  -5.120
  645    HA   GLU  83           HA       GLU  83  10.740  -6.460  -5.897
  646   1HB   GLU  83          2HB       GLU  83   9.368  -7.481  -3.965
  647   2HB   GLU  83          3HB       GLU  83   8.612  -8.474  -5.210
  648   1HG   GLU  83          2HG       GLU  83  11.038  -9.024  -5.949
  649   2HG   GLU  83          3HG       GLU  83  11.505  -8.398  -4.369
  650    H    LEU  84           H        LEU  84   9.624  -5.474  -8.142
  651    HA   LEU  84           HA       LEU  84   8.483  -7.540  -9.807
  652   1HB   LEU  84          2HB       LEU  84   9.653  -4.842 -10.546
  653   2HB   LEU  84          3HB       LEU  84   8.709  -5.880 -11.613
  654    HG   LEU  84           HG       LEU  84   7.547  -5.094  -8.961
  655   1HD1  LEU  84          1HD1      LEU  84   7.892  -3.332 -11.382
  656   2HD1  LEU  84          2HD1      LEU  84   6.500  -3.133 -10.316
  657   3HD1  LEU  84          3HD1      LEU  84   8.133  -2.932  -9.681
  658   1HD2  LEU  84          1HD2      LEU  84   6.367  -5.527 -11.726
  659   2HD2  LEU  84          2HD2      LEU  84   6.420  -6.740 -10.447
  660   3HD2  LEU  84          3HD2      LEU  84   5.454  -5.280 -10.238
  661    H    GLU  85           H        GLU  85  10.669  -8.696  -8.798
  662    HA   GLU  85           HA       GLU  85  13.054  -8.287 -10.317
  663   1HB   GLU  85          2HB       GLU  85  12.854  -9.342  -7.998
  664   2HB   GLU  85          3HB       GLU  85  12.322 -10.807  -8.825
  665   1HG   GLU  85          2HG       GLU  85  14.393 -10.919 -10.083
  666   2HG   GLU  85          3HG       GLU  85  14.909  -9.357  -9.452
  667    H    HIS  86           H        HIS  86  13.325  -8.793 -12.377
  668    HA   HIS  86           HA       HIS  86  11.645 -10.857 -13.617
  669   1HB   HIS  86          2HB       HIS  86  13.483  -8.741 -14.761
  670   2HB   HIS  86          3HB       HIS  86  12.695  -9.973 -15.746
  671    HD1  HIS  86           HD1      HIS  86  10.501  -9.088 -13.016
  672    HD2  HIS  86           HD2      HIS  86  11.354  -7.451 -16.755
  673    HE1  HIS  86           HE1      HIS  86   8.584  -7.528 -13.570
  674    H    HIS  87           H        HIS  87  14.931  -9.953 -14.495
  675    HA   HIS  87           HA       HIS  87  16.065 -12.471 -13.596
  676   1HB   HIS  87          2HB       HIS  87  15.096 -13.192 -15.702
  677   2HB   HIS  87          3HB       HIS  87  15.801 -11.812 -16.543
  678    HD1  HIS  87           HD1      HIS  87  17.261 -13.289 -18.086
  679    HD2  HIS  87           HD2      HIS  87  18.024 -13.874 -14.029
  680    HE1  HIS  87           HE1      HIS  87  19.399 -14.636 -17.947
  681    H    HIS  88           H        HIS  88  16.443  -9.532 -15.540
  682    HA   HIS  88           HA       HIS  88  19.283  -9.430 -15.409
  683   1HB   HIS  88          2HB       HIS  88  17.721  -8.188 -17.021
  684   2HB   HIS  88          3HB       HIS  88  17.461  -7.042 -15.708
  685    HD1  HIS  88           HD1      HIS  88  19.813  -6.027 -14.667
  686    HD2  HIS  88           HD2      HIS  88  19.979  -7.632 -18.511
  687    HE1  HIS  88           HE1      HIS  88  21.922  -5.116 -15.734
  688    H    HIS  89           H        HIS  89  20.618  -8.618 -13.885
  689    HA   HIS  89           HA       HIS  89  19.809  -8.288 -11.232
  690   1HB   HIS  89          2HB       HIS  89  22.265  -7.006 -12.440
  691   2HB   HIS  89          3HB       HIS  89  22.038  -7.559 -10.780
  692    HD1  HIS  89           HD1      HIS  89  22.497  -8.874 -14.296
  693    HD2  HIS  89           HD2      HIS  89  22.465 -10.317 -10.385
  694    HE1  HIS  89           HE1      HIS  89  23.308 -11.270 -14.410
  695    H    HIS  90           H        HIS  90  19.783  -6.386  -9.884
  696    HA   HIS  90           HA       HIS  90  19.395  -3.825 -11.266
  697   1HB   HIS  90          2HB       HIS  90  17.190  -5.210 -10.805
  698   2HB   HIS  90          3HB       HIS  90  17.396  -4.581  -9.172
  699    HD1  HIS  90           HD1      HIS  90  15.665  -3.742 -12.101
  700    HD2  HIS  90           HD2      HIS  90  18.073  -1.522  -9.521
  701    HE1  HIS  90           HE1      HIS  90  15.078  -1.310 -12.487
  702    H    HIS  91           H        HIS  91  21.444  -3.365 -10.273
  703    HA   HIS  91           HA       HIS  91  21.321  -2.944  -7.349
  704   1HB   HIS  91          2HB       HIS  91  23.176  -4.393  -8.300
  705   2HB   HIS  91          3HB       HIS  91  23.799  -2.943  -9.086
  706    HD1  HIS  91           HD1      HIS  91  22.625  -1.365  -6.310
  707    HD2  HIS  91           HD2      HIS  91  25.678  -4.173  -6.716
  708    HE1  HIS  91           HE1      HIS  91  24.133  -1.079  -4.296
  Start of MODEL    7
    1   1H    MET   1          1HT       MET   1  13.606   0.641  -0.990
    2   2H    MET   1          2HT       MET   1  14.273   2.104  -1.537
    3   3H    MET   1          3HT       MET   1  14.997   0.627  -1.961
    4    HA   MET   1           HA       MET   1  12.567   1.889  -3.011
    5   1HB   MET   1          2HB       MET   1  15.071   0.596  -4.036
    6   2HB   MET   1          3HB       MET   1  13.637   0.588  -5.064
    7   1HG   MET   1          2HG       MET   1  13.474   3.010  -4.948
    8   2HG   MET   1          3HG       MET   1  14.796   3.079  -3.783
    9   1HE   MET   1          1HE       MET   1  14.246   4.227  -7.127
   10   2HE   MET   1          2HE       MET   1  15.961   4.608  -7.250
   11   3HE   MET   1          3HE       MET   1  15.099   4.934  -5.749
   12    H    LYS   2           H        LYS   2  13.298  -0.831  -1.282
   13    HA   LYS   2           HA       LYS   2  10.946  -2.228  -2.299
   14   1HB   LYS   2          2HB       LYS   2  12.239  -4.408  -2.347
   15   2HB   LYS   2          3HB       LYS   2  12.605  -3.285  -3.655
   16   1HG   LYS   2          2HG       LYS   2  14.694  -2.731  -2.785
   17   2HG   LYS   2          3HG       LYS   2  14.236  -3.162  -1.136
   18   1HD   LYS   2          2HD       LYS   2  14.179  -5.558  -1.800
   19   2HD   LYS   2          3HD       LYS   2  14.709  -5.103  -3.420
   20   1HE   LYS   2          2HE       LYS   2  16.683  -3.924  -2.183
   21   2HE   LYS   2          3HE       LYS   2  16.236  -4.960  -0.828
   22   1HZ   LYS   2          1HZ       LYS   2  16.487  -6.209  -3.454
   23   2HZ   LYS   2          1HZ       LYS   2  16.866  -6.825  -1.918
   24   3HZ   LYS   2          3HZ       LYS   2  17.922  -5.736  -2.683
   25    H    ILE   3           H        ILE   3  10.810  -0.992  -0.017
   26    HA   ILE   3           HA       ILE   3  10.408  -1.189   2.229
   27    HB   ILE   3           HB       ILE   3  10.419  -4.153   1.629
   28   1HG1  ILE   3          2HG1      ILE   3   8.007  -2.330   1.676
   29   2HG1  ILE   3          3HG1      ILE   3   8.907  -2.624   0.188
   30   1HG2  ILE   3          1HG2      ILE   3   8.896  -4.259   3.574
   31   2HG2  ILE   3          2HG2      ILE   3  10.461  -3.588   4.032
   32   3HG2  ILE   3          3HG2      ILE   3   9.076  -2.520   3.806
   33   1HD1  ILE   3          1HD1      ILE   3   7.602  -4.736   1.930
   34   2HD1  ILE   3          2HD1      ILE   3   7.039  -4.196   0.350
   35   3HD1  ILE   3          3HD1      ILE   3   8.566  -5.067   0.490
   36    H    ILE   4           H        ILE   4  12.204  -0.465   3.265
   37    HA   ILE   4           HA       ILE   4  14.475  -2.316   3.615
   38    HB   ILE   4           HB       ILE   4  14.514   0.555   4.483
   39   1HG1  ILE   4          2HG1      ILE   4  13.582   0.562   2.183
   40   2HG1  ILE   4          3HG1      ILE   4  15.211   1.226   2.226
   41   1HG2  ILE   4          1HG2      ILE   4  16.902   0.282   3.728
   42   2HG2  ILE   4          2HG2      ILE   4  16.440  -0.795   5.044
   43   3HG2  ILE   4          3HG2      ILE   4  16.548  -1.413   3.397
   44   1HD1  ILE   4          1HD1      ILE   4  16.130  -0.920   1.460
   45   2HD1  ILE   4          2HD1      ILE   4  14.515  -1.627   1.466
   46   3HD1  ILE   4          3HD1      ILE   4  14.910  -0.342   0.327
   47    H    SER   5           H        SER   5  11.811  -0.937   5.258
   48    HA   SER   5           HA       SER   5  12.367  -2.402   7.653
   49   1HB   SER   5          2HB       SER   5  13.883  -0.401   7.915
   50   2HB   SER   5          3HB       SER   5  12.443   0.611   7.918
   51    HG   SER   5           HG       SER   5  13.445  -1.089   9.847
   52    H    ILE   6           H        ILE   6  10.410  -3.097   8.194
   53    HA   ILE   6           HA       ILE   6   8.049  -1.505   7.498
   54    HB   ILE   6           HB       ILE   6   8.451  -4.362   8.375
   55   1HG1  ILE   6          2HG1      ILE   6   8.716  -3.475   5.936
   56   2HG1  ILE   6          3HG1      ILE   6   7.733  -4.912   6.203
   57   1HG2  ILE   6          1HG2      ILE   6   5.898  -2.742   8.217
   58   2HG2  ILE   6          2HG2      ILE   6   5.905  -4.501   8.094
   59   3HG2  ILE   6          3HG2      ILE   6   6.485  -3.719   9.563
   60   1HD1  ILE   6          1HD1      ILE   6   5.724  -3.761   5.872
   61   2HD1  ILE   6          2HD1      ILE   6   6.440  -2.196   6.254
   62   3HD1  ILE   6          3HD1      ILE   6   6.790  -2.972   4.710
   63    H    SER   7           H        SER   7   6.386  -1.096   8.995
   64    HA   SER   7           HA       SER   7   5.494  -0.395  10.970
   65   1HB   SER   7          2HB       SER   7   5.856  -2.803  11.545
   66   2HB   SER   7          3HB       SER   7   7.397  -2.348  12.266
   67    HG   SER   7           HG       SER   7   5.231  -2.391  13.534
   68    H    GLU   8           H        GLU   8   5.748   1.181  12.384
   69    HA   GLU   8           HA       GLU   8   8.119   1.906  13.718
   70   1HB   GLU   8          2HB       GLU   8   8.011   2.746  11.033
   71   2HB   GLU   8          3HB       GLU   8   7.677   4.169  12.009
   72   1HG   GLU   8          2HG       GLU   8  10.050   2.314  12.381
   73   2HG   GLU   8          3HG       GLU   8  10.113   3.898  11.613
   74    H    THR   9           H        THR   9   4.988   2.098  12.969
   75    HA   THR   9           HA       THR   9   4.400   4.421  14.680
   76    HB   THR   9           HB       THR   9   2.498   2.931  12.854
   77    HG1  THR   9           HG1      THR   9   4.505   4.567  12.244
   78   1HG2  THR   9          1HG2      THR   9   1.094   4.892  13.122
   79   2HG2  THR   9          2HG2      THR   9   1.526   4.290  14.722
   80   3HG2  THR   9          3HG2      THR   9   2.345   5.706  14.063
   81    HA   PRO  10           HA       PRO  10   3.395   1.519  17.847
   82   1HB   PRO  10          2HB       PRO  10   1.568   3.348  19.116
   83   2HB   PRO  10          3HB       PRO  10   3.211   2.923  19.607
   84   1HG   PRO  10          2HG       PRO  10   2.284   5.338  18.415
   85   2HG   PRO  10          3HG       PRO  10   3.919   4.925  18.943
   86   1HD   PRO  10          2HD       PRO  10   2.971   5.187  16.258
   87   2HD   PRO  10          3HD       PRO  10   4.592   4.705  16.794
   88    H    ASN  11           H        ASN  11   1.394   2.431  15.413
   89    HA   ASN  11           HA       ASN  11  -1.077   1.299  16.496
   90   1HB   ASN  11          2HB       ASN  11  -0.894   3.355  14.915
   91   2HB   ASN  11          3HB       ASN  11  -0.657   2.160  13.641
   92   1HD2  ASN  11          2HD2      ASN  11  -2.837   3.172  12.902
   93   2HD2  ASN  11          1HD2      ASN  11  -4.253   2.483  13.535
   94    H    HIS  12           H        HIS  12  -2.238  -0.169  14.703
   95    HA   HIS  12           HA       HIS  12  -0.320  -2.117  13.617
   96   1HB   HIS  12          2HB       HIS  12  -1.265  -3.964  14.711
   97   2HB   HIS  12          3HB       HIS  12  -1.179  -2.739  15.975
   98    HD1  HIS  12           HD1      HIS  12  -3.392  -1.786  16.871
   99    HD2  HIS  12           HD2      HIS  12  -3.924  -4.477  13.732
  100    HE1  HIS  12           HE1      HIS  12  -5.873  -2.285  16.767
  101    H    ASN  13           H        ASN  13  -2.992  -0.205  13.147
  102    HA   ASN  13           HA       ASN  13  -4.441  -2.000  11.372
  103   1HB   ASN  13          2HB       ASN  13  -4.783   0.929  12.049
  104   2HB   ASN  13          3HB       ASN  13  -5.829   0.050  10.935
  105   1HD2  ASN  13          2HD2      ASN  13  -7.523  -1.163  11.848
  106   2HD2  ASN  13          1HD2      ASN  13  -7.697  -1.453  13.513
  107    H    THR  14           H        THR  14  -1.821   0.163  11.188
  108    HA   THR  14           HA       THR  14  -1.629  -0.232   8.313
  109    HB   THR  14           HB       THR  14  -2.885   1.848   8.360
  110    HG1  THR  14           HG1      THR  14  -1.566   2.466   6.878
  111   1HG2  THR  14          1HG2      THR  14  -2.065   2.330  10.793
  112   2HG2  THR  14          2HG2      THR  14  -0.709   3.134  10.003
  113   3HG2  THR  14          3HG2      THR  14  -2.355   3.693   9.714
  114    H    MET  15           H        MET  15   0.453  -0.561   7.740
  115    HA   MET  15           HA       MET  15   2.493  -0.163   9.825
  116   1HB   MET  15          2HB       MET  15   2.440  -1.880   7.338
  117   2HB   MET  15          3HB       MET  15   3.860  -1.697   8.367
  118   1HG   MET  15          2HG       MET  15   2.263  -2.366  10.309
  119   2HG   MET  15          3HG       MET  15   1.208  -2.965   9.031
  120   1HE   MET  15          1HE       MET  15   1.930  -4.114   7.164
  121   2HE   MET  15          2HE       MET  15   2.607  -5.723   7.396
  122   3HE   MET  15          3HE       MET  15   3.636  -4.417   6.815
  123    H    LYS  16           H        LYS  16   4.586   0.620   9.274
  124    HA   LYS  16           HA       LYS  16   4.503   2.768   7.271
  125   1HB   LYS  16          2HB       LYS  16   5.144   3.325   9.599
  126   2HB   LYS  16          3HB       LYS  16   6.498   2.204   9.485
  127   1HG   LYS  16          2HG       LYS  16   6.245   4.321   7.382
  128   2HG   LYS  16          3HG       LYS  16   6.812   4.800   8.982
  129   1HD   LYS  16          2HD       LYS  16   8.308   2.550   8.563
  130   2HD   LYS  16          3HD       LYS  16   8.158   3.161   6.916
  131   1HE   LYS  16          2HE       LYS  16   9.429   4.465   9.306
  132   2HE   LYS  16          3HE       LYS  16  10.060   4.288   7.670
  133   1HZ   LYS  16          1HZ       LYS  16   9.354   6.350   7.332
  134   2HZ   LYS  16          1HZ       LYS  16   8.468   6.379   8.781
  135   3HZ   LYS  16          3HZ       LYS  16   7.770   5.745   7.367
  136    H    ILE  17           H        ILE  17   5.418   2.446   5.346
  137    HA   ILE  17           HA       ILE  17   7.357   0.259   5.010
  138    HB   ILE  17           HB       ILE  17   5.745   1.880   3.027
  139   1HG1  ILE  17          2HG1      ILE  17   5.725  -1.088   3.668
  140   2HG1  ILE  17          3HG1      ILE  17   4.596   0.072   4.368
  141   1HG2  ILE  17          1HG2      ILE  17   6.721   0.090   1.417
  142   2HG2  ILE  17          2HG2      ILE  17   7.754   1.446   1.863
  143   3HG2  ILE  17          3HG2      ILE  17   7.972  -0.122   2.641
  144   1HD1  ILE  17          1HD1      ILE  17   3.479  -0.885   2.477
  145   2HD1  ILE  17          2HD1      ILE  17   3.985   0.731   1.982
  146   3HD1  ILE  17          3HD1      ILE  17   4.899  -0.682   1.452
  147    H    THR  18           H        THR  18   9.410   0.849   5.317
  148    HA   THR  18           HA       THR  18  10.309   3.562   4.770
  149    HB   THR  18           HB       THR  18  11.957   1.181   5.650
  150    HG1  THR  18           HG1      THR  18  11.529   2.673   7.683
  151   1HG2  THR  18          1HG2      THR  18  13.385   3.002   6.613
  152   2HG2  THR  18          2HG2      THR  18  13.296   3.043   4.853
  153   3HG2  THR  18          3HG2      THR  18  12.349   4.182   5.810
  154    H    LEU  19           H        LEU  19  11.630   4.193   3.130
  155    HA   LEU  19           HA       LEU  19  12.206   2.183   1.035
  156   1HB   LEU  19          2HB       LEU  19  11.902   5.169   0.659
  157   2HB   LEU  19          3HB       LEU  19  12.001   3.936  -0.598
  158    HG   LEU  19           HG       LEU  19   9.801   3.963   1.484
  159   1HD1  LEU  19          1HD1      LEU  19   9.543   6.035   0.315
  160   2HD1  LEU  19          2HD1      LEU  19   9.930   5.288  -1.234
  161   3HD1  LEU  19          3HD1      LEU  19   8.408   4.910  -0.430
  162   1HD2  LEU  19          1HD2      LEU  19  10.233   2.574  -1.177
  163   2HD2  LEU  19          2HD2      LEU  19  10.037   1.824   0.408
  164   3HD2  LEU  19          3HD2      LEU  19   8.667   2.621  -0.366
  165    H    SER  20           H        SER  20  14.205   2.317  -0.061
  166    HA   SER  20           HA       SER  20  16.442   2.995   1.560
  167   1HB   SER  20          2HB       SER  20  16.518   1.178  -0.105
  168   2HB   SER  20          3HB       SER  20  16.318   2.355  -1.400
  169    HG   SER  20           HG       SER  20  18.327   2.982   0.347
  170    H    GLU  21           H        GLU  21  14.369   4.941  -0.098
  171    HA   GLU  21           HA       GLU  21  16.361   6.828  -1.070
  172   1HB   GLU  21          2HB       GLU  21  13.917   6.176  -2.033
  173   2HB   GLU  21          3HB       GLU  21  13.494   7.577  -1.050
  174   1HG   GLU  21          2HG       GLU  21  14.049   8.614  -3.053
  175   2HG   GLU  21          3HG       GLU  21  15.601   8.657  -2.222
  176    H    SER  22           H        SER  22  16.304   9.073  -0.423
  177    HA   SER  22           HA       SER  22  15.066   9.696   2.150
  178   1HB   SER  22          2HB       SER  22  18.044  10.034   1.730
  179   2HB   SER  22          3HB       SER  22  17.132  10.374   3.198
  180    HG   SER  22           HG       SER  22  16.699   7.851   2.310
  181    H    ARG  23           H        ARG  23  16.499  12.075   2.601
  182    HA   ARG  23           HA       ARG  23  16.156  14.310   2.085
  183   1HB   ARG  23          2HB       ARG  23  17.218  13.571  -0.637
  184   2HB   ARG  23          3HB       ARG  23  17.529  15.024   0.312
  185   1HG   ARG  23          2HG       ARG  23  18.678  13.544   2.020
  186   2HG   ARG  23          3HG       ARG  23  18.544  12.223   0.858
  187   1HD   ARG  23          2HD       ARG  23  20.020  13.219  -0.650
  188   2HD   ARG  23          3HD       ARG  23  19.745  14.836  -0.008
  189    HE   ARG  23           HE       ARG  23  21.075  14.144   1.961
  190   1HH1  ARG  23          1HH2      ARG  23  21.927  13.256  -1.178
  191   2HH1  ARG  23          2HH2      ARG  23  23.177  12.149  -0.719
  192   1HH2  ARG  23          1HH1      ARG  23  22.425  12.276   2.660
  193   2HH2  ARG  23          2HH1      ARG  23  23.458  11.595   1.449
  194    H    GLU  24           H        GLU  24  15.862  15.116  -0.838
  195    HA   GLU  24           HA       GLU  24  14.038  15.994  -1.979
  196   1HB   GLU  24          2HB       GLU  24  14.605  13.850  -3.102
  197   2HB   GLU  24          3HB       GLU  24  13.415  13.031  -2.094
  198   1HG   GLU  24          2HG       GLU  24  11.718  14.749  -2.989
  199   2HG   GLU  24          3HG       GLU  24  12.937  15.154  -4.194
  200    H    GLY  25           H        GLY  25  12.122  13.253  -0.980
  201   1HA   GLY  25          1HA       GLY  25  10.786  13.784   1.230
  202   2HA   GLY  25          2HA       GLY  25  10.151  15.066   0.202
  203    H    MET  26           H        MET  26  10.673  12.962  -2.070
  204    HA   MET  26           HA       MET  26   9.314  11.604  -3.333
  205   1HB   MET  26          2HB       MET  26   9.995  10.173  -1.224
  206   2HB   MET  26          3HB       MET  26   8.287  10.334  -0.820
  207   1HG   MET  26          2HG       MET  26   8.566   8.305  -2.115
  208   2HG   MET  26          3HG       MET  26   7.727   9.486  -3.119
  209   1HE   MET  26          1HE       MET  26  10.191   6.866  -3.111
  210   2HE   MET  26          2HE       MET  26  11.173   7.970  -2.149
  211   3HE   MET  26          3HE       MET  26  11.717   7.488  -3.754
  212    H    THR  27           H        THR  27   8.235  14.126  -2.093
  213    HA   THR  27           HA       THR  27   6.258  15.264  -1.848
  214    HB   THR  27           HB       THR  27   4.664  14.923  -3.604
  215    HG1  THR  27           HG1      THR  27   5.884  12.398  -4.004
  216   1HG2  THR  27          1HG2      THR  27   6.922  15.730  -4.282
  217   2HG2  THR  27          2HG2      THR  27   7.380  14.065  -4.639
  218   3HG2  THR  27          3HG2      THR  27   6.103  14.848  -5.570
  219    H    SER  28           H        SER  28   3.592  14.429  -2.054
  220    HA   SER  28           HA       SER  28   3.177  12.179  -0.273
  221   1HB   SER  28          2HB       SER  28   2.098  13.477   1.494
  222   2HB   SER  28          3HB       SER  28   3.768  14.001   1.297
  223    HG   SER  28           HG       SER  28   1.689  15.518   1.246
  224    H    ASP  29           H        ASP  29   1.213  11.288  -0.601
  225    HA   ASP  29           HA       ASP  29  -1.016  12.850  -1.602
  226   1HB   ASP  29          2HB       ASP  29   0.564  11.010  -3.347
  227   2HB   ASP  29          3HB       ASP  29  -1.187  11.051  -3.541
  228    H    THR  30           H        THR  30  -2.972  11.871  -1.277
  229    HA   THR  30           HA       THR  30  -2.914   9.343   0.241
  230    HB   THR  30           HB       THR  30  -5.164  11.357   0.008
  231    HG1  THR  30           HG1      THR  30  -3.879  11.195   2.386
  232   1HG2  THR  30          1HG2      THR  30  -5.572  10.099   2.336
  233   2HG2  THR  30          2HG2      THR  30  -6.204   9.468   0.816
  234   3HG2  THR  30          3HG2      THR  30  -4.715   8.809   1.494
  235    H    TYR  31           H        TYR  31  -3.524   7.546  -0.787
  236    HA   TYR  31           HA       TYR  31  -5.158   7.804  -3.234
  237   1HB   TYR  31          2HB       TYR  31  -3.466   5.451  -2.367
  238   2HB   TYR  31          3HB       TYR  31  -4.208   5.712  -3.945
  239    HD1  TYR  31           HD1      TYR  31  -1.159   5.782  -2.378
  240    HD2  TYR  31           HD2      TYR  31  -3.644   8.312  -4.807
  241    HE1  TYR  31           HE1      TYR  31   0.844   7.041  -3.119
  242    HE2  TYR  31           HE2      TYR  31  -1.640   9.569  -5.546
  243    HH   TYR  31           HH       TYR  31   1.538   8.951  -4.141
  244    H    THR  32           H        THR  32  -7.233   7.402  -2.943
  245    HA   THR  32           HA       THR  32  -8.029   5.147  -1.209
  246    HB   THR  32           HB       THR  32 -10.096   6.632  -0.690
  247    HG1  THR  32           HG1      THR  32  -8.864   8.225  -2.276
  248   1HG2  THR  32          1HG2      THR  32  -7.324   7.071   0.436
  249   2HG2  THR  32          2HG2      THR  32  -8.760   7.805   1.149
  250   3HG2  THR  32          3HG2      THR  32  -8.612   6.050   1.079
  251    H    LYS  33           H        LYS  33  -7.971   6.319  -4.270
  252    HA   LYS  33           HA       LYS  33 -10.131   4.582  -5.109
  253   1HB   LYS  33          2HB       LYS  33 -11.194   6.462  -6.473
  254   2HB   LYS  33          3HB       LYS  33 -11.493   6.493  -4.736
  255   1HG   LYS  33          2HG       LYS  33 -10.112   8.320  -4.385
  256   2HG   LYS  33          3HG       LYS  33  -9.096   7.956  -5.780
  257   1HD   LYS  33          2HD       LYS  33 -11.958   8.667  -6.280
  258   2HD   LYS  33          3HD       LYS  33 -10.847   9.964  -5.839
  259   1HE   LYS  33          2HE       LYS  33  -9.496   9.622  -7.734
  260   2HE   LYS  33          3HE       LYS  33 -10.112   7.991  -7.994
  261   1HZ   LYS  33          1HZ       LYS  33 -11.799   8.762  -9.193
  262   2HZ   LYS  33          1HZ       LYS  33 -10.984  10.253  -9.235
  263   3HZ   LYS  33          3HZ       LYS  33 -12.179   9.967  -8.061
  264    H    VAL  34           H        VAL  34  -7.198   4.957  -5.469
  265    HA   VAL  34           HA       VAL  34  -5.595   4.856  -7.120
  266    HB   VAL  34           HB       VAL  34  -7.876   3.785  -8.787
  267   1HG1  VAL  34          1HG1      VAL  34  -5.788   2.247  -9.414
  268   2HG1  VAL  34          2HG1      VAL  34  -6.053   3.795 -10.214
  269   3HG1  VAL  34          3HG1      VAL  34  -4.888   3.672  -8.894
  270   1HG2  VAL  34          1HG2      VAL  34  -6.257   2.501  -6.582
  271   2HG2  VAL  34          2HG2      VAL  34  -8.012   2.593  -6.725
  272   3HG2  VAL  34          3HG2      VAL  34  -7.092   1.552  -7.810
  273    H    ASP  35           H        ASP  35  -5.213   5.363  -9.588
  274    HA   ASP  35           HA       ASP  35  -5.020   6.995 -11.187
  275   1HB   ASP  35          2HB       ASP  35  -7.891   7.705 -10.585
  276   2HB   ASP  35          3HB       ASP  35  -7.024   7.869 -12.110
  277    H    ASP  36           H        ASP  36  -3.573   8.350 -10.200
  278    HA   ASP  36           HA       ASP  36  -4.488  10.977  -9.517
  279   1HB   ASP  36          2HB       ASP  36  -4.877   9.587  -7.390
  280   2HB   ASP  36          3HB       ASP  36  -3.125   9.471  -7.279
  281    H    SER  37           H        SER  37  -1.896   8.601  -9.245
  282    HA   SER  37           HA       SER  37  -0.038   9.674 -10.926
  283   1HB   SER  37          2HB       SER  37   0.248  11.728  -9.859
  284   2HB   SER  37          3HB       SER  37  -0.014  11.048  -8.256
  285    HG   SER  37           HG       SER  37   2.254  10.813  -9.939
  286    H    GLN  38           H        GLN  38  -0.811   8.023  -8.004
  287    HA   GLN  38           HA       GLN  38   1.536   6.844  -7.202
  288   1HB   GLN  38          2HB       GLN  38   0.178   5.028  -6.315
  289   2HB   GLN  38          3HB       GLN  38  -0.662   6.558  -6.083
  290   1HG   GLN  38          2HG       GLN  38  -1.212   5.021  -8.590
  291   2HG   GLN  38          3HG       GLN  38  -1.919   4.437  -7.090
  292   1HE2  GLN  38          2HE2      GLN  38  -3.422   5.915  -5.945
  293   2HE2  GLN  38          1HE2      GLN  38  -4.178   7.178  -6.789
  294    HA   PRO  39           HA       PRO  39   3.061   4.341 -10.477
  295   1HB   PRO  39          2HB       PRO  39   3.704   2.099  -8.795
  296   2HB   PRO  39          3HB       PRO  39   4.799   3.332  -9.433
  297   1HG   PRO  39          2HG       PRO  39   3.805   3.013  -6.766
  298   2HG   PRO  39          3HG       PRO  39   5.004   4.157  -7.374
  299   1HD   PRO  39          2HD       PRO  39   2.373   4.757  -6.518
  300   2HD   PRO  39          3HD       PRO  39   3.501   5.855  -7.336
  301    H    ALA  40           H        ALA  40   2.238   2.787 -11.869
  302    HA   ALA  40           HA       ALA  40  -0.350   1.851 -11.659
  303   1HB   ALA  40          1HB       ALA  40   0.298   0.119 -13.335
  304   2HB   ALA  40          2HB       ALA  40   0.852   1.737 -13.766
  305   3HB   ALA  40          3HB       ALA  40   1.987   0.566 -13.094
  306    H    PHE  41           H        PHE  41   2.649   0.293 -10.655
  307    HA   PHE  41           HA       PHE  41   1.690  -2.192  -9.859
  308   1HB   PHE  41          2HB       PHE  41   3.823  -0.656  -8.371
  309   2HB   PHE  41          3HB       PHE  41   3.687  -2.402  -8.584
  310    HD1  PHE  41           HD1      PHE  41   5.343   0.468  -9.736
  311    HD2  PHE  41           HD2      PHE  41   3.521  -3.150 -11.173
  312    HE1  PHE  41           HE1      PHE  41   6.680   0.620 -11.818
  313    HE2  PHE  41           HE2      PHE  41   4.858  -2.995 -13.255
  314    HZ   PHE  41           HZ       PHE  41   6.437  -1.110 -13.578
  315    H    ILE  42           H        ILE  42   1.634   0.912  -8.157
  316    HA   ILE  42           HA       ILE  42   0.700  -0.164  -5.672
  317    HB   ILE  42           HB       ILE  42   1.007   2.573  -6.838
  318   1HG1  ILE  42          2HG1      ILE  42   2.770   1.240  -5.523
  319   2HG1  ILE  42          3HG1      ILE  42   2.456   2.886  -4.978
  320   1HG2  ILE  42          1HG2      ILE  42  -1.176   2.819  -5.874
  321   2HG2  ILE  42          2HG2      ILE  42  -0.727   1.875  -4.454
  322   3HG2  ILE  42          3HG2      ILE  42  -0.036   3.479  -4.701
  323   1HD1  ILE  42          1HD1      ILE  42   0.757   0.783  -3.754
  324   2HD1  ILE  42          2HD1      ILE  42   2.464   0.747  -3.310
  325   3HD1  ILE  42          3HD1      ILE  42   1.507   2.199  -3.017
  326    H    ASN  43           H        ASN  43  -0.835   0.754  -8.667
  327    HA   ASN  43           HA       ASN  43  -3.453   1.226  -7.733
  328   1HB   ASN  43          2HB       ASN  43  -2.640  -0.079 -10.343
  329   2HB   ASN  43          3HB       ASN  43  -4.176   0.691  -9.995
  330   1HD2  ASN  43          2HD2      ASN  43  -1.785   2.509  -8.458
  331   2HD2  ASN  43          1HD2      ASN  43  -1.537   3.668  -9.672
  332    H    ASP  44           H        ASP  44  -1.695  -1.707  -8.607
  333    HA   ASP  44           HA       ASP  44  -3.766  -3.579  -8.444
  334   1HB   ASP  44          2HB       ASP  44  -1.336  -3.939  -9.176
  335   2HB   ASP  44          3HB       ASP  44  -0.958  -4.097  -7.462
  336    H    ILE  45           H        ILE  45  -1.646  -2.275  -5.920
  337    HA   ILE  45           HA       ILE  45  -2.543  -3.817  -3.759
  338    HB   ILE  45           HB       ILE  45  -1.613  -0.931  -3.702
  339   1HG1  ILE  45          2HG1      ILE  45  -0.089  -3.556  -3.685
  340   2HG1  ILE  45          3HG1      ILE  45   0.022  -2.272  -4.887
  341   1HG2  ILE  45          1HG2      ILE  45  -2.676  -1.865  -1.610
  342   2HG2  ILE  45          2HG2      ILE  45  -1.405  -3.087  -1.584
  343   3HG2  ILE  45          3HG2      ILE  45  -0.993  -1.381  -1.415
  344   1HD1  ILE  45          1HD1      ILE  45   1.787  -1.545  -3.660
  345   2HD1  ILE  45          2HD1      ILE  45   0.566  -0.912  -2.556
  346   3HD1  ILE  45          3HD1      ILE  45   1.306  -2.483  -2.246
  347    H    LEU  46           H        LEU  46  -3.481  -0.455  -4.506
  348    HA   LEU  46           HA       LEU  46  -5.500  -0.069  -2.727
  349   1HB   LEU  46          2HB       LEU  46  -5.269   0.830  -5.592
  350   2HB   LEU  46          3HB       LEU  46  -6.572   1.376  -4.535
  351    HG   LEU  46           HG       LEU  46  -3.673   1.573  -3.702
  352   1HD1  LEU  46          1HD1      LEU  46  -4.154   2.793  -5.897
  353   2HD1  LEU  46          2HD1      LEU  46  -5.260   3.811  -4.976
  354   3HD1  LEU  46          3HD1      LEU  46  -3.543   3.789  -4.577
  355   1HD2  LEU  46          1HD2      LEU  46  -4.738   3.506  -2.366
  356   2HD2  LEU  46          2HD2      LEU  46  -6.291   2.807  -2.823
  357   3HD2  LEU  46          3HD2      LEU  46  -5.149   1.868  -1.861
  358    H    LYS  47           H        LYS  47  -5.714  -1.978  -5.700
  359    HA   LYS  47           HA       LYS  47  -8.576  -2.352  -5.454
  360   1HB   LYS  47          2HB       LYS  47  -6.457  -3.417  -7.304
  361   2HB   LYS  47          3HB       LYS  47  -8.093  -4.075  -7.319
  362   1HG   LYS  47          2HG       LYS  47  -9.035  -2.099  -8.090
  363   2HG   LYS  47          3HG       LYS  47  -7.749  -1.099  -7.410
  364   1HD   LYS  47          2HD       LYS  47  -6.291  -1.527  -9.178
  365   2HD   LYS  47          3HD       LYS  47  -7.082  -3.047  -9.598
  366   1HE   LYS  47          2HE       LYS  47  -8.542  -0.423  -9.881
  367   2HE   LYS  47          3HE       LYS  47  -7.467  -1.002 -11.154
  368   1HZ   LYS  47          1HZ       LYS  47 -10.024  -1.661 -11.018
  369   2HZ   LYS  47          1HZ       LYS  47  -9.372  -2.926 -10.091
  370   3HZ   LYS  47          3HZ       LYS  47  -8.847  -2.682 -11.688
  371    H    VAL  48           H        VAL  48  -5.839  -3.844  -4.057
  372    HA   VAL  48           HA       VAL  48  -6.952  -6.495  -3.808
  373    HB   VAL  48           HB       VAL  48  -4.576  -5.108  -2.562
  374   1HG1  VAL  48          1HG1      VAL  48  -3.995  -7.413  -1.686
  375   2HG1  VAL  48          2HG1      VAL  48  -5.339  -6.629  -0.858
  376   3HG1  VAL  48          3HG1      VAL  48  -5.653  -7.894  -2.048
  377   1HG2  VAL  48          1HG2      VAL  48  -4.724  -6.007  -5.019
  378   2HG2  VAL  48          2HG2      VAL  48  -3.305  -6.404  -4.050
  379   3HG2  VAL  48          3HG2      VAL  48  -4.591  -7.593  -4.263
  380    H    GLU  49           H        GLU  49  -8.545  -7.039  -2.463
  381    HA   GLU  49           HA       GLU  49  -9.740  -5.350  -0.597
  382   1HB   GLU  49          2HB       GLU  49 -11.050  -7.189   0.065
  383   2HB   GLU  49          3HB       GLU  49 -10.631  -7.539  -1.610
  384   1HG   GLU  49          2HG       GLU  49  -8.625  -8.846  -0.653
  385   2HG   GLU  49          3HG       GLU  49  -9.452  -8.739   0.899
  386    H    GLY  50           H        GLY  50  -9.590  -5.076   1.609
  387   1HA   GLY  50          1HA       GLY  50  -8.753  -5.428   3.784
  388   2HA   GLY  50          2HA       GLY  50  -7.561  -6.544   3.127
  389    H    VAL  51           H        VAL  51  -7.539  -3.987   1.110
  390    HA   VAL  51           HA       VAL  51  -5.057  -2.966   2.162
  391    HB   VAL  51           HB       VAL  51  -6.590  -2.615  -0.379
  392   1HG1  VAL  51          1HG1      VAL  51  -4.364  -0.821   0.635
  393   2HG1  VAL  51          2HG1      VAL  51  -4.809  -0.954  -1.064
  394   3HG1  VAL  51          3HG1      VAL  51  -5.972  -0.325   0.103
  395   1HG2  VAL  51          1HG2      VAL  51  -3.780  -3.409   0.444
  396   2HG2  VAL  51          2HG2      VAL  51  -5.032  -4.463  -0.208
  397   3HG2  VAL  51          3HG2      VAL  51  -4.287  -3.241  -1.231
  398    H    LYS  52           H        LYS  52  -8.327  -2.028   2.395
  399    HA   LYS  52           HA       LYS  52  -9.451  -0.237   3.217
  400   1HB   LYS  52          2HB       LYS  52  -8.291  -0.876   5.260
  401   2HB   LYS  52          3HB       LYS  52  -6.872   0.044   4.773
  402   1HG   LYS  52          2HG       LYS  52  -7.807   2.048   5.333
  403   2HG   LYS  52          3HG       LYS  52  -9.407   1.573   4.766
  404   1HD   LYS  52          2HD       LYS  52  -8.227   0.371   7.270
  405   2HD   LYS  52          3HD       LYS  52  -9.080   1.913   7.317
  406   1HE   LYS  52          2HE       LYS  52 -11.123   0.959   6.722
  407   2HE   LYS  52          3HE       LYS  52 -10.364  -0.430   5.943
  408   1HZ   LYS  52          1HZ       LYS  52  -9.541  -0.987   8.279
  409   2HZ   LYS  52          1HZ       LYS  52 -11.179  -1.273   7.927
  410   3HZ   LYS  52          3HZ       LYS  52 -10.726   0.098   8.825
  411    H    SER  53           H        SER  53  -6.120   0.943   3.107
  412    HA   SER  53           HA       SER  53  -6.518   2.666   0.882
  413   1HB   SER  53          2HB       SER  53  -6.440   4.844   2.178
  414   2HB   SER  53          3HB       SER  53  -7.971   3.977   2.251
  415    HG   SER  53           HG       SER  53  -6.141   3.251   4.174
  416    H    ILE  54           H        ILE  54  -4.778   4.444   0.856
  417    HA   ILE  54           HA       ILE  54  -2.338   3.562   2.252
  418    HB   ILE  54           HB       ILE  54  -2.538   4.167  -0.712
  419   1HG1  ILE  54          2HG1      ILE  54  -1.823   1.572   0.693
  420   2HG1  ILE  54          3HG1      ILE  54  -3.418   1.917   0.026
  421   1HG2  ILE  54          1HG2      ILE  54  -0.422   4.954   0.111
  422   2HG2  ILE  54          2HG2      ILE  54  -0.209   3.519   1.115
  423   3HG2  ILE  54          3HG2      ILE  54  -0.116   3.389  -0.641
  424   1HD1  ILE  54          1HD1      ILE  54  -2.011   2.498  -2.152
  425   2HD1  ILE  54          2HD1      ILE  54  -0.835   1.418  -1.402
  426   3HD1  ILE  54          3HD1      ILE  54  -2.454   0.832  -1.780
  427    H    PHE  55           H        PHE  55  -0.860   5.199   2.662
  428    HA   PHE  55           HA       PHE  55  -1.640   7.933   1.884
  429   1HB   PHE  55          2HB       PHE  55  -2.489   7.514   4.162
  430   2HB   PHE  55          3HB       PHE  55  -0.867   7.057   4.679
  431    HD1  PHE  55           HD1      PHE  55   0.342   8.709   5.787
  432    HD2  PHE  55           HD2      PHE  55  -2.478   9.860   2.757
  433    HE1  PHE  55           HE1      PHE  55   0.879  11.095   6.193
  434    HE2  PHE  55           HE2      PHE  55  -1.938  12.247   3.162
  435    HZ   PHE  55           HZ       PHE  55  -0.260  12.862   4.880
  436    H    HIS  56           H        HIS  56   0.007   8.561   0.651
  437    HA   HIS  56           HA       HIS  56   2.740   7.728   1.303
  438   1HB   HIS  56          2HB       HIS  56   1.713   7.681  -1.059
  439   2HB   HIS  56          3HB       HIS  56   1.905   9.433  -1.038
  440    HD1  HIS  56           HD1      HIS  56   3.628   6.671  -2.281
  441    HD2  HIS  56           HD2      HIS  56   4.849   9.908   0.043
  442    HE1  HIS  56           HE1      HIS  56   6.140   6.841  -2.552
  443    H    VAL  57           H        VAL  57   4.165   9.023   2.266
  444    HA   VAL  57           HA       VAL  57   4.090  11.886   2.017
  445    HB   VAL  57           HB       VAL  57   2.307  11.363   3.758
  446   1HG1  VAL  57          1HG1      VAL  57   4.691  10.752   5.517
  447   2HG1  VAL  57          2HG1      VAL  57   2.981  10.616   5.926
  448   3HG1  VAL  57          3HG1      VAL  57   3.706   9.488   4.780
  449   1HG2  VAL  57          1HG2      VAL  57   4.661  12.946   4.824
  450   2HG2  VAL  57          2HG2      VAL  57   3.618  13.539   3.531
  451   3HG2  VAL  57          3HG2      VAL  57   2.946  13.223   5.131
  452    H    MET  58           H        MET  58   6.001  12.855   2.740
  453    HA   MET  58           HA       MET  58   8.279  12.902   3.032
  454   1HB   MET  58          2HB       MET  58   7.223  12.293   5.374
  455   2HB   MET  58          3HB       MET  58   8.028  10.750   5.099
  456   1HG   MET  58          2HG       MET  58   9.786  11.854   6.087
  457   2HG   MET  58          3HG       MET  58  10.049  12.408   4.435
  458   1HE   MET  58          1HE       MET  58   8.637  14.536   8.117
  459   2HE   MET  58          2HE       MET  58   8.702  12.811   7.762
  460   3HE   MET  58          3HE       MET  58   7.276  13.743   7.311
  461    H    ASP  59           H        ASP  59   9.786  10.513   4.096
  462    HA   ASP  59           HA       ASP  59  10.130   9.202   1.497
  463   1HB   ASP  59          2HB       ASP  59  12.275   8.438   2.393
  464   2HB   ASP  59          3HB       ASP  59  12.110  10.182   2.561
  465    H    PHE  60           H        PHE  60   7.811   8.399   2.820
  466    HA   PHE  60           HA       PHE  60   8.255   5.565   2.937
  467   1HB   PHE  60          2HB       PHE  60   7.633   5.127   5.197
  468   2HB   PHE  60          3HB       PHE  60   8.916   6.331   5.255
  469    HD1  PHE  60           HD1      PHE  60   5.279   5.762   5.624
  470    HD2  PHE  60           HD2      PHE  60   8.482   8.601   5.983
  471    HE1  PHE  60           HE1      PHE  60   3.786   7.285   6.887
  472    HE2  PHE  60           HE2      PHE  60   6.989  10.124   7.246
  473    HZ   PHE  60           HZ       PHE  60   4.641   9.466   7.699
  474    H    ILE  61           H        ILE  61   6.116   4.434   3.614
  475    HA   ILE  61           HA       ILE  61   3.778   6.035   2.805
  476    HB   ILE  61           HB       ILE  61   4.294   3.276   1.685
  477   1HG1  ILE  61          2HG1      ILE  61   4.861   5.980   0.419
  478   2HG1  ILE  61          3HG1      ILE  61   6.070   4.783   0.878
  479   1HG2  ILE  61          1HG2      ILE  61   2.433   3.710   0.310
  480   2HG2  ILE  61          2HG2      ILE  61   1.952   4.405   1.856
  481   3HG2  ILE  61          3HG2      ILE  61   2.535   5.452   0.563
  482   1HD1  ILE  61          1HD1      ILE  61   4.655   3.186  -0.670
  483   2HD1  ILE  61          2HD1      ILE  61   4.088   4.699  -1.374
  484   3HD1  ILE  61          3HD1      ILE  61   5.808   4.310  -1.389
  485    H    SER  62           H        SER  62   2.008   5.629   3.982
  486    HA   SER  62           HA       SER  62   2.128   3.448   5.958
  487   1HB   SER  62          2HB       SER  62   1.664   5.352   7.174
  488   2HB   SER  62          3HB       SER  62   0.806   6.124   5.846
  489    HG   SER  62           HG       SER  62  -0.948   4.815   6.249
  490    H    VAL  63           H        VAL  63   1.224   1.628   5.222
  491    HA   VAL  63           HA       VAL  63  -1.152   1.788   3.494
  492    HB   VAL  63           HB       VAL  63   0.608  -0.585   4.165
  493   1HG1  VAL  63          1HG1      VAL  63  -1.660  -1.254   3.524
  494   2HG1  VAL  63          2HG1      VAL  63  -1.603  -0.187   2.121
  495   3HG1  VAL  63          3HG1      VAL  63  -0.549  -1.599   2.199
  496   1HG2  VAL  63          1HG2      VAL  63   0.525   1.312   1.799
  497   2HG2  VAL  63          2HG2      VAL  63   1.881   1.029   2.892
  498   3HG2  VAL  63          3HG2      VAL  63   1.370  -0.236   1.773
  499    H    ASP  64           H        ASP  64  -2.999   1.841   4.581
  500    HA   ASP  64           HA       ASP  64  -3.294   0.518   7.170
  501   1HB   ASP  64          2HB       ASP  64  -5.338   2.038   5.561
  502   2HB   ASP  64          3HB       ASP  64  -5.452   1.614   7.258
  503    H    LYS  65           H        LYS  65  -4.741  -1.163   7.579
  504    HA   LYS  65           HA       LYS  65  -5.861  -2.469   5.171
  505   1HB   LYS  65          2HB       LYS  65  -5.586  -4.628   6.466
  506   2HB   LYS  65          3HB       LYS  65  -4.083  -3.869   5.940
  507   1HG   LYS  65          2HG       LYS  65  -3.506  -3.204   8.089
  508   2HG   LYS  65          3HG       LYS  65  -5.180  -3.168   8.643
  509   1HD   LYS  65          2HD       LYS  65  -5.254  -5.647   8.507
  510   2HD   LYS  65          3HD       LYS  65  -3.556  -5.657   8.033
  511   1HE   LYS  65          2HE       LYS  65  -3.503  -6.029  10.371
  512   2HE   LYS  65          3HE       LYS  65  -3.140  -4.312  10.200
  513   1HZ   LYS  65          1HZ       LYS  65  -5.928  -5.192  10.504
  514   2HZ   LYS  65          1HZ       LYS  65  -5.219  -3.706  10.918
  515   3HZ   LYS  65          3HZ       LYS  65  -4.933  -5.082  11.872
  516    H    GLU  66           H        GLU  66  -7.666  -4.058   5.818
  517    HA   GLU  66           HA       GLU  66  -9.799  -2.602   6.912
  518   1HB   GLU  66          2HB       GLU  66  -9.368  -5.286   5.871
  519   2HB   GLU  66          3HB       GLU  66 -10.512  -5.283   7.211
  520   1HG   GLU  66          2HG       GLU  66 -11.872  -4.874   5.327
  521   2HG   GLU  66          3HG       GLU  66 -11.612  -3.268   6.003
  522    H    ASN  67           H        ASN  67 -11.197  -3.895   8.715
  523    HA   ASN  67           HA       ASN  67 -10.505  -3.163  11.179
  524   1HB   ASN  67          2HB       ASN  67 -11.560  -5.962  10.796
  525   2HB   ASN  67          3HB       ASN  67 -11.915  -4.829  12.096
  526   1HD2  ASN  67          2HD2      ASN  67 -13.865  -3.731  11.865
  527   2HD2  ASN  67          1HD2      ASN  67 -14.672  -3.483  10.393
  528    H    ASP  68           H        ASP  68  -9.657  -6.433  10.028
  529    HA   ASP  68           HA       ASP  68  -7.136  -6.269  11.537
  530   1HB   ASP  68          2HB       ASP  68  -7.466  -8.553  12.402
  531   2HB   ASP  68          3HB       ASP  68  -8.714  -7.459  12.992
  532    H    ALA  69           H        ALA  69  -9.085  -8.298   9.349
  533    HA   ALA  69           HA       ALA  69  -8.491  -9.610   7.556
  534   1HB   ALA  69          1HB       ALA  69  -7.434  -8.424   5.823
  535   2HB   ALA  69          2HB       ALA  69  -8.172  -7.161   6.806
  536   3HB   ALA  69          3HB       ALA  69  -6.445  -7.488   6.943
  537    H    ASN  70           H        ASN  70  -5.846  -9.544   6.260
  538    HA   ASN  70           HA       ASN  70  -4.100 -10.770   8.280
  539   1HB   ASN  70          2HB       ASN  70  -5.187 -12.128   5.817
  540   2HB   ASN  70          3HB       ASN  70  -3.673 -12.637   6.562
  541   1HD2  ASN  70          2HD2      ASN  70  -7.143 -12.102   7.346
  542   2HD2  ASN  70          1HD2      ASN  70  -7.195 -13.269   8.577
  543    H    TRP  71           H        TRP  71  -2.096 -10.021   8.051
  544    HA   TRP  71           HA       TRP  71  -1.357  -8.374   5.817
  545   1HB   TRP  71          2HB       TRP  71  -0.032  -9.299   8.336
  546   2HB   TRP  71          3HB       TRP  71   0.976  -8.660   7.038
  547    HD1  TRP  71           HD1      TRP  71  -0.982  -7.560   9.919
  548    HE1  TRP  71           HE1      TRP  71  -1.412  -5.020   9.836
  549    HE3  TRP  71           HE3      TRP  71   0.348  -6.595   5.081
  550    HZ2  TRP  71           HZ2      TRP  71  -1.220  -2.865   7.967
  551    HZ3  TRP  71           HZ3      TRP  71   0.214  -4.291   4.179
  552    HH2  TRP  71           HH2      TRP  71  -0.566  -2.427   5.613
  553    H    GLU  72           H        GLU  72  -0.398 -11.582   6.994
  554    HA   GLU  72           HA       GLU  72   1.563 -12.186   5.104
  555   1HB   GLU  72          2HB       GLU  72   0.764 -13.492   7.220
  556   2HB   GLU  72          3HB       GLU  72  -0.337 -14.289   6.097
  557   1HG   GLU  72          2HG       GLU  72   1.575 -15.671   6.069
  558   2HG   GLU  72          3HG       GLU  72   1.764 -14.675   4.628
  559    H    THR  73           H        THR  73  -1.856 -11.943   4.731
  560    HA   THR  73           HA       THR  73  -1.949 -13.540   2.296
  561    HB   THR  73           HB       THR  73  -3.972 -11.967   3.882
  562    HG1  THR  73           HG1      THR  73  -3.296 -14.199   4.332
  563   1HG2  THR  73          1HG2      THR  73  -5.618 -12.852   2.118
  564   2HG2  THR  73          2HG2      THR  73  -4.638 -11.459   1.660
  565   3HG2  THR  73          3HG2      THR  73  -4.210 -13.070   1.079
  566    H    VAL  74           H        VAL  74  -2.250 -10.170   3.280
  567    HA   VAL  74           HA       VAL  74  -2.563  -9.158   0.624
  568    HB   VAL  74           HB       VAL  74  -2.609  -8.159   3.352
  569   1HG1  VAL  74          1HG1      VAL  74  -1.261  -6.452   1.246
  570   2HG1  VAL  74          2HG1      VAL  74  -1.888  -5.844   2.777
  571   3HG1  VAL  74          3HG1      VAL  74  -0.556  -6.999   2.768
  572   1HG2  VAL  74          1HG2      VAL  74  -4.545  -8.180   1.880
  573   2HG2  VAL  74          2HG2      VAL  74  -4.139  -6.507   2.264
  574   3HG2  VAL  74          3HG2      VAL  74  -3.698  -7.184   0.696
  575    H    LEU  75           H        LEU  75   0.163  -9.457   2.872
  576    HA   LEU  75           HA       LEU  75   2.051  -7.876   1.657
  577   1HB   LEU  75          2HB       LEU  75   2.096 -10.143   3.470
  578   2HB   LEU  75          3HB       LEU  75   3.504 -10.127   2.409
  579    HG   LEU  75           HG       LEU  75   2.569  -7.633   3.835
  580   1HD1  LEU  75          1HD1      LEU  75   4.604  -9.658   4.813
  581   2HD1  LEU  75          2HD1      LEU  75   4.229  -8.113   5.576
  582   3HD1  LEU  75          3HD1      LEU  75   3.012  -9.388   5.524
  583   1HD2  LEU  75          1HD2      LEU  75   4.234  -7.696   1.832
  584   2HD2  LEU  75          2HD2      LEU  75   4.689  -6.775   3.264
  585   3HD2  LEU  75          3HD2      LEU  75   5.370  -8.378   2.995
  586    HA   PRO  76           HA       PRO  76   3.485 -11.678  -1.132
  587   1HB   PRO  76          2HB       PRO  76   1.021 -12.998  -1.832
  588   2HB   PRO  76          3HB       PRO  76   2.451 -13.688  -1.053
  589   1HG   PRO  76          2HG       PRO  76  -0.075 -12.867   0.119
  590   2HG   PRO  76          3HG       PRO  76   1.206 -13.876   0.798
  591   1HD   PRO  76          2HD       PRO  76   0.635 -11.319   1.666
  592   2HD   PRO  76          3HD       PRO  76   2.218 -12.104   1.856
  593    H    LYS  77           H        LYS  77   0.362 -10.053  -1.291
  594    HA   LYS  77           HA       LYS  77   0.441  -9.727  -4.172
  595   1HB   LYS  77          2HB       LYS  77  -1.340  -8.278  -2.202
  596   2HB   LYS  77          3HB       LYS  77  -1.624  -8.541  -3.923
  597   1HG   LYS  77          2HG       LYS  77  -1.418 -11.090  -3.252
  598   2HG   LYS  77          3HG       LYS  77  -1.835 -10.487  -1.649
  599   1HD   LYS  77          2HD       LYS  77  -3.951 -10.903  -2.527
  600   2HD   LYS  77          3HD       LYS  77  -3.738  -9.206  -2.952
  601   1HE   LYS  77          2HE       LYS  77  -2.794  -9.997  -5.177
  602   2HE   LYS  77          3HE       LYS  77  -3.343 -11.615  -4.742
  603   1HZ   LYS  77          1HZ       LYS  77  -5.155 -10.833  -5.858
  604   2HZ   LYS  77          1HZ       LYS  77  -4.913  -9.223  -5.377
  605   3HZ   LYS  77          3HZ       LYS  77  -5.564 -10.349  -4.285
  606    H    VAL  78           H        VAL  78   1.005  -7.778  -1.280
  607    HA   VAL  78           HA       VAL  78   1.519  -5.314  -2.599
  608    HB   VAL  78           HB       VAL  78   2.279  -6.394   0.126
  609   1HG1  VAL  78          1HG1      VAL  78   3.975  -4.800  -0.250
  610   2HG1  VAL  78          2HG1      VAL  78   2.915  -3.755  -1.194
  611   3HG1  VAL  78          3HG1      VAL  78   2.716  -3.864   0.554
  612   1HG2  VAL  78          1HG2      VAL  78   0.451  -5.142   0.911
  613   2HG2  VAL  78          2HG2      VAL  78   0.426  -4.102  -0.513
  614   3HG2  VAL  78          3HG2      VAL  78  -0.150  -5.765  -0.626
  615    H    GLU  79           H        GLU  79   3.605  -7.970  -1.513
  616    HA   GLU  79           HA       GLU  79   6.105  -6.848  -1.973
  617   1HB   GLU  79          2HB       GLU  79   5.090  -9.679  -2.164
  618   2HB   GLU  79          3HB       GLU  79   6.779  -9.283  -2.489
  619   1HG   GLU  79          2HG       GLU  79   6.762  -8.063  -0.228
  620   2HG   GLU  79          3HG       GLU  79   5.233  -8.882   0.079
  621    H    ALA  80           H        ALA  80   3.935  -8.487  -4.248
  622    HA   ALA  80           HA       ALA  80   5.543  -8.681  -6.482
  623   1HB   ALA  80          1HB       ALA  80   3.555  -8.784  -7.778
  624   2HB   ALA  80          2HB       ALA  80   3.123  -9.440  -6.199
  625   3HB   ALA  80          3HB       ALA  80   2.663  -7.792  -6.624
  626    H    VAL  81           H        VAL  81   3.994  -5.832  -5.148
  627    HA   VAL  81           HA       VAL  81   4.214  -4.097  -7.336
  628    HB   VAL  81           HB       VAL  81   4.484  -3.292  -4.435
  629   1HG1  VAL  81          1HG1      VAL  81   2.956  -1.805  -6.540
  630   2HG1  VAL  81          2HG1      VAL  81   3.790  -1.183  -5.118
  631   3HG1  VAL  81          3HG1      VAL  81   4.713  -1.683  -6.535
  632   1HG2  VAL  81          1HG2      VAL  81   2.468  -4.890  -5.380
  633   2HG2  VAL  81          2HG2      VAL  81   2.273  -3.731  -4.068
  634   3HG2  VAL  81          3HG2      VAL  81   1.812  -3.290  -5.711
  635    H    PHE  82           H        PHE  82   6.412  -4.155  -4.483
  636    HA   PHE  82           HA       PHE  82   8.437  -2.733  -6.026
  637   1HB   PHE  82          2HB       PHE  82   8.977  -3.808  -3.291
  638   2HB   PHE  82          3HB       PHE  82   9.483  -2.285  -4.020
  639    HD1  PHE  82           HD1      PHE  82   7.744  -0.471  -4.406
  640    HD2  PHE  82           HD2      PHE  82   6.989  -3.953  -2.006
  641    HE1  PHE  82           HE1      PHE  82   5.817   0.675  -3.348
  642    HE2  PHE  82           HE2      PHE  82   5.062  -2.805  -0.948
  643    HZ   PHE  82           HZ       PHE  82   4.478  -0.493  -1.620
  644    H    GLU  83           H        GLU  83   7.835  -5.979  -4.867
  645    HA   GLU  83           HA       GLU  83  10.514  -6.923  -5.369
  646   1HB   GLU  83          2HB       GLU  83   8.763  -7.857  -3.693
  647   2HB   GLU  83          3HB       GLU  83   8.103  -8.699  -5.095
  648   1HG   GLU  83          2HG       GLU  83  10.575  -9.440  -5.503
  649   2HG   GLU  83          3HG       GLU  83  10.808  -9.005  -3.810
  650    H    LEU  84           H        LEU  84  10.032  -5.748  -7.624
  651    HA   LEU  84           HA       LEU  84   8.696  -7.377  -9.586
  652   1HB   LEU  84          2HB       LEU  84  10.637  -5.088  -9.989
  653   2HB   LEU  84          3HB       LEU  84   9.534  -5.752 -11.194
  654    HG   LEU  84           HG       LEU  84   8.443  -4.749  -8.576
  655   1HD1  LEU  84          1HD1      LEU  84   8.065  -2.546  -9.848
  656   2HD1  LEU  84          2HD1      LEU  84   9.693  -2.843  -9.240
  657   3HD1  LEU  84          3HD1      LEU  84   9.329  -3.097 -10.947
  658   1HD2  LEU  84          1HD2      LEU  84   6.956  -5.976 -10.093
  659   2HD2  LEU  84          2HD2      LEU  84   6.481  -4.279 -10.041
  660   3HD2  LEU  84          3HD2      LEU  84   7.388  -4.900 -11.421
  661    H    GLU  85           H        GLU  85  10.660  -8.803  -8.088
  662    HA   GLU  85           HA       GLU  85  12.657  -9.981  -8.260
  663   1HB   GLU  85          2HB       GLU  85  12.497 -11.367 -10.509
  664   2HB   GLU  85          3HB       GLU  85  11.365 -11.643  -9.187
  665   1HG   GLU  85          2HG       GLU  85   9.756 -10.089 -10.262
  666   2HG   GLU  85          3HG       GLU  85  10.880  -9.874 -11.603
  667    H    HIS  86           H        HIS  86  14.093  -8.155  -8.398
  668    HA   HIS  86           HA       HIS  86  14.915  -6.916 -10.779
  669   1HB   HIS  86          2HB       HIS  86  16.342  -7.413  -8.161
  670   2HB   HIS  86          3HB       HIS  86  17.066  -6.489  -9.476
  671    HD1  HIS  86           HD1      HIS  86  15.300  -5.897  -6.497
  672    HD2  HIS  86           HD2      HIS  86  14.899  -4.400 -10.367
  673    HE1  HIS  86           HE1      HIS  86  13.998  -3.733  -6.298
  674    H    HIS  87           H        HIS  87  16.078  -7.618 -12.458
  675    HA   HIS  87           HA       HIS  87  18.077  -9.711 -12.138
  676   1HB   HIS  87          2HB       HIS  87  16.139 -11.092 -12.522
  677   2HB   HIS  87          3HB       HIS  87  15.613 -10.071 -13.860
  678    HD1  HIS  87           HD1      HIS  87  16.863 -10.302 -16.113
  679    HD2  HIS  87           HD2      HIS  87  18.323 -12.831 -13.138
  680    HE1  HIS  87           HE1      HIS  87  18.404 -11.949 -17.266
  681    H    HIS  88           H        HIS  88  16.192  -8.080 -14.704
  682    HA   HIS  88           HA       HIS  88  18.231  -7.940 -16.601
  683   1HB   HIS  88          2HB       HIS  88  16.915  -6.231 -17.690
  684   2HB   HIS  88          3HB       HIS  88  15.813  -7.426 -17.011
  685    HD1  HIS  88           HD1      HIS  88  15.645  -6.562 -14.108
  686    HD2  HIS  88           HD2      HIS  88  15.590  -3.836 -17.262
  687    HE1  HIS  88           HE1      HIS  88  14.550  -4.459 -13.218
  688    H    HIS  89           H        HIS  89  19.645  -6.255 -17.218
  689    HA   HIS  89           HA       HIS  89  21.142  -5.091 -15.170
  690   1HB   HIS  89          2HB       HIS  89  20.958  -4.086 -18.018
  691   2HB   HIS  89          3HB       HIS  89  22.308  -3.880 -16.902
  692    HD1  HIS  89           HD1      HIS  89  20.358  -6.742 -18.513
  693    HD2  HIS  89           HD2      HIS  89  24.190  -5.899 -17.104
  694    HE1  HIS  89           HE1      HIS  89  21.780  -8.768 -19.047
  695    H    HIS  90           H        HIS  90  21.609  -2.630 -15.161
  696    HA   HIS  90           HA       HIS  90  19.624  -1.257 -13.889
  697   1HB   HIS  90          2HB       HIS  90  20.826   0.854 -14.810
  698   2HB   HIS  90          3HB       HIS  90  21.742  -0.264 -13.800
  699    HD1  HIS  90           HD1      HIS  90  20.902  -0.857 -17.446
  700    HD2  HIS  90           HD2      HIS  90  24.226   0.005 -15.084
  701    HE1  HIS  90           HE1      HIS  90  22.927  -1.085 -18.949
  702    H    HIS  91           H        HIS  91  18.039   0.239 -14.429
  703    HA   HIS  91           HA       HIS  91  16.354  -0.240 -16.527
  704   1HB   HIS  91          2HB       HIS  91  15.723   1.179 -14.650
  705   2HB   HIS  91          3HB       HIS  91  16.872   2.414 -15.158
  706    HD1  HIS  91           HD1      HIS  91  14.890   4.113 -15.479
  707    HD2  HIS  91           HD2      HIS  91  14.706   0.776 -17.971
  708    HE1  HIS  91           HE1      HIS  91  13.179   4.647 -17.268
  Start of MODEL    8
    1   1H    MET   1          1HT       MET   1  12.840   3.076  -5.748
    2   2H    MET   1          2HT       MET   1  12.634   1.508  -6.375
    3   3H    MET   1          3HT       MET   1  13.551   1.750  -4.966
    4    HA   MET   1           HA       MET   1  11.542   2.562  -3.822
    5   1HB   MET   1          2HB       MET   1  10.197   1.554  -6.352
    6   2HB   MET   1          3HB       MET   1   9.374   2.145  -4.908
    7   1HG   MET   1          2HG       MET   1   9.377   4.095  -6.134
    8   2HG   MET   1          3HG       MET   1  10.949   4.267  -5.355
    9   1HE   MET   1          1HE       MET   1   9.913   3.524  -9.702
   10   2HE   MET   1          2HE       MET   1   9.245   4.734  -8.608
   11   3HE   MET   1          3HE       MET   1   8.951   3.023  -8.303
   12    H    LYS   2           H        LYS   2  12.641   0.873  -2.664
   13    HA   LYS   2           HA       LYS   2  11.316  -1.748  -2.958
   14   1HB   LYS   2          2HB       LYS   2  14.272  -1.198  -2.703
   15   2HB   LYS   2          3HB       LYS   2  13.569  -2.747  -2.242
   16   1HG   LYS   2          2HG       LYS   2  12.850  -1.626  -4.920
   17   2HG   LYS   2          3HG       LYS   2  14.456  -2.320  -4.721
   18   1HD   LYS   2          2HD       LYS   2  12.160  -3.898  -3.656
   19   2HD   LYS   2          3HD       LYS   2  12.334  -3.812  -5.408
   20   1HE   LYS   2          2HE       LYS   2  13.548  -5.735  -4.140
   21   2HE   LYS   2          3HE       LYS   2  14.442  -4.852  -5.376
   22   1HZ   LYS   2          1HZ       LYS   2  15.728  -5.112  -3.339
   23   2HZ   LYS   2          1HZ       LYS   2  14.527  -4.294  -2.457
   24   3HZ   LYS   2          3HZ       LYS   2  15.412  -3.476  -3.655
   25    H    ILE   3           H        ILE   3  11.433  -3.056  -0.993
   26    HA   ILE   3           HA       ILE   3  10.933  -1.436   1.359
   27    HB   ILE   3           HB       ILE   3  10.868  -4.431   0.888
   28   1HG1  ILE   3          2HG1      ILE   3   8.502  -2.653   1.433
   29   2HG1  ILE   3          3HG1      ILE   3   9.167  -2.734  -0.197
   30   1HG2  ILE   3          1HG2      ILE   3   9.390  -4.134   3.088
   31   2HG2  ILE   3          2HG2      ILE   3  11.134  -4.379   3.183
   32   3HG2  ILE   3          3HG2      ILE   3  10.461  -2.755   3.333
   33   1HD1  ILE   3          1HD1      ILE   3   8.538  -5.257   1.328
   34   2HD1  ILE   3          2HD1      ILE   3   7.278  -4.404   0.438
   35   3HD1  ILE   3          3HD1      ILE   3   8.691  -5.031  -0.414
   36    H    ILE   4           H        ILE   4  12.639  -0.688   2.467
   37    HA   ILE   4           HA       ILE   4  15.052  -2.371   2.686
   38    HB   ILE   4           HB       ILE   4  14.967   0.488   3.571
   39   1HG1  ILE   4          2HG1      ILE   4  13.861   0.486   1.352
   40   2HG1  ILE   4          3HG1      ILE   4  15.457   1.231   1.273
   41   1HG2  ILE   4          1HG2      ILE   4  17.293   0.430   2.838
   42   2HG2  ILE   4          2HG2      ILE   4  16.980  -0.947   3.895
   43   3HG2  ILE   4          3HG2      ILE   4  17.065  -1.177   2.148
   44   1HD1  ILE   4          1HD1      ILE   4  14.837  -1.646   0.516
   45   2HD1  ILE   4          2HD1      ILE   4  15.070  -0.322  -0.624
   46   3HD1  ILE   4          3HD1      ILE   4  16.408  -0.856   0.389
   47    H    SER   5           H        SER   5  12.466  -0.965   4.558
   48    HA   SER   5           HA       SER   5  13.218  -2.487   6.883
   49   1HB   SER   5          2HB       SER   5  13.116   0.426   7.501
   50   2HB   SER   5          3HB       SER   5  13.975  -0.868   8.328
   51    HG   SER   5           HG       SER   5  14.807   0.805   6.364
   52    H    ILE   6           H        ILE   6  11.381  -3.088   7.827
   53    HA   ILE   6           HA       ILE   6   8.921  -1.570   7.297
   54    HB   ILE   6           HB       ILE   6   9.187  -4.255   8.668
   55   1HG1  ILE   6          2HG1      ILE   6   8.670  -3.751   5.719
   56   2HG1  ILE   6          3HG1      ILE   6  10.241  -4.227   6.367
   57   1HG2  ILE   6          1HG2      ILE   6   6.976  -2.516   7.781
   58   2HG2  ILE   6          2HG2      ILE   6   6.817  -4.196   7.278
   59   3HG2  ILE   6          3HG2      ILE   6   6.985  -3.800   8.987
   60   1HD1  ILE   6          1HD1      ILE   6   9.107  -6.235   5.626
   61   2HD1  ILE   6          2HD1      ILE   6   9.122  -6.243   7.391
   62   3HD1  ILE   6          3HD1      ILE   6   7.652  -5.797   6.522
   63    H    SER   7           H        SER   7   7.333  -1.810   9.324
   64    HA   SER   7           HA       SER   7   8.765  -1.284  11.825
   65   1HB   SER   7          2HB       SER   7   8.288   0.909  11.911
   66   2HB   SER   7          3HB       SER   7   7.805   0.803  10.223
   67    HG   SER   7           HG       SER   7   6.174   1.651  11.650
   68    H    GLU   8           H        GLU   8   7.942  -2.677  13.212
   69    HA   GLU   8           HA       GLU   8   5.143  -3.521  12.962
   70   1HB   GLU   8          2HB       GLU   8   6.315  -4.895  15.107
   71   2HB   GLU   8          3HB       GLU   8   6.015  -5.521  13.489
   72   1HG   GLU   8          2HG       GLU   8   8.232  -4.739  12.759
   73   2HG   GLU   8          3HG       GLU   8   8.533  -4.066  14.360
   74    H    THR   9           H        THR   9   3.625  -3.170  14.533
   75    HA   THR   9           HA       THR   9   4.430  -1.798  16.992
   76    HB   THR   9           HB       THR   9   2.126  -0.434  16.177
   77    HG1  THR   9           HG1      THR   9   3.213  -1.372  14.038
   78   1HG2  THR   9          1HG2      THR   9   3.916   1.424  15.812
   79   2HG2  THR   9          2HG2      THR   9   3.741   0.717  17.416
   80   3HG2  THR   9          3HG2      THR   9   5.057   0.201  16.365
   81    HA   PRO  10           HA       PRO  10   1.157  -4.028  18.809
   82   1HB   PRO  10          2HB       PRO  10  -0.077  -1.870  20.267
   83   2HB   PRO  10          3HB       PRO  10   1.056  -3.090  20.867
   84   1HG   PRO  10          2HG       PRO  10   1.582  -0.380  20.543
   85   2HG   PRO  10          3HG       PRO  10   2.779  -1.659  20.785
   86   1HD   PRO  10          2HD       PRO  10   2.059  -0.218  18.301
   87   2HD   PRO  10          3HD       PRO  10   3.566  -1.055  18.726
   88    H    ASN  11           H        ASN  11   0.414  -1.379  16.825
   89    HA   ASN  11           HA       ASN  11  -2.461  -2.008  16.740
   90   1HB   ASN  11          2HB       ASN  11  -2.398   0.094  15.195
   91   2HB   ASN  11          3HB       ASN  11  -2.255   0.308  16.937
   92   1HD2  ASN  11          2HD2      ASN  11  -0.303   0.115  13.936
   93   2HD2  ASN  11          1HD2      ASN  11   1.015   0.987  14.557
   94    H    HIS  12           H        HIS  12  -2.972  -3.533  15.305
   95    HA   HIS  12           HA       HIS  12  -1.354  -3.830  12.868
   96   1HB   HIS  12          2HB       HIS  12  -2.397  -6.018  12.652
   97   2HB   HIS  12          3HB       HIS  12  -1.765  -5.830  14.288
   98    HD1  HIS  12           HD1      HIS  12  -3.762  -4.667  15.967
   99    HD2  HIS  12           HD2      HIS  12  -4.958  -6.965  12.704
  100    HE1  HIS  12           HE1      HIS  12  -6.152  -5.373  16.428
  101    H    ASN  13           H        ASN  13  -2.202  -1.952  11.819
  102    HA   ASN  13           HA       ASN  13  -4.648  -2.520  10.342
  103   1HB   ASN  13          2HB       ASN  13  -5.537  -1.344  12.259
  104   2HB   ASN  13          3HB       ASN  13  -4.372  -0.038  12.050
  105   1HD2  ASN  13          2HD2      ASN  13  -7.370  -1.418  10.849
  106   2HD2  ASN  13          1HD2      ASN  13  -7.728  -0.171   9.756
  107    H    THR  14           H        THR  14  -1.811  -0.523  10.897
  108    HA   THR  14           HA       THR  14  -1.624  -0.077   8.019
  109    HB   THR  14           HB       THR  14  -2.847   1.881   9.164
  110    HG1  THR  14           HG1      THR  14  -0.633   2.979   8.007
  111   1HG2  THR  14          1HG2      THR  14  -0.037   2.628   9.990
  112   2HG2  THR  14          2HG2      THR  14  -1.542   3.454  10.388
  113   3HG2  THR  14          3HG2      THR  14  -1.184   1.886  11.106
  114    H    MET  15           H        MET  15   0.385  -0.401   7.330
  115    HA   MET  15           HA       MET  15   2.559  -0.422   9.339
  116   1HB   MET  15          2HB       MET  15   2.301  -1.880   6.699
  117   2HB   MET  15          3HB       MET  15   3.739  -1.904   7.718
  118   1HG   MET  15          2HG       MET  15   1.943  -2.588   9.579
  119   2HG   MET  15          3HG       MET  15   1.084  -3.182   8.161
  120   1HE   MET  15          1HE       MET  15   3.169  -4.016   6.149
  121   2HE   MET  15          2HE       MET  15   1.803  -5.020   6.628
  122   3HE   MET  15          3HE       MET  15   3.417  -5.720   6.553
  123    H    LYS  16           H        LYS  16   4.611   0.394   8.740
  124    HA   LYS  16           HA       LYS  16   4.473   2.535   6.703
  125   1HB   LYS  16          2HB       LYS  16   5.912   2.254   9.312
  126   2HB   LYS  16          3HB       LYS  16   6.630   3.256   8.050
  127   1HG   LYS  16          2HG       LYS  16   4.700   4.669   7.942
  128   2HG   LYS  16          3HG       LYS  16   3.750   3.558   8.928
  129   1HD   LYS  16          2HD       LYS  16   4.339   5.024  10.591
  130   2HD   LYS  16          3HD       LYS  16   5.788   4.021  10.638
  131   1HE   LYS  16          2HE       LYS  16   6.750   5.624   8.871
  132   2HE   LYS  16          3HE       LYS  16   5.415   6.695   9.291
  133   1HZ   LYS  16          1HZ       LYS  16   7.386   5.597  11.216
  134   2HZ   LYS  16          1HZ       LYS  16   6.135   6.690  11.572
  135   3HZ   LYS  16          3HZ       LYS  16   7.425   7.165  10.574
  136    H    ILE  17           H        ILE  17   5.499   2.122   4.850
  137    HA   ILE  17           HA       ILE  17   7.600   0.071   4.794
  138    HB   ILE  17           HB       ILE  17   6.278   1.507   2.479
  139   1HG1  ILE  17          2HG1      ILE  17   5.700  -1.283   3.514
  140   2HG1  ILE  17          3HG1      ILE  17   4.729   0.122   3.951
  141   1HG2  ILE  17          1HG2      ILE  17   7.124  -0.746   1.399
  142   2HG2  ILE  17          2HG2      ILE  17   8.246   0.596   1.621
  143   3HG2  ILE  17          3HG2      ILE  17   8.243  -0.750   2.762
  144   1HD1  ILE  17          1HD1      ILE  17   3.792  -1.148   2.001
  145   2HD1  ILE  17          2HD1      ILE  17   4.177   0.528   1.613
  146   3HD1  ILE  17          3HD1      ILE  17   5.257  -0.768   1.099
  147    H    THR  18           H        THR  18   9.673   0.640   4.829
  148    HA   THR  18           HA       THR  18  10.440   3.426   4.413
  149    HB   THR  18           HB       THR  18  12.103   1.013   5.185
  150    HG1  THR  18           HG1      THR  18  11.188   3.196   6.737
  151   1HG2  THR  18          1HG2      THR  18  13.524   2.676   4.160
  152   2HG2  THR  18          2HG2      THR  18  12.738   3.971   5.063
  153   3HG2  THR  18          3HG2      THR  18  13.738   2.791   5.907
  154    H    LEU  19           H        LEU  19  11.149   4.197   2.533
  155    HA   LEU  19           HA       LEU  19  11.799   2.323   0.365
  156   1HB   LEU  19          2HB       LEU  19  11.499   5.327   0.190
  157   2HB   LEU  19          3HB       LEU  19  11.432   4.156  -1.129
  158    HG   LEU  19           HG       LEU  19   9.443   4.366   1.155
  159   1HD1  LEU  19          1HD1      LEU  19   7.883   5.098  -0.605
  160   2HD1  LEU  19          2HD1      LEU  19   9.267   6.187  -0.510
  161   3HD1  LEU  19          3HD1      LEU  19   9.174   4.990  -1.802
  162   1HD2  LEU  19          1HD2      LEU  19   8.174   2.718  -0.342
  163   2HD2  LEU  19          2HD2      LEU  19   9.692   2.486  -1.209
  164   3HD2  LEU  19          3HD2      LEU  19   9.578   2.065   0.499
  165    H    SER  20           H        SER  20  13.332   4.310  -1.100
  166    HA   SER  20           HA       SER  20  15.944   3.648  -0.237
  167   1HB   SER  20          2HB       SER  20  15.141   5.913  -2.073
  168   2HB   SER  20          3HB       SER  20  16.708   5.112  -1.999
  169    HG   SER  20           HG       SER  20  14.788   4.460  -3.554
  170    H    GLU  21           H        GLU  21  13.789   5.752   1.129
  171    HA   GLU  21           HA       GLU  21  13.927   7.452   2.655
  172   1HB   GLU  21          2HB       GLU  21  16.554   6.044   2.973
  173   2HB   GLU  21          3HB       GLU  21  16.276   7.555   3.838
  174   1HG   GLU  21          2HG       GLU  21  14.201   6.615   4.802
  175   2HG   GLU  21          3HG       GLU  21  14.496   5.101   3.952
  176    H    SER  22           H        SER  22  13.655   9.171   1.242
  177    HA   SER  22           HA       SER  22  15.993  10.371  -0.025
  178   1HB   SER  22          2HB       SER  22  13.156  11.406  -0.064
  179   2HB   SER  22          3HB       SER  22  14.457  11.775  -1.191
  180    HG   SER  22           HG       SER  22  13.645   9.113  -0.794
  181    H    ARG  23           H        ARG  23  15.483  13.025   0.052
  182    HA   ARG  23           HA       ARG  23  16.431  13.764   2.652
  183   1HB   ARG  23          2HB       ARG  23  15.948  15.112   0.054
  184   2HB   ARG  23          3HB       ARG  23  15.901  16.140   1.484
  185   1HG   ARG  23          2HG       ARG  23  18.186  16.040   0.586
  186   2HG   ARG  23          3HG       ARG  23  18.115  15.275   2.174
  187   1HD   ARG  23          2HD       ARG  23  18.264  13.106   1.278
  188   2HD   ARG  23          3HD       ARG  23  17.742  13.628  -0.321
  189    HE   ARG  23           HE       ARG  23  19.964  14.010  -0.807
  190   1HH1  ARG  23          1HH2      ARG  23  20.083  16.096   1.508
  191   2HH1  ARG  23          2HH2      ARG  23  21.476  15.526   2.366
  192   1HH2  ARG  23          1HH1      ARG  23  21.511  12.439   0.788
  193   2HH2  ARG  23          2HH1      ARG  23  22.281  13.453   1.962
  194    H    GLU  24           H        GLU  24  14.317  12.708   3.563
  195    HA   GLU  24           HA       GLU  24  12.150  12.923   4.410
  196   1HB   GLU  24          2HB       GLU  24  13.242  15.599   5.293
  197   2HB   GLU  24          3HB       GLU  24  12.116  14.547   6.150
  198   1HG   GLU  24          2HG       GLU  24  13.927  12.822   6.311
  199   2HG   GLU  24          3HG       GLU  24  15.040  13.976   5.581
  200    H    GLY  25           H        GLY  25  11.762  13.427   1.834
  201   1HA   GLY  25          1HA       GLY  25   9.842  15.648   1.864
  202   2HA   GLY  25          2HA       GLY  25  11.085  15.655   0.617
  203    H    MET  26           H        MET  26  11.020  14.124  -1.044
  204    HA   MET  26           HA       MET  26   9.930  12.902  -2.662
  205   1HB   MET  26          2HB       MET  26  10.392  11.259  -0.656
  206   2HB   MET  26          3HB       MET  26   8.637  11.292  -0.491
  207   1HG   MET  26          2HG       MET  26   8.771   9.585  -2.014
  208   2HG   MET  26          3HG       MET  26   8.802  10.926  -3.156
  209   1HE   MET  26          1HE       MET  26  10.061   7.724  -2.902
  210   2HE   MET  26          2HE       MET  26  10.674   8.169  -1.310
  211   3HE   MET  26          3HE       MET  26  11.802   7.713  -2.584
  212    H    THR  27           H        THR  27   8.342  15.027  -0.891
  213    HA   THR  27           HA       THR  27   6.302  16.056  -1.083
  214    HB   THR  27           HB       THR  27   5.320  14.082  -3.105
  215    HG1  THR  27           HG1      THR  27   7.138  14.343  -4.130
  216   1HG2  THR  27          1HG2      THR  27   4.360  16.447  -2.163
  217   2HG2  THR  27          2HG2      THR  27   5.299  17.014  -3.543
  218   3HG2  THR  27          3HG2      THR  27   4.013  15.829  -3.778
  219    H    SER  28           H        SER  28   3.751  14.900  -1.527
  220    HA   SER  28           HA       SER  28   3.457  12.580   0.174
  221   1HB   SER  28          2HB       SER  28   2.149  13.682   1.915
  222   2HB   SER  28          3HB       SER  28   3.753  14.402   1.837
  223    HG   SER  28           HG       SER  28   1.278  15.462   1.219
  224    H    ASP  29           H        ASP  29   1.454  11.618  -0.044
  225    HA   ASP  29           HA       ASP  29  -0.770  12.977  -1.295
  226   1HB   ASP  29          2HB       ASP  29   0.916  11.032  -2.855
  227   2HB   ASP  29          3HB       ASP  29  -0.808  11.180  -3.178
  228    H    THR  30           H        THR  30  -2.677  11.661  -1.402
  229    HA   THR  30           HA       THR  30  -2.522   9.130   0.109
  230    HB   THR  30           HB       THR  30  -3.368  10.421   1.819
  231    HG1  THR  30           HG1      THR  30  -5.028   9.084   1.639
  232   1HG2  THR  30          1HG2      THR  30  -3.369  12.594   0.983
  233   2HG2  THR  30          2HG2      THR  30  -4.397  12.175  -0.389
  234   3HG2  THR  30          3HG2      THR  30  -5.093  12.310   1.228
  235    H    TYR  31           H        TYR  31  -3.545   7.503  -0.865
  236    HA   TYR  31           HA       TYR  31  -5.386   8.152  -3.083
  237   1HB   TYR  31          2HB       TYR  31  -4.166   5.436  -2.669
  238   2HB   TYR  31          3HB       TYR  31  -4.739   6.181  -4.160
  239    HD1  TYR  31           HD1      TYR  31  -1.865   5.077  -2.795
  240    HD2  TYR  31           HD2      TYR  31  -3.496   8.760  -4.289
  241    HE1  TYR  31           HE1      TYR  31   0.426   5.898  -3.270
  242    HE2  TYR  31           HE2      TYR  31  -1.207   9.581  -4.764
  243    HH   TYR  31           HH       TYR  31   0.972   9.177  -4.565
  244    H    THR  32           H        THR  32  -7.452   7.646  -2.933
  245    HA   THR  32           HA       THR  32  -8.331   5.791  -0.794
  246    HB   THR  32           HB       THR  32 -10.193   7.140  -0.361
  247    HG1  THR  32           HG1      THR  32 -10.815   8.798  -1.870
  248   1HG2  THR  32          1HG2      THR  32  -9.390   9.446  -0.111
  249   2HG2  THR  32          2HG2      THR  32  -8.110   8.307   0.313
  250   3HG2  THR  32          3HG2      THR  32  -8.082   9.125  -1.250
  251    H    LYS  33           H        LYS  33  -7.727   6.012  -3.900
  252    HA   LYS  33           HA       LYS  33  -9.597   3.961  -4.702
  253   1HB   LYS  33          2HB       LYS  33 -10.863   6.021  -5.160
  254   2HB   LYS  33          3HB       LYS  33  -9.510   6.627  -6.113
  255   1HG   LYS  33          2HG       LYS  33  -9.813   5.007  -7.800
  256   2HG   LYS  33          3HG       LYS  33 -10.785   3.971  -6.755
  257   1HD   LYS  33          2HD       LYS  33 -11.763   6.742  -7.365
  258   2HD   LYS  33          3HD       LYS  33 -11.951   5.485  -8.587
  259   1HE   LYS  33          2HE       LYS  33 -12.762   4.818  -5.790
  260   2HE   LYS  33          3HE       LYS  33 -13.810   5.899  -6.707
  261   1HZ   LYS  33          1HZ       LYS  33 -12.930   3.177  -7.498
  262   2HZ   LYS  33          1HZ       LYS  33 -13.795   4.233  -8.509
  263   3HZ   LYS  33          3HZ       LYS  33 -14.500   3.658  -7.076
  264    H    VAL  34           H        VAL  34  -8.292   5.944  -7.049
  265    HA   VAL  34           HA       VAL  34  -5.676   4.814  -7.295
  266    HB   VAL  34           HB       VAL  34  -7.842   3.850  -9.189
  267   1HG1  VAL  34          1HG1      VAL  34  -4.830   3.893  -9.428
  268   2HG1  VAL  34          2HG1      VAL  34  -5.815   2.718 -10.299
  269   3HG1  VAL  34          3HG1      VAL  34  -6.027   4.443 -10.601
  270   1HG2  VAL  34          1HG2      VAL  34  -5.966   2.530  -7.224
  271   2HG2  VAL  34          2HG2      VAL  34  -7.708   2.307  -7.405
  272   3HG2  VAL  34          3HG2      VAL  34  -6.599   1.632  -8.601
  273    H    ASP  35           H        ASP  35  -4.926   6.884  -7.568
  274    HA   ASP  35           HA       ASP  35  -5.209   8.062 -10.183
  275   1HB   ASP  35          2HB       ASP  35  -7.185   8.846  -8.561
  276   2HB   ASP  35          3HB       ASP  35  -5.945   9.970  -8.012
  277    H    ASP  36           H        ASP  36  -4.432  10.732  -9.069
  278    HA   ASP  36           HA       ASP  36  -2.523  11.898  -8.563
  279   1HB   ASP  36          2HB       ASP  36  -2.805  10.546  -6.414
  280   2HB   ASP  36          3HB       ASP  36  -1.592   9.448  -7.066
  281    H    SER  37           H        SER  37  -2.624   9.341 -10.544
  282    HA   SER  37           HA       SER  37  -1.290   8.572 -12.229
  283   1HB   SER  37          2HB       SER  37   0.228  10.014 -13.189
  284   2HB   SER  37          3HB       SER  37  -0.692  11.155 -12.215
  285    HG   SER  37           HG       SER  37   1.117  11.556 -11.232
  286    H    GLN  38           H        GLN  38  -0.906   7.947  -9.243
  287    HA   GLN  38           HA       GLN  38   1.755   7.297  -8.696
  288   1HB   GLN  38          2HB       GLN  38   0.913   5.941  -6.953
  289   2HB   GLN  38          3HB       GLN  38  -0.318   7.179  -7.166
  290   1HG   GLN  38          2HG       GLN  38  -1.249   5.354  -8.921
  291   2HG   GLN  38          3HG       GLN  38  -0.427   4.271  -7.801
  292   1HE2  GLN  38          2HE2      GLN  38  -2.947   3.704  -7.554
  293   2HE2  GLN  38          1HE2      GLN  38  -3.744   4.535  -6.309
  294    HA   PRO  39           HA       PRO  39   2.674   3.798 -11.165
  295   1HB   PRO  39          2HB       PRO  39   3.351   1.892  -9.111
  296   2HB   PRO  39          3HB       PRO  39   4.440   2.877 -10.095
  297   1HG   PRO  39          2HG       PRO  39   3.999   3.166  -7.375
  298   2HG   PRO  39          3HG       PRO  39   4.757   4.357  -8.439
  299   1HD   PRO  39          2HD       PRO  39   2.021   4.334  -7.300
  300   2HD   PRO  39          3HD       PRO  39   3.012   5.704  -7.839
  301    H    ALA  40           H        ALA  40   1.322   2.503 -12.260
  302    HA   ALA  40           HA       ALA  40  -1.172   1.673 -11.481
  303   1HB   ALA  40          1HB       ALA  40   0.472  -0.128 -13.230
  304   2HB   ALA  40          2HB       ALA  40  -1.228   0.313 -13.375
  305   3HB   ALA  40          3HB       ALA  40   0.025   1.482 -13.791
  306    H    PHE  41           H        PHE  41   1.903   0.060 -10.974
  307    HA   PHE  41           HA       PHE  41   1.057  -2.419 -10.046
  308   1HB   PHE  41          2HB       PHE  41   3.366  -0.909  -8.827
  309   2HB   PHE  41          3HB       PHE  41   3.201  -2.647  -9.067
  310    HD1  PHE  41           HD1      PHE  41   2.691  -3.302 -11.655
  311    HD2  PHE  41           HD2      PHE  41   4.751   0.222 -10.318
  312    HE1  PHE  41           HE1      PHE  41   3.787  -3.099 -13.872
  313    HE2  PHE  41           HE2      PHE  41   5.846   0.423 -12.533
  314    HZ   PHE  41           HZ       PHE  41   5.364  -1.237 -14.311
  315    H    ILE  42           H        ILE  42   1.126   0.710  -8.431
  316    HA   ILE  42           HA       ILE  42   0.526  -0.359  -5.816
  317    HB   ILE  42           HB       ILE  42   0.734   2.401  -6.994
  318   1HG1  ILE  42          2HG1      ILE  42   2.701   0.968  -6.131
  319   2HG1  ILE  42          3HG1      ILE  42   2.577   2.615  -5.525
  320   1HG2  ILE  42          1HG2      ILE  42   0.235   3.233  -4.631
  321   2HG2  ILE  42          2HG2      ILE  42  -1.157   2.691  -5.569
  322   3HG2  ILE  42          3HG2      ILE  42  -0.470   1.646  -4.324
  323   1HD1  ILE  42          1HD1      ILE  42   2.888   0.476  -3.900
  324   2HD1  ILE  42          2HD1      ILE  42   2.052   1.947  -3.404
  325   3HD1  ILE  42          3HD1      ILE  42   1.128   0.551  -3.959
  326    H    ASN  43           H        ASN  43  -1.287   0.500  -8.626
  327    HA   ASN  43           HA       ASN  43  -3.752   1.182  -7.420
  328   1HB   ASN  43          2HB       ASN  43  -3.237  -0.219 -10.058
  329   2HB   ASN  43          3HB       ASN  43  -4.751   0.526  -9.573
  330   1HD2  ASN  43          2HD2      ASN  43  -2.264   2.431  -8.313
  331   2HD2  ASN  43          1HD2      ASN  43  -2.172   3.574  -9.564
  332    H    ASP  44           H        ASP  44  -2.184  -1.847  -8.262
  333    HA   ASP  44           HA       ASP  44  -4.305  -3.618  -7.791
  334   1HB   ASP  44          2HB       ASP  44  -1.976  -4.108  -8.763
  335   2HB   ASP  44          3HB       ASP  44  -1.433  -4.213  -7.091
  336    H    ILE  45           H        ILE  45  -1.762  -2.452  -5.586
  337    HA   ILE  45           HA       ILE  45  -2.449  -3.761  -3.260
  338    HB   ILE  45           HB       ILE  45  -1.499  -0.898  -3.583
  339   1HG1  ILE  45          2HG1      ILE  45  -0.095  -3.568  -3.315
  340   2HG1  ILE  45          3HG1      ILE  45   0.049  -2.401  -4.628
  341   1HG2  ILE  45          1HG2      ILE  45  -2.475  -1.521  -1.308
  342   2HG2  ILE  45          2HG2      ILE  45  -1.169  -2.697  -1.172
  343   3HG2  ILE  45          3HG2      ILE  45  -0.800  -0.977  -1.297
  344   1HD1  ILE  45          1HD1      ILE  45   1.843  -1.566  -3.546
  345   2HD1  ILE  45          2HD1      ILE  45   0.728  -0.946  -2.330
  346   3HD1  ILE  45          3HD1      ILE  45   1.496  -2.519  -2.105
  347    H    LEU  46           H        LEU  46  -3.705  -0.612  -4.371
  348    HA   LEU  46           HA       LEU  46  -5.554  -0.281  -2.249
  349   1HB   LEU  46          2HB       LEU  46  -5.636   0.880  -5.047
  350   2HB   LEU  46          3HB       LEU  46  -6.551   1.466  -3.657
  351    HG   LEU  46           HG       LEU  46  -3.577   1.202  -3.394
  352   1HD1  LEU  46          1HD1      LEU  46  -3.673   2.385  -5.468
  353   2HD1  LEU  46          2HD1      LEU  46  -5.032   3.367  -4.925
  354   3HD1  LEU  46          3HD1      LEU  46  -3.435   3.609  -4.222
  355   1HD2  LEU  46          1HD2      LEU  46  -3.929   3.182  -1.941
  356   2HD2  LEU  46          2HD2      LEU  46  -5.639   3.176  -2.359
  357   3HD2  LEU  46          3HD2      LEU  46  -4.950   1.833  -1.451
  358    H    LYS  47           H        LYS  47  -5.830  -1.760  -5.447
  359    HA   LYS  47           HA       LYS  47  -8.671  -2.270  -5.124
  360   1HB   LYS  47          2HB       LYS  47  -6.642  -2.957  -7.251
  361   2HB   LYS  47          3HB       LYS  47  -8.295  -3.568  -7.299
  362   1HG   LYS  47          2HG       LYS  47  -9.210  -1.355  -7.413
  363   2HG   LYS  47          3HG       LYS  47  -7.657  -0.620  -7.019
  364   1HD   LYS  47          2HD       LYS  47  -6.737  -1.142  -9.144
  365   2HD   LYS  47          3HD       LYS  47  -8.003  -2.322  -9.492
  366   1HE   LYS  47          2HE       LYS  47  -8.700   0.578  -9.049
  367   2HE   LYS  47          3HE       LYS  47  -8.149   0.021 -10.628
  368   1HZ   LYS  47          1HZ       LYS  47 -10.349  -1.306  -9.163
  369   2HZ   LYS  47          1HZ       LYS  47  -9.940  -1.459 -10.804
  370   3HZ   LYS  47          3HZ       LYS  47 -10.621  -0.013 -10.228
  371    H    VAL  48           H        VAL  48  -5.822  -3.720  -4.067
  372    HA   VAL  48           HA       VAL  48  -6.680  -6.472  -4.228
  373    HB   VAL  48           HB       VAL  48  -4.332  -5.013  -3.075
  374   1HG1  VAL  48          1HG1      VAL  48  -4.824  -6.446  -1.213
  375   2HG1  VAL  48          2HG1      VAL  48  -5.226  -7.796  -2.273
  376   3HG1  VAL  48          3HG1      VAL  48  -3.555  -7.248  -2.132
  377   1HG2  VAL  48          1HG2      VAL  48  -4.707  -6.164  -5.447
  378   2HG2  VAL  48          2HG2      VAL  48  -3.143  -6.243  -4.634
  379   3HG2  VAL  48          3HG2      VAL  48  -4.250  -7.614  -4.554
  380    H    GLU  49           H        GLU  49  -8.056  -7.436  -2.906
  381    HA   GLU  49           HA       GLU  49  -9.523  -6.215  -0.916
  382   1HB   GLU  49          2HB       GLU  49  -8.848  -9.104  -1.421
  383   2HB   GLU  49          3HB       GLU  49  -9.859  -8.634  -0.056
  384   1HG   GLU  49          2HG       GLU  49 -11.335  -9.123  -1.894
  385   2HG   GLU  49          3HG       GLU  49 -11.323  -7.374  -1.685
  386    H    GLY  50           H        GLY  50  -9.252  -5.740   1.184
  387   1HA   GLY  50          1HA       GLY  50  -8.314  -6.412   3.372
  388   2HA   GLY  50          2HA       GLY  50  -6.794  -6.705   2.534
  389    H    VAL  51           H        VAL  51  -6.656  -4.472   0.900
  390    HA   VAL  51           HA       VAL  51  -5.822  -2.460   2.802
  391    HB   VAL  51           HB       VAL  51  -5.773  -2.532  -0.227
  392   1HG1  VAL  51          1HG1      VAL  51  -4.619  -0.550   1.755
  393   2HG1  VAL  51          2HG1      VAL  51  -4.132  -0.639   0.064
  394   3HG1  VAL  51          3HG1      VAL  51  -5.793  -0.220   0.481
  395   1HG2  VAL  51          1HG2      VAL  51  -4.328  -4.129   1.274
  396   2HG2  VAL  51          2HG2      VAL  51  -3.548  -3.249  -0.038
  397   3HG2  VAL  51          3HG2      VAL  51  -3.400  -2.672   1.623
  398    H    LYS  52           H        LYS  52  -6.767  -0.517   3.212
  399    HA   LYS  52           HA       LYS  52  -9.433  -0.064   2.026
  400   1HB   LYS  52          2HB       LYS  52  -9.507  -0.275   4.436
  401   2HB   LYS  52          3HB       LYS  52  -8.216   0.908   4.622
  402   1HG   LYS  52          2HG       LYS  52  -9.593   2.701   3.935
  403   2HG   LYS  52          3HG       LYS  52 -10.769   1.624   3.183
  404   1HD   LYS  52          2HD       LYS  52 -11.618   2.538   5.323
  405   2HD   LYS  52          3HD       LYS  52 -11.446   0.785   5.391
  406   1HE   LYS  52          2HE       LYS  52  -9.088   2.398   6.235
  407   2HE   LYS  52          3HE       LYS  52 -10.481   2.390   7.317
  408   1HZ   LYS  52          1HZ       LYS  52  -8.576   0.353   6.851
  409   2HZ   LYS  52          1HZ       LYS  52 -10.135  -0.216   6.493
  410   3HZ   LYS  52          3HZ       LYS  52  -9.794   0.427   8.028
  411    H    SER  53           H        SER  53  -6.277   1.388   2.620
  412    HA   SER  53           HA       SER  53  -6.468   3.146   0.417
  413   1HB   SER  53          2HB       SER  53  -6.328   5.271   2.024
  414   2HB   SER  53          3HB       SER  53  -7.865   4.676   1.404
  415    HG   SER  53           HG       SER  53  -7.015   4.849   3.933
  416    H    ILE  54           H        ILE  54  -4.705   5.009   0.730
  417    HA   ILE  54           HA       ILE  54  -2.434   3.975   2.291
  418    HB   ILE  54           HB       ILE  54  -2.420   4.502  -0.688
  419   1HG1  ILE  54          2HG1      ILE  54  -1.651   2.068   0.955
  420   2HG1  ILE  54          3HG1      ILE  54  -3.173   2.249   0.085
  421   1HG2  ILE  54          1HG2      ILE  54  -0.125   4.062   1.245
  422   2HG2  ILE  54          2HG2      ILE  54   0.030   3.977  -0.508
  423   3HG2  ILE  54          3HG2      ILE  54  -0.415   5.498   0.265
  424   1HD1  ILE  54          1HD1      ILE  54  -2.049   1.231  -1.615
  425   2HD1  ILE  54          2HD1      ILE  54  -1.382   2.841  -1.889
  426   3HD1  ILE  54          3HD1      ILE  54  -0.470   1.656  -0.952
  427    H    PHE  55           H        PHE  55  -0.793   5.515   2.707
  428    HA   PHE  55           HA       PHE  55  -1.378   8.305   1.984
  429   1HB   PHE  55          2HB       PHE  55  -2.432   8.155   4.112
  430   2HB   PHE  55          3HB       PHE  55  -1.107   7.210   4.785
  431    HD1  PHE  55           HD1      PHE  55   0.156   8.398   6.321
  432    HD2  PHE  55           HD2      PHE  55  -1.368  10.440   2.865
  433    HE1  PHE  55           HE1      PHE  55   1.276  10.482   7.061
  434    HE2  PHE  55           HE2      PHE  55  -0.247  12.527   3.602
  435    HZ   PHE  55           HZ       PHE  55   1.077  12.547   5.703
  436    H    HIS  56           H        HIS  56   0.402   8.818   0.874
  437    HA   HIS  56           HA       HIS  56   3.034   7.882   1.785
  438   1HB   HIS  56          2HB       HIS  56   2.593   7.567  -0.572
  439   2HB   HIS  56          3HB       HIS  56   2.124   9.255  -0.758
  440    HD1  HIS  56           HD1      HIS  56   4.001   9.965  -2.331
  441    HD2  HIS  56           HD2      HIS  56   5.418   8.181   1.159
  442    HE1  HIS  56           HE1      HIS  56   6.506  10.326  -2.309
  443    H    VAL  57           H        VAL  57   4.646   9.269   2.452
  444    HA   VAL  57           HA       VAL  57   4.374  12.132   2.283
  445    HB   VAL  57           HB       VAL  57   2.824  11.584   4.146
  446   1HG1  VAL  57          1HG1      VAL  57   3.437  10.344   5.981
  447   2HG1  VAL  57          2HG1      VAL  57   4.522   9.609   4.804
  448   3HG1  VAL  57          3HG1      VAL  57   5.122  10.855   5.897
  449   1HG2  VAL  57          1HG2      VAL  57   5.298  12.914   5.260
  450   2HG2  VAL  57          2HG2      VAL  57   4.309  13.690   4.023
  451   3HG2  VAL  57          3HG2      VAL  57   3.608  13.292   5.592
  452    H    MET  58           H        MET  58   6.177  13.243   3.392
  453    HA   MET  58           HA       MET  58   8.477  13.499   3.141
  454   1HB   MET  58          2HB       MET  58   9.599  12.559   5.199
  455   2HB   MET  58          3HB       MET  58   8.195  13.583   5.477
  456   1HG   MET  58          2HG       MET  58   7.239  10.915   5.210
  457   2HG   MET  58          3HG       MET  58   8.616  10.870   6.306
  458   1HE   MET  58          1HE       MET  58   7.694  12.674   9.377
  459   2HE   MET  58          2HE       MET  58   8.965  12.727   8.158
  460   3HE   MET  58          3HE       MET  58   8.357  11.172   8.720
  461    H    ASP  59           H        ASP  59   8.903  10.252   4.506
  462    HA   ASP  59           HA       ASP  59   9.907   9.318   1.913
  463   1HB   ASP  59          2HB       ASP  59  12.091   8.815   2.686
  464   2HB   ASP  59          3HB       ASP  59  11.769  10.473   3.178
  465    H    PHE  60           H        PHE  60   7.610   8.444   3.213
  466    HA   PHE  60           HA       PHE  60   8.146   5.633   3.338
  467   1HB   PHE  60          2HB       PHE  60   7.584   5.150   5.589
  468   2HB   PHE  60          3HB       PHE  60   8.755   6.460   5.674
  469    HD1  PHE  60           HD1      PHE  60   5.090   5.742   5.702
  470    HD2  PHE  60           HD2      PHE  60   8.212   8.502   6.732
  471    HE1  PHE  60           HE1      PHE  60   3.460   7.104   6.977
  472    HE2  PHE  60           HE2      PHE  60   6.582   9.864   8.008
  473    HZ   PHE  60           HZ       PHE  60   4.207   9.168   8.131
  474    H    ILE  61           H        ILE  61   6.256   4.364   3.248
  475    HA   ILE  61           HA       ILE  61   3.806   5.906   2.624
  476    HB   ILE  61           HB       ILE  61   4.716   3.226   1.540
  477   1HG1  ILE  61          2HG1      ILE  61   4.430   5.938   0.193
  478   2HG1  ILE  61          3HG1      ILE  61   5.963   5.207   0.666
  479   1HG2  ILE  61          1HG2      ILE  61   2.725   3.643  -0.016
  480   2HG2  ILE  61          2HG2      ILE  61   2.323   3.208   1.643
  481   3HG2  ILE  61          3HG2      ILE  61   2.219   4.891   1.120
  482   1HD1  ILE  61          1HD1      ILE  61   5.556   4.764  -1.700
  483   2HD1  ILE  61          2HD1      ILE  61   5.450   3.253  -0.794
  484   3HD1  ILE  61          3HD1      ILE  61   3.979   4.070  -1.326
  485    H    SER  62           H        SER  62   1.975   5.438   3.678
  486    HA   SER  62           HA       SER  62   2.064   3.269   5.676
  487   1HB   SER  62          2HB       SER  62   1.720   5.655   6.443
  488   2HB   SER  62          3HB       SER  62   0.174   5.625   5.603
  489    HG   SER  62           HG       SER  62   1.007   3.791   7.611
  490    H    VAL  63           H        VAL  63   1.087   1.476   4.979
  491    HA   VAL  63           HA       VAL  63  -1.241   1.700   3.186
  492    HB   VAL  63           HB       VAL  63   0.253  -0.809   3.985
  493   1HG1  VAL  63          1HG1      VAL  63  -2.123  -0.862   2.963
  494   2HG1  VAL  63          2HG1      VAL  63  -1.355  -0.284   1.482
  495   3HG1  VAL  63          3HG1      VAL  63  -0.879  -1.833   2.175
  496   1HG2  VAL  63          1HG2      VAL  63   1.121  -0.401   1.498
  497   2HG2  VAL  63          2HG2      VAL  63   0.831   1.287   1.921
  498   3HG2  VAL  63          3HG2      VAL  63   1.954   0.320   2.877
  499    H    ASP  64           H        ASP  64  -3.064   1.987   4.343
  500    HA   ASP  64           HA       ASP  64  -3.402   0.537   6.866
  501   1HB   ASP  64          2HB       ASP  64  -5.305   1.998   7.256
  502   2HB   ASP  64          3HB       ASP  64  -3.903   2.958   6.807
  503    H    LYS  65           H        LYS  65  -4.895  -1.020   7.205
  504    HA   LYS  65           HA       LYS  65  -6.480  -1.885   4.854
  505   1HB   LYS  65          2HB       LYS  65  -6.366  -4.171   6.049
  506   2HB   LYS  65          3HB       LYS  65  -4.911  -3.602   5.233
  507   1HG   LYS  65          2HG       LYS  65  -3.833  -3.059   7.234
  508   2HG   LYS  65          3HG       LYS  65  -5.348  -2.925   8.130
  509   1HD   LYS  65          2HD       LYS  65  -5.669  -5.386   7.879
  510   2HD   LYS  65          3HD       LYS  65  -4.088  -5.486   7.102
  511   1HE   LYS  65          2HE       LYS  65  -4.763  -4.905   9.966
  512   2HE   LYS  65          3HE       LYS  65  -3.520  -5.964   9.304
  513   1HZ   LYS  65          1HZ       LYS  65  -2.674  -3.867  10.306
  514   2HZ   LYS  65          1HZ       LYS  65  -3.455  -3.009   9.067
  515   3HZ   LYS  65          3HZ       LYS  65  -2.212  -4.097   8.694
  516    H    GLU  66           H        GLU  66  -8.168  -3.652   5.963
  517    HA   GLU  66           HA       GLU  66 -10.170  -2.042   7.123
  518   1HB   GLU  66          2HB       GLU  66 -10.003  -5.055   7.293
  519   2HB   GLU  66          3HB       GLU  66 -11.455  -4.056   7.350
  520   1HG   GLU  66          2HG       GLU  66 -10.766  -3.233   5.008
  521   2HG   GLU  66          3HG       GLU  66  -9.649  -4.595   4.991
  522    H    ASN  67           H        ASN  67 -11.085  -3.948   9.154
  523    HA   ASN  67           HA       ASN  67  -9.964  -2.716  11.438
  524   1HB   ASN  67          2HB       ASN  67 -11.221  -4.631  12.634
  525   2HB   ASN  67          3HB       ASN  67 -12.156  -3.456  11.715
  526   1HD2  ASN  67          2HD2      ASN  67 -13.887  -4.981  11.269
  527   2HD2  ASN  67          1HD2      ASN  67 -13.674  -6.284  10.202
  528    H    ASP  68           H        ASP  68  -9.491  -5.956  10.030
  529    HA   ASP  68           HA       ASP  68  -6.938  -6.136  11.471
  530   1HB   ASP  68          2HB       ASP  68  -8.220  -7.354  12.993
  531   2HB   ASP  68          3HB       ASP  68  -9.269  -8.006  11.740
  532    H    ALA  69           H        ALA  69  -9.106  -7.924   9.254
  533    HA   ALA  69           HA       ALA  69  -8.661  -9.142   7.351
  534   1HB   ALA  69          1HB       ALA  69  -7.527  -7.963   5.676
  535   2HB   ALA  69          2HB       ALA  69  -8.063  -6.681   6.761
  536   3HB   ALA  69          3HB       ALA  69  -6.391  -7.242   6.816
  537    H    ASN  70           H        ASN  70  -6.033  -9.334   6.046
  538    HA   ASN  70           HA       ASN  70  -4.427 -10.801   8.026
  539   1HB   ASN  70          2HB       ASN  70  -5.448 -11.959   5.421
  540   2HB   ASN  70          3HB       ASN  70  -4.183 -12.692   6.406
  541   1HD2  ASN  70          2HD2      ASN  70  -4.926 -12.946   8.866
  542   2HD2  ASN  70          1HD2      ASN  70  -6.507 -13.522   9.082
  543    H    TRP  71           H        TRP  71  -2.310 -10.404   7.792
  544    HA   TRP  71           HA       TRP  71  -1.426  -8.743   5.573
  545   1HB   TRP  71          2HB       TRP  71  -0.271  -9.610   8.193
  546   2HB   TRP  71          3HB       TRP  71   0.822  -9.060   6.925
  547    HD1  TRP  71           HD1      TRP  71  -1.044  -7.756   9.713
  548    HE1  TRP  71           HE1      TRP  71  -1.457  -5.226   9.498
  549    HE3  TRP  71           HE3      TRP  71   0.109  -7.093   4.782
  550    HZ2  TRP  71           HZ2      TRP  71  -1.312  -3.180   7.493
  551    HZ3  TRP  71           HZ3      TRP  71  -0.037  -4.845   3.748
  552    HH2  TRP  71           HH2      TRP  71  -0.746  -2.889   5.098
  553    H    GLU  72           H        GLU  72  -0.713 -11.945   6.914
  554    HA   GLU  72           HA       GLU  72   1.348 -12.697   5.199
  555   1HB   GLU  72          2HB       GLU  72  -0.779 -14.622   6.129
  556   2HB   GLU  72          3HB       GLU  72   0.933 -14.930   5.856
  557   1HG   GLU  72          2HG       GLU  72   0.941 -14.729   8.160
  558   2HG   GLU  72          3HG       GLU  72   1.226 -13.049   7.713
  559    H    THR  73           H        THR  73  -2.025 -12.305   4.531
  560    HA   THR  73           HA       THR  73  -1.916 -13.880   2.064
  561    HB   THR  73           HB       THR  73  -4.103 -12.417   3.539
  562    HG1  THR  73           HG1      THR  73  -4.959 -14.524   3.533
  563   1HG2  THR  73          1HG2      THR  73  -4.071 -13.435   0.699
  564   2HG2  THR  73          2HG2      THR  73  -5.566 -13.390   1.633
  565   3HG2  THR  73          3HG2      THR  73  -4.682 -11.898   1.313
  566    H    VAL  74           H        VAL  74  -2.398 -10.539   3.102
  567    HA   VAL  74           HA       VAL  74  -2.485  -9.513   0.409
  568    HB   VAL  74           HB       VAL  74  -2.968  -8.549   3.121
  569   1HG1  VAL  74          1HG1      VAL  74  -1.596  -6.703   1.150
  570   2HG1  VAL  74          2HG1      VAL  74  -2.445  -6.172   2.602
  571   3HG1  VAL  74          3HG1      VAL  74  -1.002  -7.170   2.745
  572   1HG2  VAL  74          1HG2      VAL  74  -3.855  -7.447   0.446
  573   2HG2  VAL  74          2HG2      VAL  74  -4.606  -8.846   1.213
  574   3HG2  VAL  74          3HG2      VAL  74  -4.665  -7.271   2.002
  575    H    LEU  75           H        LEU  75  -0.102  -9.632   3.026
  576    HA   LEU  75           HA       LEU  75   1.824  -7.886   2.129
  577   1HB   LEU  75          2HB       LEU  75   2.084  -8.993   4.248
  578   2HB   LEU  75          3HB       LEU  75   2.192 -10.572   3.477
  579    HG   LEU  75           HG       LEU  75   4.144  -8.594   2.474
  580   1HD1  LEU  75          1HD1      LEU  75   3.940  -9.297   5.371
  581   2HD1  LEU  75          2HD1      LEU  75   5.548  -9.267   4.646
  582   3HD1  LEU  75          3HD1      LEU  75   4.539  -7.822   4.612
  583   1HD2  LEU  75          1HD2      LEU  75   5.654 -10.608   2.920
  584   2HD2  LEU  75          2HD2      LEU  75   4.201 -11.470   3.428
  585   3HD2  LEU  75          3HD2      LEU  75   4.345 -10.880   1.773
  586    HA   PRO  76           HA       PRO  76   3.875 -11.576  -0.475
  587   1HB   PRO  76          2HB       PRO  76   1.587 -12.956  -1.552
  588   2HB   PRO  76          3HB       PRO  76   2.908 -13.615  -0.572
  589   1HG   PRO  76          2HG       PRO  76   0.209 -12.832   0.220
  590   2HG   PRO  76          3HG       PRO  76   1.367 -13.882   1.045
  591   1HD   PRO  76          2HD       PRO  76   0.702 -11.392   1.952
  592   2HD   PRO  76          3HD       PRO  76   2.286 -12.141   2.252
  593    H    LYS  77           H        LYS  77   0.767 -10.019  -1.080
  594    HA   LYS  77           HA       LYS  77   1.252  -9.701  -3.921
  595   1HB   LYS  77          2HB       LYS  77  -0.824  -8.297  -2.228
  596   2HB   LYS  77          3HB       LYS  77  -0.856  -8.571  -3.970
  597   1HG   LYS  77          2HG       LYS  77  -0.984 -11.002  -3.598
  598   2HG   LYS  77          3HG       LYS  77  -0.927 -10.745  -1.854
  599   1HD   LYS  77          2HD       LYS  77  -3.021  -9.444  -1.972
  600   2HD   LYS  77          3HD       LYS  77  -3.084  -9.704  -3.715
  601   1HE   LYS  77          2HE       LYS  77  -2.747 -12.269  -2.646
  602   2HE   LYS  77          3HE       LYS  77  -3.890 -11.487  -1.557
  603   1HZ   LYS  77          1HZ       LYS  77  -5.460 -11.748  -3.071
  604   2HZ   LYS  77          1HZ       LYS  77  -4.356 -12.492  -4.127
  605   3HZ   LYS  77          3HZ       LYS  77  -4.582 -10.810  -4.178
  606    H    VAL  78           H        VAL  78   1.118  -7.558  -1.069
  607    HA   VAL  78           HA       VAL  78   1.706  -5.128  -2.255
  608    HB   VAL  78           HB       VAL  78   2.475  -6.259   0.437
  609   1HG1  VAL  78          1HG1      VAL  78   2.839  -3.720   0.940
  610   2HG1  VAL  78          2HG1      VAL  78   4.144  -4.626   0.176
  611   3HG1  VAL  78          3HG1      VAL  78   3.105  -3.582  -0.796
  612   1HG2  VAL  78          1HG2      VAL  78   0.653  -4.956   1.240
  613   2HG2  VAL  78          2HG2      VAL  78   0.564  -4.021  -0.254
  614   3HG2  VAL  78          3HG2      VAL  78   0.056  -5.708  -0.239
  615    H    GLU  79           H        GLU  79   4.058  -7.466  -0.924
  616    HA   GLU  79           HA       GLU  79   6.399  -6.124  -1.616
  617   1HB   GLU  79          2HB       GLU  79   6.144  -8.237  -0.199
  618   2HB   GLU  79          3HB       GLU  79   6.112  -9.128  -1.722
  619   1HG   GLU  79          2HG       GLU  79   8.290  -7.986  -2.327
  620   2HG   GLU  79          3HG       GLU  79   8.343  -7.363  -0.680
  621    H    ALA  80           H        ALA  80   4.415  -8.346  -3.530
  622    HA   ALA  80           HA       ALA  80   6.053  -8.742  -5.727
  623   1HB   ALA  80          1HB       ALA  80   4.131  -9.394  -6.911
  624   2HB   ALA  80          2HB       ALA  80   3.713  -9.704  -5.225
  625   3HB   ALA  80          3HB       ALA  80   3.096  -8.266  -6.036
  626    H    VAL  81           H        VAL  81   4.146  -5.917  -4.868
  627    HA   VAL  81           HA       VAL  81   4.188  -4.569  -7.332
  628    HB   VAL  81           HB       VAL  81   4.362  -3.267  -4.601
  629   1HG1  VAL  81          1HG1      VAL  81   4.420  -2.092  -7.062
  630   2HG1  VAL  81          2HG1      VAL  81   2.681  -2.168  -6.786
  631   3HG1  VAL  81          3HG1      VAL  81   3.720  -1.328  -5.636
  632   1HG2  VAL  81          1HG2      VAL  81   1.723  -3.708  -5.902
  633   2HG2  VAL  81          2HG2      VAL  81   2.497  -5.145  -5.237
  634   3HG2  VAL  81          3HG2      VAL  81   2.160  -3.765  -4.195
  635    H    PHE  82           H        PHE  82   6.423  -4.245  -4.552
  636    HA   PHE  82           HA       PHE  82   8.308  -2.735  -6.178
  637   1HB   PHE  82          2HB       PHE  82   9.015  -3.758  -3.460
  638   2HB   PHE  82          3HB       PHE  82   9.393  -2.211  -4.212
  639    HD1  PHE  82           HD1      PHE  82   7.440  -0.570  -4.624
  640    HD2  PHE  82           HD2      PHE  82   7.181  -3.963  -2.004
  641    HE1  PHE  82           HE1      PHE  82   5.488   0.455  -3.490
  642    HE2  PHE  82           HE2      PHE  82   5.232  -2.937  -0.870
  643    HZ   PHE  82           HZ       PHE  82   4.385  -0.729  -1.613
  644    H    GLU  83           H        GLU  83   7.801  -5.329  -7.167
  645    HA   GLU  83           HA       GLU  83  10.499  -6.338  -7.298
  646   1HB   GLU  83          2HB       GLU  83   8.569  -7.596  -5.511
  647   2HB   GLU  83          3HB       GLU  83   9.144  -8.712  -6.746
  648   1HG   GLU  83          2HG       GLU  83  11.098  -6.985  -5.240
  649   2HG   GLU  83          3HG       GLU  83  10.510  -8.489  -4.537
  650    H    LEU  84           H        LEU  84   7.422  -8.027  -7.753
  651    HA   LEU  84           HA       LEU  84   6.307  -8.744  -9.624
  652   1HB   LEU  84          2HB       LEU  84   8.066  -6.873 -11.223
  653   2HB   LEU  84          3HB       LEU  84   6.511  -7.547 -11.698
  654    HG   LEU  84           HG       LEU  84   6.783  -5.843  -9.222
  655   1HD1  LEU  84          1HD1      LEU  84   6.266  -4.939 -12.067
  656   2HD1  LEU  84          2HD1      LEU  84   6.012  -3.937 -10.637
  657   3HD1  LEU  84          3HD1      LEU  84   7.634  -4.485 -11.051
  658   1HD2  LEU  84          1HD2      LEU  84   4.502  -6.596 -11.077
  659   2HD2  LEU  84          2HD2      LEU  84   4.721  -7.116  -9.406
  660   3HD2  LEU  84          3HD2      LEU  84   4.357  -5.429  -9.763
  661    H    GLU  85           H        GLU  85   9.802  -8.507  -9.825
  662    HA   GLU  85           HA       GLU  85  10.173 -10.471 -11.863
  663   1HB   GLU  85          2HB       GLU  85  11.773  -8.607 -10.779
  664   2HB   GLU  85          3HB       GLU  85  12.289  -9.990  -9.818
  665   1HG   GLU  85          2HG       GLU  85  12.174  -9.950 -12.847
  666   2HG   GLU  85          3HG       GLU  85  13.638  -9.697 -11.899
  667    H    HIS  86           H        HIS  86  10.265 -12.654 -11.716
  668    HA   HIS  86           HA       HIS  86   9.196 -14.074  -9.605
  669   1HB   HIS  86          2HB       HIS  86  10.164 -16.089 -10.602
  670   2HB   HIS  86          3HB       HIS  86   9.505 -15.036 -11.849
  671    HD1  HIS  86           HD1      HIS  86  12.909 -14.920 -10.108
  672    HD2  HIS  86           HD2      HIS  86  11.297 -15.268 -13.936
  673    HE1  HIS  86           HE1      HIS  86  14.866 -14.922 -11.710
  674    H    HIS  87           H        HIS  87  10.214 -15.677  -8.183
  675    HA   HIS  87           HA       HIS  87  12.980 -15.272  -7.434
  676   1HB   HIS  87          2HB       HIS  87  12.457 -14.636  -5.090
  677   2HB   HIS  87          3HB       HIS  87  11.965 -13.399  -6.248
  678    HD1  HIS  87           HD1      HIS  87   9.301 -13.902  -7.129
  679    HD2  HIS  87           HD2      HIS  87  10.421 -15.150  -3.313
  680    HE1  HIS  87           HE1      HIS  87   7.154 -14.247  -5.831
  681    H    HIS  88           H        HIS  88  13.197 -17.475  -7.845
  682    HA   HIS  88           HA       HIS  88  11.482 -19.439  -6.644
  683   1HB   HIS  88          2HB       HIS  88  14.255 -19.887  -7.768
  684   2HB   HIS  88          3HB       HIS  88  12.950 -21.063  -7.616
  685    HD1  HIS  88           HD1      HIS  88  14.181 -20.521 -10.382
  686    HD2  HIS  88           HD2      HIS  88  10.834 -18.501  -8.929
  687    HE1  HIS  88           HE1      HIS  88  12.943 -19.636 -12.406
  688    H    HIS  89           H        HIS  89  14.227 -20.924  -6.085
  689    HA   HIS  89           HA       HIS  89  15.070 -19.709  -3.597
  690   1HB   HIS  89          2HB       HIS  89  12.902 -20.969  -3.081
  691   2HB   HIS  89          3HB       HIS  89  13.798 -22.444  -3.443
  692    HD1  HIS  89           HD1      HIS  89  13.813 -19.504  -1.056
  693    HD2  HIS  89           HD2      HIS  89  15.558 -23.273  -1.422
  694    HE1  HIS  89           HE1      HIS  89  15.008 -19.957   1.132
  695    H    HIS  90           H        HIS  90  14.952 -22.763  -5.412
  696    HA   HIS  90           HA       HIS  90  17.427 -23.794  -4.571
  697   1HB   HIS  90          2HB       HIS  90  17.271 -24.991  -6.894
  698   2HB   HIS  90          3HB       HIS  90  16.075 -25.357  -5.652
  699    HD1  HIS  90           HD1      HIS  90  16.509 -23.353  -8.834
  700    HD2  HIS  90           HD2      HIS  90  13.453 -24.556  -6.266
  701    HE1  HIS  90           HE1      HIS  90  14.330 -22.757  -9.982
  702    H    HIS  91           H        HIS  91  19.479 -23.708  -5.442
  703    HA   HIS  91           HA       HIS  91  20.062 -22.094  -7.775
  704   1HB   HIS  91          2HB       HIS  91  19.848 -20.360  -6.047
  705   2HB   HIS  91          3HB       HIS  91  21.002 -21.217  -5.028
  706    HD1  HIS  91           HD1      HIS  91  23.070 -19.806  -5.088
  707    HD2  HIS  91           HD2      HIS  91  21.451 -20.327  -8.895
  708    HE1  HIS  91           HE1      HIS  91  24.707 -18.759  -6.713
  Start of MODEL    9
    1   1H    MET   1          1HT       MET   1  14.432   2.759  -4.462
    2   2H    MET   1          2HT       MET   1  13.839   1.396  -5.287
    3   3H    MET   1          3HT       MET   1  14.062   1.344  -3.603
    4    HA   MET   1           HA       MET   1  12.369   3.125  -3.378
    5   1HB   MET   1          2HB       MET   1  11.836   2.419  -6.281
    6   2HB   MET   1          3HB       MET   1  10.930   3.569  -5.297
    7   1HG   MET   1          2HG       MET   1  12.932   4.981  -5.078
    8   2HG   MET   1          3HG       MET   1  13.866   3.822  -6.021
    9   1HE   MET   1          1HE       MET   1  13.375   7.170  -7.127
   10   2HE   MET   1          2HE       MET   1  13.892   6.375  -8.612
   11   3HE   MET   1          3HE       MET   1  14.552   5.851  -7.064
   12    H    LYS   2           H        LYS   2  12.616   0.774  -2.299
   13    HA   LYS   2           HA       LYS   2  10.051  -0.558  -2.816
   14   1HB   LYS   2          2HB       LYS   2  11.083  -2.780  -2.706
   15   2HB   LYS   2          3HB       LYS   2  11.755  -1.855  -4.048
   16   1HG   LYS   2          2HG       LYS   2  13.686  -1.219  -2.606
   17   2HG   LYS   2          3HG       LYS   2  13.032  -2.239  -1.324
   18   1HD   LYS   2          2HD       LYS   2  13.107  -4.178  -2.955
   19   2HD   LYS   2          3HD       LYS   2  13.994  -3.122  -4.059
   20   1HE   LYS   2          2HE       LYS   2  15.749  -2.800  -2.369
   21   2HE   LYS   2          3HE       LYS   2  14.856  -3.808  -1.232
   22   1HZ   LYS   2          1HZ       LYS   2  15.836  -5.566  -2.113
   23   2HZ   LYS   2          1HZ       LYS   2  16.630  -4.603  -3.267
   24   3HZ   LYS   2          3HZ       LYS   2  15.091  -5.243  -3.602
   25    H    ILE   3           H        ILE   3  10.389  -2.643  -0.986
   26    HA   ILE   3           HA       ILE   3  10.023  -1.204   1.498
   27    HB   ILE   3           HB       ILE   3   9.985  -4.188   0.964
   28   1HG1  ILE   3          2HG1      ILE   3   7.547  -2.461   1.292
   29   2HG1  ILE   3          3HG1      ILE   3   8.348  -2.519  -0.276
   30   1HG2  ILE   3          1HG2      ILE   3   8.683  -4.277   3.054
   31   2HG2  ILE   3          2HG2      ILE   3  10.265  -3.560   3.350
   32   3HG2  ILE   3          3HG2      ILE   3   8.839  -2.530   3.240
   33   1HD1  ILE   3          1HD1      ILE   3   7.382  -4.940   1.275
   34   2HD1  ILE   3          2HD1      ILE   3   6.556  -4.223  -0.107
   35   3HD1  ILE   3          3HD1      ILE   3   8.141  -4.968  -0.317
   36    H    ILE   4           H        ILE   4  11.555  -0.800   2.941
   37    HA   ILE   4           HA       ILE   4  14.074  -2.342   2.794
   38    HB   ILE   4           HB       ILE   4  13.659   0.369   4.061
   39   1HG1  ILE   4          2HG1      ILE   4  13.119   0.625   1.714
   40   2HG1  ILE   4          3HG1      ILE   4  14.753   1.236   1.957
   41   1HG2  ILE   4          1HG2      ILE   4  16.060  -1.288   3.264
   42   2HG2  ILE   4          2HG2      ILE   4  16.173   0.439   3.605
   43   3HG2  ILE   4          3HG2      ILE   4  15.644  -0.674   4.866
   44   1HD1  ILE   4          1HD1      ILE   4  15.432  -1.253   1.363
   45   2HD1  ILE   4          2HD1      ILE   4  13.854  -1.269   0.580
   46   3HD1  ILE   4          3HD1      ILE   4  15.071  -0.097   0.082
   47    H    SER   5           H        SER   5  11.755  -0.880   5.053
   48    HA   SER   5           HA       SER   5  11.933  -3.056   6.883
   49   1HB   SER   5          2HB       SER   5  13.929  -2.348   7.788
   50   2HB   SER   5          3HB       SER   5  13.662  -0.668   7.333
   51    HG   SER   5           HG       SER   5  12.044  -0.611   8.993
   52    H    ILE   6           H        ILE   6  10.464  -2.841   8.648
   53    HA   ILE   6           HA       ILE   6   8.414  -0.786   8.170
   54    HB   ILE   6           HB       ILE   6   7.944  -2.935  10.173
   55   1HG1  ILE   6          2HG1      ILE   6   9.158  -4.168   8.399
   56   2HG1  ILE   6          3HG1      ILE   6   7.452  -4.607   8.418
   57   1HG2  ILE   6          1HG2      ILE   6   6.350  -1.082   9.147
   58   2HG2  ILE   6          2HG2      ILE   6   6.182  -2.254   7.841
   59   3HG2  ILE   6          3HG2      ILE   6   5.735  -2.699   9.486
   60   1HD1  ILE   6          1HD1      ILE   6   6.979  -3.286   6.495
   61   2HD1  ILE   6          2HD1      ILE   6   8.518  -2.435   6.605
   62   3HD1  ILE   6          3HD1      ILE   6   8.481  -4.127   6.117
   63    H    SER   7           H        SER   7   7.249  -0.853  10.753
   64    HA   SER   7           HA       SER   7   9.341   0.003  12.604
   65   1HB   SER   7          2HB       SER   7   7.205   1.843  11.524
   66   2HB   SER   7          3HB       SER   7   8.056   2.156  13.034
   67    HG   SER   7           HG       SER   7   9.857   1.507  11.205
   68    H    GLU   8           H        GLU   8   8.439  -2.047  13.472
   69    HA   GLU   8           HA       GLU   8   5.927  -2.608  14.325
   70   1HB   GLU   8          2HB       GLU   8   7.602  -3.162  16.570
   71   2HB   GLU   8          3HB       GLU   8   6.978  -4.280  15.367
   72   1HG   GLU   8          2HG       GLU   8   9.463  -2.599  14.937
   73   2HG   GLU   8          3HG       GLU   8   9.502  -4.237  15.581
   74    H    THR   9           H        THR   9   4.477  -1.792  15.668
   75    HA   THR   9           HA       THR   9   5.271   0.014  17.826
   76    HB   THR   9           HB       THR   9   4.978   1.618  16.095
   77    HG1  THR   9           HG1      THR   9   2.581   1.281  17.567
   78   1HG2  THR   9          1HG2      THR   9   2.461   0.104  15.354
   79   2HG2  THR   9          2HG2      THR   9   3.005   1.601  14.601
   80   3HG2  THR   9          3HG2      THR   9   3.964   0.130  14.432
   81    HA   PRO  10           HA       PRO  10   2.117  -2.039  20.091
   82   1HB   PRO  10          2HB       PRO  10   0.946   0.366  21.158
   83   2HB   PRO  10          3HB       PRO  10   2.036  -0.772  21.961
   84   1HG   PRO  10          2HG       PRO  10   2.607   1.837  20.827
   85   2HG   PRO  10          3HG       PRO  10   3.590   0.836  21.906
   86   1HD   PRO  10          2HD       PRO  10   4.168   1.312  19.236
   87   2HD   PRO  10          3HD       PRO  10   4.793  -0.054  20.179
   88    H    ASN  11           H        ASN  11   1.472   0.324  17.711
   89    HA   ASN  11           HA       ASN  11  -1.421  -0.186  17.713
   90   1HB   ASN  11          2HB       ASN  11  -0.215   2.155  17.423
   91   2HB   ASN  11          3HB       ASN  11  -0.081   1.627  15.746
   92   1HD2  ASN  11          2HD2      ASN  11  -2.646   1.544  18.308
   93   2HD2  ASN  11          1HD2      ASN  11  -3.882   2.077  17.278
   94    H    HIS  12           H        HIS  12  -2.440  -0.605  15.590
   95    HA   HIS  12           HA       HIS  12  -0.711  -2.000  13.667
   96   1HB   HIS  12          2HB       HIS  12  -3.209  -3.212  14.886
   97   2HB   HIS  12          3HB       HIS  12  -2.255  -3.918  13.582
   98    HD1  HIS  12           HD1      HIS  12  -2.465  -3.730  17.232
   99    HD2  HIS  12           HD2      HIS  12   0.521  -4.548  14.439
  100    HE1  HIS  12           HE1      HIS  12  -0.578  -4.840  18.505
  101    H    ASN  13           H        ASN  13  -3.268  -3.076  12.467
  102    HA   ASN  13           HA       ASN  13  -4.855  -2.480  10.932
  103   1HB   ASN  13          2HB       ASN  13  -4.722   0.371  11.881
  104   2HB   ASN  13          3HB       ASN  13  -6.089  -0.501  11.198
  105   1HD2  ASN  13          2HD2      ASN  13  -5.325  -2.913  12.994
  106   2HD2  ASN  13          1HD2      ASN  13  -5.939  -2.485  14.517
  107    H    THR  14           H        THR  14  -2.196  -0.143  11.289
  108    HA   THR  14           HA       THR  14  -1.664  -0.382   8.432
  109    HB   THR  14           HB       THR  14  -3.199   1.577   8.592
  110    HG1  THR  14           HG1      THR  14  -1.689   3.028   7.577
  111   1HG2  THR  14          1HG2      THR  14  -2.424   2.197  10.933
  112   2HG2  THR  14          2HG2      THR  14  -0.970   2.866  10.192
  113   3HG2  THR  14          3HG2      THR  14  -2.550   3.547   9.807
  114    H    MET  15           H        MET  15   0.464  -0.331   7.981
  115    HA   MET  15           HA       MET  15   2.301   0.366  10.194
  116   1HB   MET  15          2HB       MET  15   3.888  -1.224   8.989
  117   2HB   MET  15          3HB       MET  15   2.503  -1.965   9.787
  118   1HG   MET  15          2HG       MET  15   1.672  -2.730   7.834
  119   2HG   MET  15          3HG       MET  15   1.874  -1.164   7.051
  120   1HE   MET  15          1HE       MET  15   4.160  -4.901   6.431
  121   2HE   MET  15          2HE       MET  15   2.492  -4.450   6.092
  122   3HE   MET  15          3HE       MET  15   3.036  -4.591   7.762
  123    H    LYS  16           H        LYS  16   4.485   1.064   9.480
  124    HA   LYS  16           HA       LYS  16   4.255   2.961   7.238
  125   1HB   LYS  16          2HB       LYS  16   4.915   4.064   9.241
  126   2HB   LYS  16          3HB       LYS  16   6.085   2.806   9.638
  127   1HG   LYS  16          2HG       LYS  16   7.530   3.456   7.833
  128   2HG   LYS  16          3HG       LYS  16   6.304   4.524   7.154
  129   1HD   LYS  16          2HD       LYS  16   6.634   6.158   8.766
  130   2HD   LYS  16          3HD       LYS  16   7.201   5.003   9.972
  131   1HE   LYS  16          2HE       LYS  16   9.363   5.010   9.171
  132   2HE   LYS  16          3HE       LYS  16   8.861   5.333   7.512
  133   1HZ   LYS  16          1HZ       LYS  16   8.185   7.471   9.281
  134   2HZ   LYS  16          1HZ       LYS  16   9.059   7.510   7.824
  135   3HZ   LYS  16          3HZ       LYS  16   9.853   7.159   9.285
  136    H    ILE  17           H        ILE  17   5.327   2.615   5.387
  137    HA   ILE  17           HA       ILE  17   7.251   0.389   5.274
  138    HB   ILE  17           HB       ILE  17   5.671   1.848   3.150
  139   1HG1  ILE  17          2HG1      ILE  17   5.769  -1.072   3.985
  140   2HG1  ILE  17          3HG1      ILE  17   4.538   0.074   4.511
  141   1HG2  ILE  17          1HG2      ILE  17   7.693   1.458   2.021
  142   2HG2  ILE  17          2HG2      ILE  17   8.023  -0.021   2.924
  143   3HG2  ILE  17          3HG2      ILE  17   6.777  -0.011   1.678
  144   1HD1  ILE  17          1HD1      ILE  17   4.254   0.507   1.926
  145   2HD1  ILE  17          2HD1      ILE  17   5.000  -1.086   1.782
  146   3HD1  ILE  17          3HD1      ILE  17   3.490  -0.896   2.672
  147    H    THR  18           H        THR  18   9.352   0.820   5.255
  148    HA   THR  18           HA       THR  18  10.292   3.547   4.836
  149    HB   THR  18           HB       THR  18  11.876   1.062   5.527
  150    HG1  THR  18           HG1      THR  18  11.529   2.772   7.542
  151   1HG2  THR  18          1HG2      THR  18  13.409   2.699   4.808
  152   2HG2  THR  18          2HG2      THR  18  12.458   4.020   5.491
  153   3HG2  THR  18          3HG2      THR  18  13.354   2.933   6.554
  154    H    LEU  19           H        LEU  19  11.350   4.271   3.076
  155    HA   LEU  19           HA       LEU  19  11.759   2.371   0.854
  156   1HB   LEU  19          2HB       LEU  19  11.654   5.387   0.702
  157   2HB   LEU  19          3HB       LEU  19  11.569   4.241  -0.636
  158    HG   LEU  19           HG       LEU  19   9.535   4.221   1.603
  159   1HD1  LEU  19          1HD1      LEU  19   8.067   5.535   0.086
  160   2HD1  LEU  19          2HD1      LEU  19   9.474   6.457   0.612
  161   3HD1  LEU  19          3HD1      LEU  19   9.432   5.761  -1.009
  162   1HD2  LEU  19          1HD2      LEU  19   9.730   3.079  -1.190
  163   2HD2  LEU  19          2HD2      LEU  19   9.443   2.221   0.325
  164   3HD2  LEU  19          3HD2      LEU  19   8.179   3.238  -0.367
  165    H    SER  20           H        SER  20  13.621   2.872  -0.605
  166    HA   SER  20           HA       SER  20  16.054   2.926   0.882
  167   1HB   SER  20          2HB       SER  20  15.555   1.716  -1.348
  168   2HB   SER  20          3HB       SER  20  15.862   3.274  -2.105
  169    HG   SER  20           HG       SER  20  17.925   3.216  -1.416
  170    H    GLU  21           H        GLU  21  14.030   5.380  -0.177
  171    HA   GLU  21           HA       GLU  21  16.211   7.297  -0.569
  172   1HB   GLU  21          2HB       GLU  21  13.228   7.738  -0.862
  173   2HB   GLU  21          3HB       GLU  21  14.511   8.826  -1.384
  174   1HG   GLU  21          2HG       GLU  21  13.965   7.715  -3.374
  175   2HG   GLU  21          3HG       GLU  21  15.339   6.784  -2.791
  176    H    SER  22           H        SER  22  17.008   7.803   1.434
  177    HA   SER  22           HA       SER  22  15.183   8.408   3.638
  178   1HB   SER  22          2HB       SER  22  17.369   7.086   3.874
  179   2HB   SER  22          3HB       SER  22  18.193   8.629   3.677
  180    HG   SER  22           HG       SER  22  16.813   7.622   5.814
  181    H    ARG  23           H        ARG  23  16.107  10.376   5.035
  182    HA   ARG  23           HA       ARG  23  15.770  12.689   5.117
  183   1HB   ARG  23          2HB       ARG  23  18.276  12.336   3.453
  184   2HB   ARG  23          3HB       ARG  23  17.807  13.842   4.242
  185   1HG   ARG  23          2HG       ARG  23  17.995  11.296   5.836
  186   2HG   ARG  23          3HG       ARG  23  19.450  12.222   5.476
  187   1HD   ARG  23          2HD       ARG  23  16.978  13.281   6.877
  188   2HD   ARG  23          3HD       ARG  23  18.510  12.892   7.650
  189    HE   ARG  23           HE       ARG  23  17.996  15.172   5.860
  190   1HH1  ARG  23          1HH2      ARG  23  19.506  14.123   8.682
  191   2HH1  ARG  23          2HH2      ARG  23  20.952  15.053   8.470
  192   1HH2  ARG  23          1HH1      ARG  23  20.158  16.053   5.248
  193   2HH2  ARG  23          2HH1      ARG  23  21.321  16.140   6.528
  194    H    GLU  24           H        GLU  24  17.289  13.898   2.493
  195    HA   GLU  24           HA       GLU  24  16.388  15.294   0.856
  196   1HB   GLU  24          2HB       GLU  24  15.694  12.455   0.102
  197   2HB   GLU  24          3HB       GLU  24  15.390  13.807  -0.987
  198   1HG   GLU  24          2HG       GLU  24  17.550  12.947  -1.570
  199   2HG   GLU  24          3HG       GLU  24  17.833  14.449  -0.696
  200    H    GLY  25           H        GLY  25  13.781  13.269  -0.011
  201   1HA   GLY  25          1HA       GLY  25  11.592  13.493   1.302
  202   2HA   GLY  25          2HA       GLY  25  11.878  15.220   1.133
  203    H    MET  26           H        MET  26   9.993  12.921  -0.014
  204    HA   MET  26           HA       MET  26  10.160  13.579  -2.868
  205   1HB   MET  26          2HB       MET  26   8.345  11.675  -1.359
  206   2HB   MET  26          3HB       MET  26   8.383  11.873  -3.112
  207   1HG   MET  26          2HG       MET  26  10.521  10.925  -3.298
  208   2HG   MET  26          3HG       MET  26  10.906  11.217  -1.603
  209   1HE   MET  26          1HE       MET  26  11.615   8.364  -2.609
  210   2HE   MET  26          2HE       MET  26  10.582   8.793  -3.970
  211   3HE   MET  26          3HE       MET  26  10.255   7.323  -3.056
  212    H    THR  27           H        THR  27   7.125  12.951  -1.263
  213    HA   THR  27           HA       THR  27   6.304  15.692  -1.033
  214    HB   THR  27           HB       THR  27   4.708  14.188  -3.081
  215    HG1  THR  27           HG1      THR  27   7.139  15.563  -3.491
  216   1HG2  THR  27          1HG2      THR  27   4.079  16.403  -3.767
  217   2HG2  THR  27          2HG2      THR  27   3.985  16.365  -2.007
  218   3HG2  THR  27          3HG2      THR  27   5.362  17.131  -2.801
  219    H    SER  28           H        SER  28   3.478  14.708  -1.722
  220    HA   SER  28           HA       SER  28   2.925  12.673   0.253
  221   1HB   SER  28          2HB       SER  28   1.533  14.076   1.691
  222   2HB   SER  28          3HB       SER  28   3.182  14.692   1.671
  223    HG   SER  28           HG       SER  28   2.349  16.063  -0.134
  224    H    ASP  29           H        ASP  29   1.052  11.628  -0.234
  225    HA   ASP  29           HA       ASP  29  -1.067  12.935  -1.736
  226   1HB   ASP  29          2HB       ASP  29   0.615  10.729  -2.934
  227   2HB   ASP  29          3HB       ASP  29  -1.006  11.113  -3.506
  228    H    THR  30           H        THR  30  -3.007  12.045  -1.275
  229    HA   THR  30           HA       THR  30  -3.018   9.589   0.364
  230    HB   THR  30           HB       THR  30  -5.404  11.384   0.080
  231    HG1  THR  30           HG1      THR  30  -4.446  12.483   1.968
  232   1HG2  THR  30          1HG2      THR  30  -5.691  10.675   2.454
  233   2HG2  THR  30          2HG2      THR  30  -5.635   9.308   1.341
  234   3HG2  THR  30          3HG2      THR  30  -4.222   9.712   2.316
  235    H    TYR  31           H        TYR  31  -3.669   7.759  -0.588
  236    HA   TYR  31           HA       TYR  31  -5.420   7.968  -2.965
  237   1HB   TYR  31          2HB       TYR  31  -3.564   5.673  -2.305
  238   2HB   TYR  31          3HB       TYR  31  -4.439   5.950  -3.808
  239    HD1  TYR  31           HD1      TYR  31  -1.316   6.283  -2.256
  240    HD2  TYR  31           HD2      TYR  31  -3.996   8.387  -4.873
  241    HE1  TYR  31           HE1      TYR  31   0.582   7.613  -3.134
  242    HE2  TYR  31           HE2      TYR  31  -2.094   9.714  -5.752
  243    HH   TYR  31           HH       TYR  31   1.173   8.898  -5.095
  244    H    THR  32           H        THR  32  -7.438   7.440  -2.538
  245    HA   THR  32           HA       THR  32  -7.977   5.176  -0.711
  246    HB   THR  32           HB       THR  32 -10.186   6.427  -0.270
  247    HG1  THR  32           HG1      THR  32 -10.235   8.063  -1.639
  248   1HG2  THR  32          1HG2      THR  32  -8.951   8.023   1.360
  249   2HG2  THR  32          2HG2      THR  32  -8.676   6.290   1.535
  250   3HG2  THR  32          3HG2      THR  32  -7.475   7.297   0.725
  251    H    LYS  33           H        LYS  33  -8.127   6.397  -3.799
  252    HA   LYS  33           HA       LYS  33  -9.812   4.241  -4.726
  253   1HB   LYS  33          2HB       LYS  33 -11.552   5.839  -4.211
  254   2HB   LYS  33          3HB       LYS  33 -10.670   7.134  -5.018
  255   1HG   LYS  33          2HG       LYS  33 -11.438   6.524  -7.053
  256   2HG   LYS  33          3HG       LYS  33 -11.094   4.820  -6.761
  257   1HD   LYS  33          2HD       LYS  33 -13.486   6.280  -5.603
  258   2HD   LYS  33          3HD       LYS  33 -13.541   5.328  -7.088
  259   1HE   LYS  33          2HE       LYS  33 -12.285   3.640  -5.250
  260   2HE   LYS  33          3HE       LYS  33 -13.559   4.421  -4.314
  261   1HZ   LYS  33          1HZ       LYS  33 -13.790   2.403  -6.266
  262   2HZ   LYS  33          1HZ       LYS  33 -14.638   3.778  -6.791
  263   3HZ   LYS  33          3HZ       LYS  33 -14.999   3.076  -5.286
  264    H    VAL  34           H        VAL  34  -7.179   4.513  -5.179
  265    HA   VAL  34           HA       VAL  34  -5.534   4.692  -6.767
  266    HB   VAL  34           HB       VAL  34  -7.895   4.440  -8.653
  267   1HG1  VAL  34          1HG1      VAL  34  -6.052   5.007 -10.012
  268   2HG1  VAL  34          2HG1      VAL  34  -4.909   4.159  -8.970
  269   3HG1  VAL  34          3HG1      VAL  34  -6.003   3.244 -10.006
  270   1HG2  VAL  34          1HG2      VAL  34  -8.031   2.545  -7.264
  271   2HG2  VAL  34          2HG2      VAL  34  -7.010   1.977  -8.586
  272   3HG2  VAL  34          3HG2      VAL  34  -6.281   2.458  -7.054
  273    H    ASP  35           H        ASP  35  -4.759   5.977  -8.732
  274    HA   ASP  35           HA       ASP  35  -6.055   8.482  -9.303
  275   1HB   ASP  35          2HB       ASP  35  -5.151   9.022  -7.098
  276   2HB   ASP  35          3HB       ASP  35  -3.549   8.500  -7.602
  277    H    ASP  36           H        ASP  36  -2.626   8.706  -9.241
  278    HA   ASP  36           HA       ASP  36  -2.075   7.382 -11.718
  279   1HB   ASP  36          2HB       ASP  36  -3.482   9.408 -12.396
  280   2HB   ASP  36          3HB       ASP  36  -2.113  10.391 -11.888
  281    H    SER  37           H        SER  37  -1.119  10.264  -9.830
  282    HA   SER  37           HA       SER  37   1.569  10.364 -10.419
  283   1HB   SER  37          2HB       SER  37   1.859  11.335  -8.117
  284   2HB   SER  37          3HB       SER  37   0.567  12.074  -9.059
  285    HG   SER  37           HG       SER  37  -0.804  10.419  -7.963
  286    H    GLN  38           H        GLN  38  -0.119   7.959  -8.632
  287    HA   GLN  38           HA       GLN  38   2.277   6.860  -7.386
  288   1HB   GLN  38          2HB       GLN  38   0.800   5.261  -6.377
  289   2HB   GLN  38          3HB       GLN  38  -0.016   6.821  -6.300
  290   1HG   GLN  38          2HG       GLN  38  -0.903   5.969  -8.709
  291   2HG   GLN  38          3HG       GLN  38  -0.683   4.414  -7.911
  292   1HE2  GLN  38          2HE2      GLN  38  -1.383   5.104  -5.248
  293   2HE2  GLN  38          1HE2      GLN  38  -3.016   5.565  -5.216
  294    HA   PRO  39           HA       PRO  39   3.430   4.261 -10.753
  295   1HB   PRO  39          2HB       PRO  39   3.858   1.915  -9.149
  296   2HB   PRO  39          3HB       PRO  39   5.071   3.032  -9.789
  297   1HG   PRO  39          2HG       PRO  39   4.088   2.767  -7.099
  298   2HG   PRO  39          3HG       PRO  39   5.439   3.729  -7.703
  299   1HD   PRO  39          2HD       PRO  39   2.978   4.725  -6.763
  300   2HD   PRO  39          3HD       PRO  39   4.204   5.638  -7.663
  301    H    ALA  40           H        ALA  40   2.253   2.991 -12.165
  302    HA   ALA  40           HA       ALA  40  -0.393   2.334 -11.764
  303   1HB   ALA  40          1HB       ALA  40   1.554   0.783 -13.487
  304   2HB   ALA  40          2HB       ALA  40  -0.204   0.780 -13.639
  305   3HB   ALA  40          3HB       ALA  40   0.709   2.251 -13.977
  306    H    PHE  41           H        PHE  41   2.485   0.481 -11.009
  307    HA   PHE  41           HA       PHE  41   1.368  -1.989 -10.356
  308   1HB   PHE  41          2HB       PHE  41   3.640  -0.717  -8.825
  309   2HB   PHE  41          3HB       PHE  41   3.374  -2.426  -9.160
  310    HD1  PHE  41           HD1      PHE  41   2.994  -2.837 -11.873
  311    HD2  PHE  41           HD2      PHE  41   5.357   0.256 -10.051
  312    HE1  PHE  41           HE1      PHE  41   4.340  -2.642 -13.947
  313    HE2  PHE  41           HE2      PHE  41   6.704   0.448 -12.126
  314    HZ   PHE  41           HZ       PHE  41   6.194  -1.001 -14.074
  315    H    ILE  42           H        ILE  42   1.533   1.014  -8.519
  316    HA   ILE  42           HA       ILE  42   0.635  -0.112  -6.040
  317    HB   ILE  42           HB       ILE  42   1.104   2.640  -7.109
  318   1HG1  ILE  42          2HG1      ILE  42   2.802   1.144  -5.906
  319   2HG1  ILE  42          3HG1      ILE  42   2.614   2.777  -5.274
  320   1HG2  ILE  42          1HG2      ILE  42   0.204   3.542  -4.905
  321   2HG2  ILE  42          2HG2      ILE  42  -1.017   3.037  -6.073
  322   3HG2  ILE  42          3HG2      ILE  42  -0.618   1.996  -4.706
  323   1HD1  ILE  42          1HD1      ILE  42   0.783   0.781  -4.093
  324   2HD1  ILE  42          2HD1      ILE  42   2.490   0.526  -3.735
  325   3HD1  ILE  42          3HD1      ILE  42   1.721   2.054  -3.311
  326    H    ASN  43           H        ASN  43  -0.948   0.931  -8.947
  327    HA   ASN  43           HA       ASN  43  -3.493   1.565  -7.889
  328   1HB   ASN  43          2HB       ASN  43  -2.834   0.300 -10.567
  329   2HB   ASN  43          3HB       ASN  43  -4.333   1.110 -10.139
  330   1HD2  ASN  43          2HD2      ASN  43  -2.162   2.959  -8.543
  331   2HD2  ASN  43          1HD2      ASN  43  -1.776   4.084  -9.752
  332    H    ASP  44           H        ASP  44  -1.935  -1.430  -8.892
  333    HA   ASP  44           HA       ASP  44  -4.084  -3.206  -8.685
  334   1HB   ASP  44          2HB       ASP  44  -1.768  -3.715  -9.559
  335   2HB   ASP  44          3HB       ASP  44  -1.223  -3.791  -7.888
  336    H    ILE  45           H        ILE  45  -1.685  -2.291  -6.216
  337    HA   ILE  45           HA       ILE  45  -2.562  -3.776  -4.068
  338    HB   ILE  45           HB       ILE  45  -1.593  -0.907  -3.927
  339   1HG1  ILE  45          2HG1      ILE  45  -0.129  -3.542  -4.195
  340   2HG1  ILE  45          3HG1      ILE  45   0.018  -2.114  -5.219
  341   1HG2  ILE  45          1HG2      ILE  45  -2.579  -2.015  -1.844
  342   2HG2  ILE  45          2HG2      ILE  45  -1.228  -3.147  -1.923
  343   3HG2  ILE  45          3HG2      ILE  45  -0.926  -1.426  -1.690
  344   1HD1  ILE  45          1HD1      ILE  45   0.649  -1.049  -2.789
  345   2HD1  ILE  45          2HD1      ILE  45   1.264  -2.692  -2.595
  346   3HD1  ILE  45          3HD1      ILE  45   1.846  -1.683  -3.918
  347    H    LEU  46           H        LEU  46  -3.506  -0.395  -4.698
  348    HA   LEU  46           HA       LEU  46  -5.416  -0.072  -2.761
  349   1HB   LEU  46          2HB       LEU  46  -5.295   1.001  -5.575
  350   2HB   LEU  46          3HB       LEU  46  -6.548   1.494  -4.436
  351    HG   LEU  46           HG       LEU  46  -3.586   1.645  -3.803
  352   1HD1  LEU  46          1HD1      LEU  46  -5.350   3.966  -4.612
  353   2HD1  LEU  46          2HD1      LEU  46  -3.599   3.949  -4.410
  354   3HD1  LEU  46          3HD1      LEU  46  -4.335   3.101  -5.769
  355   1HD2  LEU  46          1HD2      LEU  46  -6.122   2.332  -2.413
  356   2HD2  LEU  46          2HD2      LEU  46  -4.564   1.854  -1.742
  357   3HD2  LEU  46          3HD2      LEU  46  -4.823   3.516  -2.272
  358    H    LYS  47           H        LYS  47  -5.746  -1.783  -5.819
  359    HA   LYS  47           HA       LYS  47  -8.597  -2.174  -5.534
  360   1HB   LYS  47          2HB       LYS  47  -6.617  -2.499  -7.581
  361   2HB   LYS  47          3HB       LYS  47  -7.498  -4.015  -7.397
  362   1HG   LYS  47          2HG       LYS  47  -8.797  -2.795  -8.943
  363   2HG   LYS  47          3HG       LYS  47  -9.630  -2.535  -7.410
  364   1HD   LYS  47          2HD       LYS  47  -8.171  -0.427  -7.171
  365   2HD   LYS  47          3HD       LYS  47  -7.787  -0.643  -8.878
  366   1HE   LYS  47          2HE       LYS  47 -10.574  -0.346  -7.715
  367   2HE   LYS  47          3HE       LYS  47  -9.692   0.893  -8.609
  368   1HZ   LYS  47          1HZ       LYS  47  -9.586  -0.683 -10.494
  369   2HZ   LYS  47          1HZ       LYS  47 -11.170  -0.213 -10.097
  370   3HZ   LYS  47          3HZ       LYS  47 -10.593  -1.743  -9.634
  371    H    VAL  48           H        VAL  48  -5.815  -3.721  -4.268
  372    HA   VAL  48           HA       VAL  48  -6.932  -6.378  -4.093
  373    HB   VAL  48           HB       VAL  48  -4.506  -5.053  -2.864
  374   1HG1  VAL  48          1HG1      VAL  48  -5.725  -7.751  -2.312
  375   2HG1  VAL  48          2HG1      VAL  48  -3.976  -7.537  -2.239
  376   3HG1  VAL  48          3HG1      VAL  48  -5.024  -6.599  -1.176
  377   1HG2  VAL  48          1HG2      VAL  48  -4.930  -7.242  -4.923
  378   2HG2  VAL  48          2HG2      VAL  48  -4.327  -5.616  -5.230
  379   3HG2  VAL  48          3HG2      VAL  48  -3.354  -6.757  -4.300
  380    H    GLU  49           H        GLU  49  -8.675  -6.723  -2.868
  381    HA   GLU  49           HA       GLU  49  -9.666  -5.133  -0.821
  382   1HB   GLU  49          2HB       GLU  49  -9.973  -8.120  -1.229
  383   2HB   GLU  49          3HB       GLU  49 -10.965  -7.151  -0.138
  384   1HG   GLU  49          2HG       GLU  49 -10.674  -6.404  -3.050
  385   2HG   GLU  49          3HG       GLU  49 -11.870  -7.591  -2.534
  386    H    GLY  50           H        GLY  50  -9.312  -4.924   1.316
  387   1HA   GLY  50          1HA       GLY  50  -8.576  -5.739   3.465
  388   2HA   GLY  50          2HA       GLY  50  -7.403  -6.760   2.633
  389    H    VAL  51           H        VAL  51  -7.319  -4.064   0.917
  390    HA   VAL  51           HA       VAL  51  -4.877  -3.114   2.135
  391    HB   VAL  51           HB       VAL  51  -6.314  -2.594  -0.446
  392   1HG1  VAL  51          1HG1      VAL  51  -4.388  -0.960  -0.926
  393   2HG1  VAL  51          2HG1      VAL  51  -5.681  -0.358   0.112
  394   3HG1  VAL  51          3HG1      VAL  51  -4.155  -0.887   0.821
  395   1HG2  VAL  51          1HG2      VAL  51  -4.274  -3.450  -1.372
  396   2HG2  VAL  51          2HG2      VAL  51  -3.420  -3.258   0.154
  397   3HG2  VAL  51          3HG2      VAL  51  -4.664  -4.496  -0.015
  398    H    LYS  52           H        LYS  52  -8.178  -2.198   2.165
  399    HA   LYS  52           HA       LYS  52  -9.388  -0.490   3.027
  400   1HB   LYS  52          2HB       LYS  52  -7.890  -1.271   5.028
  401   2HB   LYS  52          3HB       LYS  52  -7.070   0.268   4.769
  402   1HG   LYS  52          2HG       LYS  52  -9.536   1.223   4.725
  403   2HG   LYS  52          3HG       LYS  52  -9.895  -0.242   5.635
  404   1HD   LYS  52          2HD       LYS  52  -7.702   1.709   6.397
  405   2HD   LYS  52          3HD       LYS  52  -9.331   1.762   7.068
  406   1HE   LYS  52          2HE       LYS  52  -8.935  -0.740   7.654
  407   2HE   LYS  52          3HE       LYS  52  -7.229  -0.368   7.410
  408   1HZ   LYS  52          1HZ       LYS  52  -7.514   1.488   9.005
  409   2HZ   LYS  52          1HZ       LYS  52  -7.748  -0.046   9.697
  410   3HZ   LYS  52          3HZ       LYS  52  -9.085   0.934   9.323
  411    H    SER  53           H        SER  53  -6.061   0.744   3.072
  412    HA   SER  53           HA       SER  53  -6.488   2.573   0.929
  413   1HB   SER  53          2HB       SER  53  -7.791   4.028   2.115
  414   2HB   SER  53          3HB       SER  53  -7.159   3.499   3.670
  415    HG   SER  53           HG       SER  53  -5.306   4.700   3.278
  416    H    ILE  54           H        ILE  54  -4.760   4.328   0.901
  417    HA   ILE  54           HA       ILE  54  -2.279   3.533   2.265
  418    HB   ILE  54           HB       ILE  54  -2.622   3.838  -0.731
  419   1HG1  ILE  54          2HG1      ILE  54  -1.492   1.551   0.912
  420   2HG1  ILE  54          3HG1      ILE  54  -3.155   1.609   0.335
  421   1HG2  ILE  54          1HG2      ILE  54  -0.578   4.959  -0.216
  422   2HG2  ILE  54          2HG2      ILE  54  -0.149   3.765   1.011
  423   3HG2  ILE  54          3HG2      ILE  54  -0.103   3.331  -0.697
  424   1HD1  ILE  54          1HD1      ILE  54  -2.190   0.445  -1.410
  425   2HD1  ILE  54          2HD1      ILE  54  -1.949   2.091  -1.994
  426   3HD1  ILE  54          3HD1      ILE  54  -0.624   1.231  -1.209
  427    H    PHE  55           H        PHE  55  -0.774   5.229   2.485
  428    HA   PHE  55           HA       PHE  55  -1.585   7.886   1.512
  429   1HB   PHE  55          2HB       PHE  55  -2.552   7.861   3.699
  430   2HB   PHE  55          3HB       PHE  55  -1.112   7.128   4.401
  431    HD1  PHE  55           HD1      PHE  55   0.153   8.588   5.691
  432    HD2  PHE  55           HD2      PHE  55  -1.836  10.087   2.189
  433    HE1  PHE  55           HE1      PHE  55   1.082  10.843   6.128
  434    HE2  PHE  55           HE2      PHE  55  -0.904  12.343   2.628
  435    HZ   PHE  55           HZ       PHE  55   0.555  12.719   4.599
  436    H    HIS  56           H        HIS  56   0.107   8.682   0.457
  437    HA   HIS  56           HA       HIS  56   2.810   7.778   1.152
  438   1HB   HIS  56          2HB       HIS  56   2.388   7.611  -1.175
  439   2HB   HIS  56          3HB       HIS  56   1.644   9.210  -1.234
  440    HD1  HIS  56           HD1      HIS  56   3.155  10.923  -2.200
  441    HD2  HIS  56           HD2      HIS  56   5.309   7.984  -0.173
  442    HE1  HIS  56           HE1      HIS  56   5.600  11.545  -2.425
  443    H    VAL  57           H        VAL  57   4.399   9.096   1.878
  444    HA   VAL  57           HA       VAL  57   4.249  11.946   1.828
  445    HB   VAL  57           HB       VAL  57   2.637  11.454   3.655
  446   1HG1  VAL  57          1HG1      VAL  57   5.065  10.137   4.883
  447   2HG1  VAL  57          2HG1      VAL  57   3.655  10.629   5.820
  448   3HG1  VAL  57          3HG1      VAL  57   3.494   9.409   4.556
  449   1HG2  VAL  57          1HG2      VAL  57   4.087  12.775   5.450
  450   2HG2  VAL  57          2HG2      VAL  57   5.207  12.932   4.099
  451   3HG2  VAL  57          3HG2      VAL  57   3.564  13.557   3.959
  452    H    MET  58           H        MET  58   6.209  12.878   2.282
  453    HA   MET  58           HA       MET  58   8.512  12.860   2.116
  454   1HB   MET  58          2HB       MET  58   9.559  12.263   4.284
  455   2HB   MET  58          3HB       MET  58   8.131  13.278   4.467
  456   1HG   MET  58          2HG       MET  58   6.794  11.454   5.195
  457   2HG   MET  58          3HG       MET  58   7.975  10.265   4.651
  458   1HE   MET  58          1HE       MET  58   8.125  12.999   8.312
  459   2HE   MET  58          2HE       MET  58   6.958  12.975   6.991
  460   3HE   MET  58          3HE       MET  58   8.549  13.687   6.739
  461    H    ASP  59           H        ASP  59   9.792  10.533   3.905
  462    HA   ASP  59           HA       ASP  59  10.307   8.836   1.565
  463   1HB   ASP  59          2HB       ASP  59  12.227   8.011   3.008
  464   2HB   ASP  59          3HB       ASP  59  12.306   9.696   2.497
  465    H    PHE  60           H        PHE  60   7.818   8.309   2.755
  466    HA   PHE  60           HA       PHE  60   8.116   5.521   3.254
  467   1HB   PHE  60          2HB       PHE  60   7.631   5.293   5.511
  468   2HB   PHE  60          3HB       PHE  60   8.711   6.680   5.505
  469    HD1  PHE  60           HD1      PHE  60   5.087   5.734   5.503
  470    HD2  PHE  60           HD2      PHE  60   8.014   8.748   6.393
  471    HE1  PHE  60           HE1      PHE  60   3.349   7.082   6.639
  472    HE2  PHE  60           HE2      PHE  60   6.270  10.099   7.529
  473    HZ   PHE  60           HZ       PHE  60   3.940   9.265   7.654
  474    H    ILE  61           H        ILE  61   6.070   4.408   3.601
  475    HA   ILE  61           HA       ILE  61   3.721   5.979   2.720
  476    HB   ILE  61           HB       ILE  61   4.404   3.180   1.777
  477   1HG1  ILE  61          2HG1      ILE  61   4.754   5.876   0.424
  478   2HG1  ILE  61          3HG1      ILE  61   6.034   4.742   0.857
  479   1HG2  ILE  61          1HG2      ILE  61   2.465   5.074   0.482
  480   2HG2  ILE  61          2HG2      ILE  61   2.484   3.312   0.458
  481   3HG2  ILE  61          3HG2      ILE  61   1.962   4.169   1.908
  482   1HD1  ILE  61          1HD1      ILE  61   3.869   4.362  -1.229
  483   2HD1  ILE  61          2HD1      ILE  61   5.612   4.447  -1.492
  484   3HD1  ILE  61          3HD1      ILE  61   4.909   3.054  -0.669
  485    H    SER  62           H        SER  62   1.856   5.568   3.788
  486    HA   SER  62           HA       SER  62   1.963   3.551   5.936
  487   1HB   SER  62          2HB       SER  62   0.568   6.171   5.603
  488   2HB   SER  62          3HB       SER  62  -0.194   4.944   6.610
  489    HG   SER  62           HG       SER  62   1.141   5.780   8.035
  490    H    VAL  63           H        VAL  63   1.140   1.660   5.281
  491    HA   VAL  63           HA       VAL  63  -1.259   1.644   3.565
  492    HB   VAL  63           HB       VAL  63   0.584  -0.650   4.292
  493   1HG1  VAL  63          1HG1      VAL  63  -1.483  -0.406   2.086
  494   2HG1  VAL  63          2HG1      VAL  63  -0.561  -1.844   2.524
  495   3HG1  VAL  63          3HG1      VAL  63  -1.785  -1.212   3.625
  496   1HG2  VAL  63          1HG2      VAL  63   0.485   1.208   1.899
  497   2HG2  VAL  63          2HG2      VAL  63   1.850   0.921   2.979
  498   3HG2  VAL  63          3HG2      VAL  63   1.320  -0.344   1.869
  499    H    ASP  64           H        ASP  64  -3.162   1.366   4.514
  500    HA   ASP  64           HA       ASP  64  -3.302   0.228   7.229
  501   1HB   ASP  64          2HB       ASP  64  -5.449   1.632   5.649
  502   2HB   ASP  64          3HB       ASP  64  -5.494   1.238   7.358
  503    H    LYS  65           H        LYS  65  -3.912  -1.854   7.445
  504    HA   LYS  65           HA       LYS  65  -5.431  -3.102   5.247
  505   1HB   LYS  65          2HB       LYS  65  -4.744  -5.244   6.268
  506   2HB   LYS  65          3HB       LYS  65  -3.356  -4.240   5.850
  507   1HG   LYS  65          2HG       LYS  65  -2.782  -3.890   8.037
  508   2HG   LYS  65          3HG       LYS  65  -4.457  -3.836   8.578
  509   1HD   LYS  65          2HD       LYS  65  -4.562  -6.336   8.213
  510   2HD   LYS  65          3HD       LYS  65  -2.822  -6.301   7.935
  511   1HE   LYS  65          2HE       LYS  65  -3.200  -6.854  10.265
  512   2HE   LYS  65          3HE       LYS  65  -2.550  -5.217  10.190
  513   1HZ   LYS  65          1HZ       LYS  65  -5.270  -4.924   9.967
  514   2HZ   LYS  65          1HZ       LYS  65  -4.322  -4.593  11.339
  515   3HZ   LYS  65          3HZ       LYS  65  -5.069  -6.108  11.166
  516    H    GLU  66           H        GLU  66  -7.058  -4.749   5.897
  517    HA   GLU  66           HA       GLU  66  -8.880  -3.602   7.850
  518   1HB   GLU  66          2HB       GLU  66  -9.126  -6.026   6.045
  519   2HB   GLU  66          3HB       GLU  66 -10.411  -5.412   7.084
  520   1HG   GLU  66          2HG       GLU  66 -10.407  -3.279   5.894
  521   2HG   GLU  66          3HG       GLU  66  -9.042  -3.801   4.911
  522    H    ASN  67           H        ASN  67  -9.170  -4.296   9.891
  523    HA   ASN  67           HA       ASN  67  -7.407  -5.972  11.224
  524   1HB   ASN  67          2HB       ASN  67 -10.307  -5.539  11.980
  525   2HB   ASN  67          3HB       ASN  67  -8.987  -5.988  13.059
  526   1HD2  ASN  67          2HD2      ASN  67 -10.799  -3.463  12.814
  527   2HD2  ASN  67          1HD2      ASN  67  -9.684  -2.184  12.856
  528    H    ASP  68           H        ASP  68 -10.358  -6.759   9.503
  529    HA   ASP  68           HA       ASP  68 -10.646  -9.426  10.443
  530   1HB   ASP  68          2HB       ASP  68 -12.316  -7.871   9.158
  531   2HB   ASP  68          3HB       ASP  68 -11.561  -8.550   7.721
  532    H    ALA  69           H        ALA  69  -8.868  -7.973   7.762
  533    HA   ALA  69           HA       ALA  69  -8.069 -10.582   6.723
  534   1HB   ALA  69          1HB       ALA  69  -8.581  -8.675   5.191
  535   2HB   ALA  69          2HB       ALA  69  -7.181  -7.823   5.843
  536   3HB   ALA  69          3HB       ALA  69  -6.962  -9.335   4.963
  537    H    ASN  70           H        ASN  70  -5.759 -11.042   6.355
  538    HA   ASN  70           HA       ASN  70  -4.124 -10.137   8.650
  539   1HB   ASN  70          2HB       ASN  70  -4.737 -12.563   8.568
  540   2HB   ASN  70          3HB       ASN  70  -3.860 -12.688   7.046
  541   1HD2  ASN  70          2HD2      ASN  70  -3.488 -12.392  10.532
  542   2HD2  ASN  70          1HD2      ASN  70  -1.801 -12.565  10.549
  543    H    TRP  71           H        TRP  71  -1.822  -9.955   8.302
  544    HA   TRP  71           HA       TRP  71  -1.187  -8.512   5.913
  545   1HB   TRP  71          2HB       TRP  71   0.263  -9.308   8.400
  546   2HB   TRP  71          3HB       TRP  71   1.223  -8.836   6.997
  547    HD1  TRP  71           HD1      TRP  71  -0.436  -7.379   9.890
  548    HE1  TRP  71           HE1      TRP  71  -0.778  -4.841   9.599
  549    HE3  TRP  71           HE3      TRP  71   0.484  -6.930   4.886
  550    HZ2  TRP  71           HZ2      TRP  71  -0.681  -2.881   7.518
  551    HZ3  TRP  71           HZ3      TRP  71   0.350  -4.715   3.775
  552    HH2  TRP  71           HH2      TRP  71  -0.231  -2.694   5.085
  553    H    GLU  72           H        GLU  72  -0.139 -11.650   7.240
  554    HA   GLU  72           HA       GLU  72   1.605 -12.464   5.250
  555   1HB   GLU  72          2HB       GLU  72  -0.392 -14.177   6.754
  556   2HB   GLU  72          3HB       GLU  72   1.029 -14.774   5.898
  557   1HG   GLU  72          2HG       GLU  72   1.279 -12.671   8.047
  558   2HG   GLU  72          3HG       GLU  72   1.234 -14.384   8.453
  559    H    THR  73           H        THR  73  -1.801 -11.999   5.072
  560    HA   THR  73           HA       THR  73  -2.155 -13.660   2.701
  561    HB   THR  73           HB       THR  73  -3.963 -11.992   4.435
  562    HG1  THR  73           HG1      THR  73  -3.367 -14.261   4.812
  563   1HG2  THR  73          1HG2      THR  73  -4.865 -11.420   2.343
  564   2HG2  THR  73          2HG2      THR  73  -4.456 -12.981   1.632
  565   3HG2  THR  73          3HG2      THR  73  -5.784 -12.857   2.786
  566    H    VAL  74           H        VAL  74  -2.211 -10.247   3.625
  567    HA   VAL  74           HA       VAL  74  -2.613  -9.331   0.922
  568    HB   VAL  74           HB       VAL  74  -2.685  -8.237   3.608
  569   1HG1  VAL  74          1HG1      VAL  74  -1.419  -6.528   1.448
  570   2HG1  VAL  74          2HG1      VAL  74  -1.976  -5.951   3.018
  571   3HG1  VAL  74          3HG1      VAL  74  -0.625  -7.079   2.924
  572   1HG2  VAL  74          1HG2      VAL  74  -4.314  -6.756   2.555
  573   2HG2  VAL  74          2HG2      VAL  74  -3.746  -7.229   0.954
  574   3HG2  VAL  74          3HG2      VAL  74  -4.562  -8.405   1.984
  575    H    LEU  75           H        LEU  75   0.123  -9.506   3.171
  576    HA   LEU  75           HA       LEU  75   1.991  -7.946   1.896
  577   1HB   LEU  75          2HB       LEU  75   2.039  -9.941   3.906
  578   2HB   LEU  75          3HB       LEU  75   3.304 -10.351   2.750
  579    HG   LEU  75           HG       LEU  75   2.936  -7.580   3.921
  580   1HD1  LEU  75          1HD1      LEU  75   4.682  -9.899   4.784
  581   2HD1  LEU  75          2HD1      LEU  75   5.036  -8.229   5.226
  582   3HD1  LEU  75          3HD1      LEU  75   3.536  -8.983   5.763
  583   1HD2  LEU  75          1HD2      LEU  75   4.214  -8.180   1.652
  584   2HD2  LEU  75          2HD2      LEU  75   4.869  -6.995   2.781
  585   3HD2  LEU  75          3HD2      LEU  75   5.492  -8.645   2.773
  586    HA   PRO  76           HA       PRO  76   3.428 -11.920  -0.713
  587   1HB   PRO  76          2HB       PRO  76   0.910 -13.142  -1.411
  588   2HB   PRO  76          3HB       PRO  76   2.293 -13.869  -0.575
  589   1HG   PRO  76          2HG       PRO  76  -0.199 -12.815   0.519
  590   2HG   PRO  76          3HG       PRO  76   0.971 -13.927   1.239
  591   1HD   PRO  76          2HD       PRO  76   0.651 -11.354   2.097
  592   2HD   PRO  76          3HD       PRO  76   2.200 -12.219   2.206
  593    H    LYS  77           H        LYS  77   0.309 -10.259  -1.091
  594    HA   LYS  77           HA       LYS  77   0.594 -10.052  -3.969
  595   1HB   LYS  77          2HB       LYS  77  -1.426  -9.176  -1.937
  596   2HB   LYS  77          3HB       LYS  77  -1.420  -8.402  -3.524
  597   1HG   LYS  77          2HG       LYS  77  -1.550 -10.636  -4.597
  598   2HG   LYS  77          3HG       LYS  77  -1.615 -11.384  -3.001
  599   1HD   LYS  77          2HD       LYS  77  -3.717 -10.308  -2.501
  600   2HD   LYS  77          3HD       LYS  77  -3.614  -9.316  -3.955
  601   1HE   LYS  77          2HE       LYS  77  -3.614 -12.329  -4.129
  602   2HE   LYS  77          3HE       LYS  77  -5.123 -11.424  -4.035
  603   1HZ   LYS  77          1HZ       LYS  77  -3.174 -10.450  -5.954
  604   2HZ   LYS  77          1HZ       LYS  77  -4.863 -10.593  -6.089
  605   3HZ   LYS  77          3HZ       LYS  77  -3.872 -11.954  -6.315
  606    H    VAL  78           H        VAL  78   0.967  -7.952  -1.145
  607    HA   VAL  78           HA       VAL  78   1.382  -5.512  -2.465
  608    HB   VAL  78           HB       VAL  78   2.413  -6.540   0.182
  609   1HG1  VAL  78          1HG1      VAL  78   2.637  -3.977   0.592
  610   2HG1  VAL  78          2HG1      VAL  78   3.914  -4.793  -0.309
  611   3HG1  VAL  78          3HG1      VAL  78   2.690  -3.859  -1.168
  612   1HG2  VAL  78          1HG2      VAL  78  -0.120  -6.128  -0.394
  613   2HG2  VAL  78          2HG2      VAL  78   0.534  -5.508   1.122
  614   3HG2  VAL  78          3HG2      VAL  78   0.318  -4.426  -0.255
  615    H    GLU  79           H        GLU  79   3.840  -7.827  -1.262
  616    HA   GLU  79           HA       GLU  79   6.113  -6.486  -2.099
  617   1HB   GLU  79          2HB       GLU  79   6.296  -8.450  -0.727
  618   2HB   GLU  79          3HB       GLU  79   5.583  -9.460  -1.986
  619   1HG   GLU  79          2HG       GLU  79   7.480  -9.181  -3.420
  620   2HG   GLU  79          3HG       GLU  79   8.128  -7.881  -2.422
  621    H    ALA  80           H        ALA  80   3.925  -8.486  -4.003
  622    HA   ALA  80           HA       ALA  80   5.392  -8.934  -6.301
  623   1HB   ALA  80          1HB       ALA  80   3.327  -9.227  -7.434
  624   2HB   ALA  80          2HB       ALA  80   3.009  -9.681  -5.761
  625   3HB   ALA  80          3HB       ALA  80   2.492  -8.106  -6.360
  626    H    VAL  81           H        VAL  81   3.874  -5.968  -5.210
  627    HA   VAL  81           HA       VAL  81   3.927  -4.488  -7.597
  628    HB   VAL  81           HB       VAL  81   4.304  -3.406  -4.796
  629   1HG1  VAL  81          1HG1      VAL  81   3.771  -1.352  -5.651
  630   2HG1  VAL  81          2HG1      VAL  81   4.399  -2.045  -7.146
  631   3HG1  VAL  81          3HG1      VAL  81   2.662  -2.024  -6.846
  632   1HG2  VAL  81          1HG2      VAL  81   1.593  -3.427  -5.921
  633   2HG2  VAL  81          2HG2      VAL  81   2.232  -5.046  -5.653
  634   3HG2  VAL  81          3HG2      VAL  81   2.145  -3.905  -4.316
  635    H    PHE  82           H        PHE  82   6.291  -4.352  -4.897
  636    HA   PHE  82           HA       PHE  82   8.183  -2.904  -6.548
  637   1HB   PHE  82          2HB       PHE  82   8.888  -4.115  -3.895
  638   2HB   PHE  82          3HB       PHE  82   9.444  -2.605  -4.614
  639    HD1  PHE  82           HD1      PHE  82   8.208  -0.558  -4.341
  640    HD2  PHE  82           HD2      PHE  82   6.551  -4.296  -3.019
  641    HE1  PHE  82           HE1      PHE  82   6.401   0.660  -3.160
  642    HE2  PHE  82           HE2      PHE  82   4.747  -3.076  -1.838
  643    HZ   PHE  82           HZ       PHE  82   4.671  -0.602  -1.912
  644    H    GLU  83           H        GLU  83   7.312  -5.983  -6.745
  645    HA   GLU  83           HA       GLU  83   9.847  -6.820  -7.849
  646   1HB   GLU  83          2HB       GLU  83   9.777  -7.294  -5.247
  647   2HB   GLU  83          3HB       GLU  83   8.783  -8.662  -5.740
  648   1HG   GLU  83          2HG       GLU  83  11.533  -8.039  -6.858
  649   2HG   GLU  83          3HG       GLU  83  11.206  -9.237  -5.605
  650    H    LEU  84           H        LEU  84   8.448  -6.847  -9.703
  651    HA   LEU  84           HA       LEU  84   6.197  -8.642  -9.840
  652   1HB   LEU  84          2HB       LEU  84   7.655  -6.849 -11.737
  653   2HB   LEU  84          3HB       LEU  84   6.660  -8.134 -12.416
  654    HG   LEU  84           HG       LEU  84   5.606  -6.260 -10.296
  655   1HD1  LEU  84          1HD1      LEU  84   5.190  -5.927 -13.273
  656   2HD1  LEU  84          2HD1      LEU  84   4.751  -4.811 -11.980
  657   3HD1  LEU  84          3HD1      LEU  84   6.447  -5.056 -12.394
  658   1HD2  LEU  84          1HD2      LEU  84   4.422  -8.207 -12.280
  659   2HD2  LEU  84          2HD2      LEU  84   4.203  -8.155 -10.531
  660   3HD2  LEU  84          3HD2      LEU  84   3.444  -6.935 -11.550
  661    H    GLU  85           H        GLU  85   8.138 -10.182  -8.855
  662    HA   GLU  85           HA       GLU  85   9.375 -12.094  -9.133
  663   1HB   GLU  85          2HB       GLU  85   7.053 -12.297 -10.787
  664   2HB   GLU  85          3HB       GLU  85   8.402 -13.051 -11.636
  665   1HG   GLU  85          2HG       GLU  85   7.322 -14.713 -10.210
  666   2HG   GLU  85          3HG       GLU  85   8.926 -14.355  -9.571
  667    H    HIS  86           H        HIS  86  10.603 -13.408 -11.053
  668    HA   HIS  86           HA       HIS  86  12.640 -11.596 -11.921
  669   1HB   HIS  86          2HB       HIS  86  13.051 -13.979 -11.267
  670   2HB   HIS  86          3HB       HIS  86  12.238 -14.480 -12.749
  671    HD1  HIS  86           HD1      HIS  86  13.390 -13.762 -15.032
  672    HD2  HIS  86           HD2      HIS  86  15.688 -13.078 -11.622
  673    HE1  HIS  86           HE1      HIS  86  15.753 -13.330 -15.835
  674    H    HIS  87           H        HIS  87   9.901 -13.180 -13.465
  675    HA   HIS  87           HA       HIS  87  10.682 -12.267 -16.119
  676   1HB   HIS  87          2HB       HIS  87   9.436 -14.476 -15.491
  677   2HB   HIS  87          3HB       HIS  87   8.001 -13.450 -15.442
  678    HD1  HIS  87           HD1      HIS  87   7.240 -12.340 -17.669
  679    HD2  HIS  87           HD2      HIS  87  10.505 -14.898 -18.093
  680    HE1  HIS  87           HE1      HIS  87   7.519 -12.739 -20.152
  681    H    HIS  88           H        HIS  88  10.511 -10.092 -16.361
  682    HA   HIS  88           HA       HIS  88   8.625  -8.421 -15.085
  683   1HB   HIS  88          2HB       HIS  88  10.728  -7.600 -16.112
  684   2HB   HIS  88          3HB       HIS  88  10.067  -7.952 -17.710
  685    HD1  HIS  88           HD1      HIS  88   7.967  -6.523 -18.465
  686    HD2  HIS  88           HD2      HIS  88   9.783  -5.217 -14.950
  687    HE1  HIS  88           HE1      HIS  88   7.068  -4.201 -18.018
  688    H    HIS  89           H        HIS  89   6.874  -7.202 -16.114
  689    HA   HIS  89           HA       HIS  89   5.061  -8.948 -17.492
  690   1HB   HIS  89          2HB       HIS  89   4.298  -7.289 -15.823
  691   2HB   HIS  89          3HB       HIS  89   4.809  -5.988 -16.898
  692    HD1  HIS  89           HD1      HIS  89   2.845  -5.066 -18.132
  693    HD2  HIS  89           HD2      HIS  89   2.486  -9.178 -17.553
  694    HE1  HIS  89           HE1      HIS  89   0.676  -5.761 -19.244
  695    H    HIS  90           H        HIS  90   5.611  -5.592 -18.448
  696    HA   HIS  90           HA       HIS  90   5.584  -4.635 -20.538
  697   1HB   HIS  90          2HB       HIS  90   7.571  -5.091 -21.812
  698   2HB   HIS  90          3HB       HIS  90   7.990  -5.210 -20.107
  699    HD1  HIS  90           HD1      HIS  90   8.549  -7.563 -19.168
  700    HD2  HIS  90           HD2      HIS  90   7.623  -7.564 -23.232
  701    HE1  HIS  90           HE1      HIS  90   9.210  -9.840 -20.052
  702    H    HIS  91           H        HIS  91   6.385  -5.887 -23.030
  703    HA   HIS  91           HA       HIS  91   4.745  -8.123 -23.638
  704   1HB   HIS  91          2HB       HIS  91   3.030  -6.948 -25.006
  705   2HB   HIS  91          3HB       HIS  91   2.885  -6.597 -23.286
  706    HD1  HIS  91           HD1      HIS  91   5.123  -4.454 -23.038
  707    HD2  HIS  91           HD2      HIS  91   2.260  -4.485 -26.068
  708    HE1  HIS  91           HE1      HIS  91   4.978  -2.083 -23.910
  Start of MODEL   10
    1   1H    MET   1          1HT       MET   1  14.869   0.621  -4.596
    2   2H    MET   1          2HT       MET   1  15.464   0.470  -3.011
    3   3H    MET   1          3HT       MET   1  15.504   1.975  -3.798
    4    HA   MET   1           HA       MET   1  13.718   1.889  -2.172
    5   1HB   MET   1          2HB       MET   1  13.059   2.049  -5.112
    6   2HB   MET   1          3HB       MET   1  11.818   2.325  -3.889
    7   1HG   MET   1          2HG       MET   1  12.822   4.263  -3.100
    8   2HG   MET   1          3HG       MET   1  14.434   3.761  -3.609
    9   1HE   MET   1          1HE       MET   1  15.288   5.623  -4.670
   10   2HE   MET   1          2HE       MET   1  15.008   5.971  -6.374
   11   3HE   MET   1          3HE       MET   1  15.524   4.359  -5.884
   12    H    LYS   2           H        LYS   2  13.147   0.139  -0.996
   13    HA   LYS   2           HA       LYS   2  11.168  -1.674  -2.129
   14   1HB   LYS   2          2HB       LYS   2  13.825  -2.623  -1.050
   15   2HB   LYS   2          3HB       LYS   2  12.420  -3.675  -1.219
   16   1HG   LYS   2          2HG       LYS   2  12.336  -2.876  -3.667
   17   2HG   LYS   2          3HG       LYS   2  13.961  -2.250  -3.389
   18   1HD   LYS   2          2HD       LYS   2  13.156  -5.132  -2.890
   19   2HD   LYS   2          3HD       LYS   2  13.925  -4.565  -4.373
   20   1HE   LYS   2          2HE       LYS   2  15.813  -5.195  -3.183
   21   2HE   LYS   2          3HE       LYS   2  15.672  -3.522  -2.647
   22   1HZ   LYS   2          1HZ       LYS   2  14.200  -4.501  -0.816
   23   2HZ   LYS   2          1HZ       LYS   2  15.882  -4.708  -0.691
   24   3HZ   LYS   2          3HZ       LYS   2  14.901  -5.988  -1.229
   25    H    ILE   3           H        ILE   3  10.595  -3.344  -0.251
   26    HA   ILE   3           HA       ILE   3   9.730  -1.694   1.950
   27    HB   ILE   3           HB       ILE   3   9.392  -4.666   1.482
   28   1HG1  ILE   3          2HG1      ILE   3   7.352  -2.474   1.048
   29   2HG1  ILE   3          3HG1      ILE   3   8.433  -3.010  -0.240
   30   1HG2  ILE   3          1HG2      ILE   3   7.474  -4.356   3.082
   31   2HG2  ILE   3          2HG2      ILE   3   9.059  -4.132   3.823
   32   3HG2  ILE   3          3HG2      ILE   3   8.073  -2.730   3.409
   33   1HD1  ILE   3          1HD1      ILE   3   7.592  -5.263  -0.114
   34   2HD1  ILE   3          2HD1      ILE   3   6.667  -4.890   1.342
   35   3HD1  ILE   3          3HD1      ILE   3   6.203  -4.181  -0.203
   36    H    ILE   4           H        ILE   4  11.156  -1.179   3.480
   37    HA   ILE   4           HA       ILE   4  12.925  -3.307   4.536
   38    HB   ILE   4           HB       ILE   4  13.400  -0.401   5.109
   39   1HG1  ILE   4          2HG1      ILE   4  13.060  -0.543   2.652
   40   2HG1  ILE   4          3HG1      ILE   4  14.733  -0.180   3.060
   41   1HG2  ILE   4          1HG2      ILE   4  14.771  -2.031   6.264
   42   2HG2  ILE   4          2HG2      ILE   4  15.134  -2.863   4.753
   43   3HG2  ILE   4          3HG2      ILE   4  15.770  -1.244   5.043
   44   1HD1  ILE   4          1HD1      ILE   4  13.663  -2.938   2.389
   45   2HD1  ILE   4          2HD1      ILE   4  14.580  -1.907   1.292
   46   3HD1  ILE   4          3HD1      ILE   4  15.341  -2.539   2.751
   47    H    SER   5           H        SER   5  11.818  -0.209   5.889
   48    HA   SER   5           HA       SER   5  11.330  -1.389   8.463
   49   1HB   SER   5          2HB       SER   5  10.426   1.337   7.542
   50   2HB   SER   5          3HB       SER   5  10.763   0.806   9.185
   51    HG   SER   5           HG       SER   5  12.906   0.765   8.736
   52    H    ILE   6           H        ILE   6   9.534  -2.406   9.076
   53    HA   ILE   6           HA       ILE   6   7.111  -2.130   7.474
   54    HB   ILE   6           HB       ILE   6   7.597  -4.138   9.650
   55   1HG1  ILE   6          2HG1      ILE   6   8.294  -4.254   6.696
   56   2HG1  ILE   6          3HG1      ILE   6   9.388  -4.463   8.063
   57   1HG2  ILE   6          1HG2      ILE   6   5.255  -3.685   8.778
   58   2HG2  ILE   6          2HG2      ILE   6   5.806  -4.273   7.210
   59   3HG2  ILE   6          3HG2      ILE   6   5.801  -5.352   8.607
   60   1HD1  ILE   6          1HD1      ILE   6   7.193  -6.332   7.140
   61   2HD1  ILE   6          2HD1      ILE   6   8.920  -6.666   7.269
   62   3HD1  ILE   6          3HD1      ILE   6   7.950  -6.471   8.727
   63    H    SER   7           H        SER   7   7.770  -2.661  10.806
   64    HA   SER   7           HA       SER   7   6.929  -1.781  12.759
   65   1HB   SER   7          2HB       SER   7   7.544   0.398  11.436
   66   2HB   SER   7          3HB       SER   7   5.799   0.555  11.246
   67    HG   SER   7           HG       SER   7   5.929   1.394  13.170
   68    H    GLU   8           H        GLU   8   5.142  -2.408  13.802
   69    HA   GLU   8           HA       GLU   8   2.575  -2.393  12.357
   70   1HB   GLU   8          2HB       GLU   8   2.240  -4.505  13.976
   71   2HB   GLU   8          3HB       GLU   8   2.892  -4.665  12.351
   72   1HG   GLU   8          2HG       GLU   8   4.681  -4.195  14.742
   73   2HG   GLU   8          3HG       GLU   8   4.175  -5.815  14.274
   74    H    THR   9           H        THR   9   1.011  -3.320  14.448
   75    HA   THR   9           HA       THR   9   1.538  -1.557  16.718
   76    HB   THR   9           HB       THR   9  -1.160  -1.111  16.193
   77    HG1  THR   9           HG1      THR   9  -1.383  -1.116  14.117
   78   1HG2  THR   9          1HG2      THR   9  -0.208   1.174  15.512
   79   2HG2  THR   9          2HG2      THR   9   0.228   0.564  17.108
   80   3HG2  THR   9          3HG2      THR   9   1.377   0.449  15.774
   81    HA   PRO  10           HA       PRO  10  -0.355  -4.696  19.049
   82   1HB   PRO  10          2HB       PRO  10  -2.044  -3.037  20.688
   83   2HB   PRO  10          3HB       PRO  10  -0.477  -3.748  21.097
   84   1HG   PRO  10          2HG       PRO  10  -1.015  -1.047  20.679
   85   2HG   PRO  10          3HG       PRO  10   0.582  -1.801  20.766
   86   1HD   PRO  10          2HD       PRO  10  -0.887  -0.823  18.402
   87   2HD   PRO  10          3HD       PRO  10   0.849  -1.127  18.604
   88    H    ASN  11           H        ASN  11  -2.367  -2.597  17.274
   89    HA   ASN  11           HA       ASN  11  -4.724  -4.322  17.651
   90   1HB   ASN  11          2HB       ASN  11  -5.803  -2.337  16.336
   91   2HB   ASN  11          3HB       ASN  11  -5.455  -2.148  18.049
   92   1HD2  ASN  11          2HD2      ASN  11  -5.257  -0.440  15.259
   93   2HD2  ASN  11          1HD2      ASN  11  -3.874   0.494  15.573
   94    H    HIS  12           H        HIS  12  -2.157  -3.699  15.557
   95    HA   HIS  12           HA       HIS  12  -1.690  -4.205  13.362
   96   1HB   HIS  12          2HB       HIS  12  -3.603  -6.429  14.106
   97   2HB   HIS  12          3HB       HIS  12  -2.642  -6.416  12.624
   98    HD1  HIS  12           HD1      HIS  12  -2.303  -6.591  16.368
   99    HD2  HIS  12           HD2      HIS  12   0.111  -6.950  12.992
  100    HE1  HIS  12           HE1      HIS  12  -0.058  -7.431  17.182
  101    H    ASN  13           H        ASN  13  -2.493  -2.463  12.227
  102    HA   ASN  13           HA       ASN  13  -4.892  -3.009  10.655
  103   1HB   ASN  13          2HB       ASN  13  -4.577  -0.456  12.248
  104   2HB   ASN  13          3HB       ASN  13  -5.903  -0.846  11.156
  105   1HD2  ASN  13          2HD2      ASN  13  -6.861  -3.240  11.805
  106   2HD2  ASN  13          1HD2      ASN  13  -7.192  -3.399  13.463
  107    H    THR  14           H        THR  14  -2.134  -0.862  11.325
  108    HA   THR  14           HA       THR  14  -1.720  -0.617   8.450
  109    HB   THR  14           HB       THR  14  -3.220   1.308   9.295
  110    HG1  THR  14           HG1      THR  14  -0.774   2.048   8.090
  111   1HG2  THR  14          1HG2      THR  14  -2.272   3.030  10.550
  112   2HG2  THR  14          2HG2      THR  14  -1.558   1.614  11.318
  113   3HG2  THR  14          3HG2      THR  14  -0.623   2.554  10.152
  114    H    MET  15           H        MET  15   0.325  -0.809   7.954
  115    HA   MET  15           HA       MET  15   2.363  -0.348  10.054
  116   1HB   MET  15          2HB       MET  15   3.761  -1.928   8.662
  117   2HB   MET  15          3HB       MET  15   2.352  -2.662   9.427
  118   1HG   MET  15          2HG       MET  15   1.270  -2.988   7.430
  119   2HG   MET  15          3HG       MET  15   1.939  -1.525   6.708
  120   1HE   MET  15          1HE       MET  15   2.891  -4.853   8.290
  121   2HE   MET  15          2HE       MET  15   3.794  -5.691   7.032
  122   3HE   MET  15          3HE       MET  15   2.083  -5.345   6.797
  123    H    LYS  16           H        LYS  16   4.546   0.253   9.119
  124    HA   LYS  16           HA       LYS  16   4.159   2.354   7.095
  125   1HB   LYS  16          2HB       LYS  16   6.039   1.956   9.373
  126   2HB   LYS  16          3HB       LYS  16   6.634   2.844   7.967
  127   1HG   LYS  16          2HG       LYS  16   4.812   4.425   8.111
  128   2HG   LYS  16          3HG       LYS  16   4.029   3.476   9.376
  129   1HD   LYS  16          2HD       LYS  16   5.903   3.894  10.894
  130   2HD   LYS  16          3HD       LYS  16   6.758   4.775   9.628
  131   1HE   LYS  16          2HE       LYS  16   5.743   6.494  10.879
  132   2HE   LYS  16          3HE       LYS  16   4.626   6.264   9.534
  133   1HZ   LYS  16          1HZ       LYS  16   3.095   5.237  10.856
  134   2HZ   LYS  16          1HZ       LYS  16   3.774   6.313  11.981
  135   3HZ   LYS  16          3HZ       LYS  16   4.243   4.680  11.972
  136    H    ILE  17           H        ILE  17   6.042   2.711   5.589
  137    HA   ILE  17           HA       ILE  17   7.498   0.259   4.903
  138    HB   ILE  17           HB       ILE  17   5.581   1.678   3.040
  139   1HG1  ILE  17          2HG1      ILE  17   5.865  -1.223   3.893
  140   2HG1  ILE  17          3HG1      ILE  17   4.656  -0.101   4.510
  141   1HG2  ILE  17          1HG2      ILE  17   6.481   0.044   1.322
  142   2HG2  ILE  17          2HG2      ILE  17   7.622   1.307   1.786
  143   3HG2  ILE  17          3HG2      ILE  17   7.792  -0.318   2.447
  144   1HD1  ILE  17          1HD1      ILE  17   3.969   0.234   2.051
  145   2HD1  ILE  17          2HD1      ILE  17   4.923  -1.211   1.717
  146   3HD1  ILE  17          3HD1      ILE  17   3.535  -1.303   2.799
  147    H    THR  18           H        THR  18   9.509   1.021   5.099
  148    HA   THR  18           HA       THR  18  10.218   3.678   4.086
  149    HB   THR  18           HB       THR  18  11.697   1.554   5.642
  150    HG1  THR  18           HG1      THR  18  11.250   2.850   7.219
  151   1HG2  THR  18          1HG2      THR  18  12.782   3.879   4.094
  152   2HG2  THR  18          2HG2      THR  18  13.497   3.493   5.659
  153   3HG2  THR  18          3HG2      THR  18  13.492   2.288   4.374
  154    H    LEU  19           H        LEU  19  11.706   4.014   2.383
  155    HA   LEU  19           HA       LEU  19  11.902   1.740   0.520
  156   1HB   LEU  19          2HB       LEU  19  12.467   4.612  -0.176
  157   2HB   LEU  19          3HB       LEU  19  11.989   3.291  -1.241
  158    HG   LEU  19           HG       LEU  19  10.262   4.604   0.880
  159   1HD1  LEU  19          1HD1      LEU  19   8.868   5.023  -1.287
  160   2HD1  LEU  19          2HD1      LEU  19  10.264   6.052  -0.966
  161   3HD1  LEU  19          3HD1      LEU  19  10.393   4.730  -2.124
  162   1HD2  LEU  19          1HD2      LEU  19   9.734   2.239   0.773
  163   2HD2  LEU  19          2HD2      LEU  19   8.477   3.115  -0.094
  164   3HD2  LEU  19          3HD2      LEU  19   9.742   2.270  -0.989
  165    H    SER  20           H        SER  20  13.810   3.489   2.666
  166    HA   SER  20           HA       SER  20  16.038   3.041   3.210
  167   1HB   SER  20          2HB       SER  20  17.408   1.667   1.966
  168   2HB   SER  20          3HB       SER  20  15.835   1.095   1.427
  169    HG   SER  20           HG       SER  20  16.113   2.081  -0.461
  170    H    GLU  21           H        GLU  21  14.657   5.113   1.072
  171    HA   GLU  21           HA       GLU  21  17.042   6.831   1.097
  172   1HB   GLU  21          2HB       GLU  21  15.443   6.170  -1.389
  173   2HB   GLU  21          3HB       GLU  21  16.650   7.453  -1.283
  174   1HG   GLU  21          2HG       GLU  21  18.366   5.791  -0.669
  175   2HG   GLU  21          3HG       GLU  21  17.162   4.508  -0.781
  176    H    SER  22           H        SER  22  16.581   9.066   0.801
  177    HA   SER  22           HA       SER  22  13.798   9.933   0.783
  178   1HB   SER  22          2HB       SER  22  15.592  10.772   3.059
  179   2HB   SER  22          3HB       SER  22  13.863  11.055   2.879
  180    HG   SER  22           HG       SER  22  13.750   8.644   2.854
  181    H    ARG  23           H        ARG  23  13.847  12.469   1.113
  182    HA   ARG  23           HA       ARG  23  16.204  13.855   0.294
  183   1HB   ARG  23          2HB       ARG  23  15.372  12.629  -1.836
  184   2HB   ARG  23          3HB       ARG  23  14.059  13.809  -1.819
  185   1HG   ARG  23          2HG       ARG  23  15.987  15.569  -1.543
  186   2HG   ARG  23          3HG       ARG  23  17.013  14.281  -2.174
  187   1HD   ARG  23          2HD       ARG  23  14.571  15.469  -3.518
  188   2HD   ARG  23          3HD       ARG  23  16.246  15.658  -4.028
  189    HE   ARG  23           HE       ARG  23  15.481  12.897  -3.896
  190   1HH1  ARG  23          1HH2      ARG  23  15.501  15.787  -5.800
  191   2HH1  ARG  23          2HH2      ARG  23  15.179  14.970  -7.293
  192   1HH2  ARG  23          1HH1      ARG  23  14.957  11.830  -5.835
  193   2HH2  ARG  23          2HH1      ARG  23  14.875  12.731  -7.311
  194    H    GLU  24           H        GLU  24  14.213  14.087   2.336
  195    HA   GLU  24           HA       GLU  24  12.652  15.560   3.237
  196   1HB   GLU  24          2HB       GLU  24  14.928  17.172   2.134
  197   2HB   GLU  24          3HB       GLU  24  13.560  17.995   2.882
  198   1HG   GLU  24          2HG       GLU  24  15.207  17.599   4.599
  199   2HG   GLU  24          3HG       GLU  24  13.849  16.515   4.888
  200    H    GLY  25           H        GLY  25  11.890  14.634   0.651
  201   1HA   GLY  25          1HA       GLY  25   9.690  16.109   0.032
  202   2HA   GLY  25          2HA       GLY  25  10.966  16.870  -0.916
  203    H    MET  26           H        MET  26   9.936  13.539  -0.118
  204    HA   MET  26           HA       MET  26  10.624  12.673  -2.826
  205   1HB   MET  26          2HB       MET  26  10.968  11.418  -0.465
  206   2HB   MET  26          3HB       MET  26   9.375  10.793  -0.891
  207   1HG   MET  26          2HG       MET  26  10.489  10.388  -3.245
  208   2HG   MET  26          3HG       MET  26  11.988  10.437  -2.317
  209   1HE   MET  26          1HE       MET  26  13.023   8.523  -1.841
  210   2HE   MET  26          2HE       MET  26  12.281   7.795  -3.264
  211   3HE   MET  26          3HE       MET  26  12.350   6.891  -1.755
  212    H    THR  27           H        THR  27   8.264  14.429  -2.049
  213    HA   THR  27           HA       THR  27   6.204  14.778  -3.032
  214    HB   THR  27           HB       THR  27   5.894  11.968  -3.978
  215    HG1  THR  27           HG1      THR  27   7.308  13.375  -5.756
  216   1HG2  THR  27          1HG2      THR  27   5.455  14.714  -5.184
  217   2HG2  THR  27          2HG2      THR  27   5.068  13.194  -5.990
  218   3HG2  THR  27          3HG2      THR  27   4.213  13.656  -4.519
  219    H    SER  28           H        SER  28   3.957  14.194  -2.586
  220    HA   SER  28           HA       SER  28   3.469  12.143  -0.576
  221   1HB   SER  28          2HB       SER  28   2.727  13.596   1.146
  222   2HB   SER  28          3HB       SER  28   4.280  14.242   0.624
  223    HG   SER  28           HG       SER  28   2.512  15.339  -0.941
  224    H    ASP  29           H        ASP  29   1.438  11.351  -0.742
  225    HA   ASP  29           HA       ASP  29  -0.769  12.936  -1.694
  226   1HB   ASP  29          2HB       ASP  29   0.704  11.129  -3.543
  227   2HB   ASP  29          3HB       ASP  29  -1.057  11.095  -3.616
  228    H    THR  30           H        THR  30  -2.727  11.990  -1.271
  229    HA   THR  30           HA       THR  30  -2.627   9.432   0.196
  230    HB   THR  30           HB       THR  30  -3.786  10.583   1.740
  231    HG1  THR  30           HG1      THR  30  -5.998  11.249   0.410
  232   1HG2  THR  30          1HG2      THR  30  -4.679  12.859   1.337
  233   2HG2  THR  30          2HG2      THR  30  -3.007  12.710   0.798
  234   3HG2  THR  30          3HG2      THR  30  -4.322  12.687  -0.380
  235    H    TYR  31           H        TYR  31  -3.292   7.716  -0.892
  236    HA   TYR  31           HA       TYR  31  -5.220   8.094  -3.098
  237   1HB   TYR  31          2HB       TYR  31  -3.296   5.815  -2.619
  238   2HB   TYR  31          3HB       TYR  31  -4.342   6.023  -4.018
  239    HD1  TYR  31           HD1      TYR  31  -3.888   7.783  -5.689
  240    HD2  TYR  31           HD2      TYR  31  -1.324   7.198  -2.293
  241    HE1  TYR  31           HE1      TYR  31  -2.140   9.171  -6.768
  242    HE2  TYR  31           HE2      TYR  31   0.425   8.585  -3.368
  243    HH   TYR  31           HH       TYR  31   1.041   9.641  -5.232
  244    H    THR  32           H        THR  32  -7.219   7.654  -2.481
  245    HA   THR  32           HA       THR  32  -7.676   5.337  -0.694
  246    HB   THR  32           HB       THR  32  -9.706   6.502   0.070
  247    HG1  THR  32           HG1      THR  32 -10.274   8.405  -0.758
  248   1HG2  THR  32          1HG2      THR  32  -7.282   6.934   0.999
  249   2HG2  THR  32          2HG2      THR  32  -7.507   8.534   0.294
  250   3HG2  THR  32          3HG2      THR  32  -8.617   7.955   1.533
  251    H    LYS  33           H        LYS  33  -8.149   6.666  -3.768
  252    HA   LYS  33           HA       LYS  33  -9.814   4.430  -4.585
  253   1HB   LYS  33          2HB       LYS  33 -11.431   6.075  -5.737
  254   2HB   LYS  33          3HB       LYS  33 -11.616   5.853  -3.996
  255   1HG   LYS  33          2HG       LYS  33 -10.567   7.914  -3.497
  256   2HG   LYS  33          3HG       LYS  33  -9.852   8.041  -5.103
  257   1HD   LYS  33          2HD       LYS  33 -12.120   8.316  -6.071
  258   2HD   LYS  33          3HD       LYS  33 -12.807   8.244  -4.448
  259   1HE   LYS  33          2HE       LYS  33 -11.125  10.188  -3.928
  260   2HE   LYS  33          3HE       LYS  33 -11.104  10.401  -5.679
  261   1HZ   LYS  33          1HZ       LYS  33 -12.903  11.661  -5.275
  262   2HZ   LYS  33          1HZ       LYS  33 -13.221  10.932  -3.772
  263   3HZ   LYS  33          3HZ       LYS  33 -13.722  10.178  -5.208
  264    H    VAL  34           H        VAL  34  -7.400   4.499  -5.400
  265    HA   VAL  34           HA       VAL  34  -5.829   5.046  -7.053
  266    HB   VAL  34           HB       VAL  34  -8.195   4.203  -8.737
  267   1HG1  VAL  34          1HG1      VAL  34  -5.185   4.007  -9.037
  268   2HG1  VAL  34          2HG1      VAL  34  -6.315   3.110 -10.050
  269   3HG1  VAL  34          3HG1      VAL  34  -6.310   4.873 -10.083
  270   1HG2  VAL  34          1HG2      VAL  34  -8.149   2.527  -7.105
  271   2HG2  VAL  34          2HG2      VAL  34  -7.014   1.888  -8.294
  272   3HG2  VAL  34          3HG2      VAL  34  -6.413   2.692  -6.839
  273    H    ASP  35           H        ASP  35  -5.543   7.294  -6.974
  274    HA   ASP  35           HA       ASP  35  -7.355   9.041  -8.407
  275   1HB   ASP  35          2HB       ASP  35  -4.707   9.506  -7.017
  276   2HB   ASP  35          3HB       ASP  35  -5.606  10.782  -7.838
  277    H    ASP  36           H        ASP  36  -4.022   9.754  -8.836
  278    HA   ASP  36           HA       ASP  36  -3.534   8.461 -11.302
  279   1HB   ASP  36          2HB       ASP  36  -5.443  10.164 -11.845
  280   2HB   ASP  36          3HB       ASP  36  -4.176  11.376 -11.711
  281    H    SER  37           H        SER  37  -1.516   8.204 -10.305
  282    HA   SER  37           HA       SER  37   0.524   9.919 -10.976
  283   1HB   SER  37          2HB       SER  37   0.997  10.745  -8.487
  284   2HB   SER  37          3HB       SER  37   0.015  11.687  -9.601
  285    HG   SER  37           HG       SER  37  -1.289  11.524  -7.908
  286    H    GLN  38           H        GLN  38  -0.654   7.835  -8.374
  287    HA   GLN  38           HA       GLN  38   1.913   6.835  -7.634
  288   1HB   GLN  38          2HB       GLN  38   0.595   5.049  -6.487
  289   2HB   GLN  38          3HB       GLN  38   0.058   6.676  -6.074
  290   1HG   GLN  38          2HG       GLN  38  -1.696   6.439  -7.896
  291   2HG   GLN  38          3HG       GLN  38  -1.242   4.738  -7.999
  292   1HE2  GLN  38          2HE2      GLN  38  -3.846   5.195  -7.240
  293   2HE2  GLN  38          1HE2      GLN  38  -4.047   4.924  -5.578
  294    HA   PRO  39           HA       PRO  39   2.839   4.067 -10.906
  295   1HB   PRO  39          2HB       PRO  39   3.577   1.865  -9.204
  296   2HB   PRO  39          3HB       PRO  39   4.638   2.976 -10.076
  297   1HG   PRO  39          2HG       PRO  39   4.036   2.882  -7.277
  298   2HG   PRO  39          3HG       PRO  39   5.200   3.903  -8.126
  299   1HD   PRO  39          2HD       PRO  39   2.779   4.738  -6.934
  300   2HD   PRO  39          3HD       PRO  39   3.819   5.701  -7.997
  301    H    ALA  40           H        ALA  40   1.684   2.627 -12.120
  302    HA   ALA  40           HA       ALA  40  -0.883   1.850 -11.540
  303   1HB   ALA  40          1HB       ALA  40  -0.587   0.062 -13.251
  304   2HB   ALA  40          2HB       ALA  40   0.039   1.622 -13.783
  305   3HB   ALA  40          3HB       ALA  40   1.150   0.369 -13.230
  306    H    PHE  41           H        PHE  41   2.127   0.219 -10.782
  307    HA   PHE  41           HA       PHE  41   1.181  -2.225  -9.840
  308   1HB   PHE  41          2HB       PHE  41   3.487  -0.709  -8.612
  309   2HB   PHE  41          3HB       PHE  41   3.280  -2.456  -8.727
  310    HD1  PHE  41           HD1      PHE  41   4.977   0.248 -10.110
  311    HD2  PHE  41           HD2      PHE  41   2.808  -3.261 -11.304
  312    HE1  PHE  41           HE1      PHE  41   6.145   0.272 -12.296
  313    HE2  PHE  41           HE2      PHE  41   3.980  -3.247 -13.489
  314    HZ   PHE  41           HZ       PHE  41   5.648  -1.475 -13.983
  315    H    ILE  42           H        ILE  42   1.206   0.942  -8.322
  316    HA   ILE  42           HA       ILE  42   0.530  -0.024  -5.690
  317    HB   ILE  42           HB       ILE  42   0.769   2.673  -6.986
  318   1HG1  ILE  42          2HG1      ILE  42   2.668   1.296  -5.896
  319   2HG1  ILE  42          3HG1      ILE  42   2.504   2.984  -5.414
  320   1HG2  ILE  42          1HG2      ILE  42  -1.232   2.989  -5.714
  321   2HG2  ILE  42          2HG2      ILE  42  -0.593   2.063  -4.357
  322   3HG2  ILE  42          3HG2      ILE  42   0.085   3.643  -4.741
  323   1HD1  ILE  42          1HD1      ILE  42   0.938   1.028  -3.828
  324   2HD1  ILE  42          2HD1      ILE  42   2.690   0.955  -3.634
  325   3HD1  ILE  42          3HD1      ILE  42   1.829   2.454  -3.299
  326    H    ASN  43           H        ASN  43  -1.225   0.758  -8.583
  327    HA   ASN  43           HA       ASN  43  -3.745   1.364  -7.419
  328   1HB   ASN  43          2HB       ASN  43  -3.075   0.132 -10.110
  329   2HB   ASN  43          3HB       ASN  43  -4.656   0.737  -9.640
  330   1HD2  ASN  43          2HD2      ASN  43  -3.080   2.938  -8.051
  331   2HD2  ASN  43          1HD2      ASN  43  -2.706   4.072  -9.256
  332    H    ASP  44           H        ASP  44  -2.044  -1.574  -8.287
  333    HA   ASP  44           HA       ASP  44  -4.131  -3.438  -7.976
  334   1HB   ASP  44          2HB       ASP  44  -1.238  -3.918  -7.220
  335   2HB   ASP  44          3HB       ASP  44  -2.421  -5.110  -7.741
  336    H    ILE  45           H        ILE  45  -1.685  -2.288  -5.668
  337    HA   ILE  45           HA       ILE  45  -2.390  -3.668  -3.390
  338    HB   ILE  45           HB       ILE  45  -1.477  -0.795  -3.654
  339   1HG1  ILE  45          2HG1      ILE  45   0.003  -3.420  -3.288
  340   2HG1  ILE  45          3HG1      ILE  45   0.055  -2.367  -4.700
  341   1HG2  ILE  45          1HG2      ILE  45  -0.761  -0.964  -1.345
  342   2HG2  ILE  45          2HG2      ILE  45  -2.476  -1.353  -1.418
  343   3HG2  ILE  45          3HG2      ILE  45  -1.284  -2.645  -1.255
  344   1HD1  ILE  45          1HD1      ILE  45   1.653  -2.234  -2.315
  345   2HD1  ILE  45          2HD1      ILE  45   1.765  -1.243  -3.771
  346   3HD1  ILE  45          3HD1      ILE  45   0.705  -0.753  -2.456
  347    H    LEU  46           H        LEU  46  -3.695  -0.524  -4.458
  348    HA   LEU  46           HA       LEU  46  -5.570  -0.263  -2.349
  349   1HB   LEU  46          2HB       LEU  46  -5.556   0.916  -5.139
  350   2HB   LEU  46          3HB       LEU  46  -6.650   1.417  -3.849
  351    HG   LEU  46           HG       LEU  46  -3.707   1.362  -3.283
  352   1HD1  LEU  46          1HD1      LEU  46  -3.530   3.692  -4.124
  353   2HD1  LEU  46          2HD1      LEU  46  -3.833   2.531  -5.418
  354   3HD1  LEU  46          3HD1      LEU  46  -5.146   3.543  -4.817
  355   1HD2  LEU  46          1HD2      LEU  46  -6.024   3.140  -2.446
  356   2HD2  LEU  46          2HD2      LEU  46  -5.285   1.866  -1.474
  357   3HD2  LEU  46          3HD2      LEU  46  -4.363   3.313  -1.874
  358    H    LYS  47           H        LYS  47  -5.693  -1.773  -5.524
  359    HA   LYS  47           HA       LYS  47  -8.522  -2.358  -5.346
  360   1HB   LYS  47          2HB       LYS  47  -6.349  -2.914  -7.340
  361   2HB   LYS  47          3HB       LYS  47  -7.884  -3.775  -7.443
  362   1HG   LYS  47          2HG       LYS  47  -9.107  -1.669  -7.552
  363   2HG   LYS  47          3HG       LYS  47  -7.615  -0.754  -7.338
  364   1HD   LYS  47          2HD       LYS  47  -6.742  -1.651  -9.450
  365   2HD   LYS  47          3HD       LYS  47  -8.206  -2.613  -9.664
  366   1HE   LYS  47          2HE       LYS  47  -9.401  -0.270  -9.373
  367   2HE   LYS  47          3HE       LYS  47  -7.838   0.354  -9.899
  368   1HZ   LYS  47          1HZ       LYS  47  -7.988  -1.163 -11.824
  369   2HZ   LYS  47          1HZ       LYS  47  -9.217   0.009 -11.797
  370   3HZ   LYS  47          3HZ       LYS  47  -9.559  -1.591 -11.338
  371    H    VAL  48           H        VAL  48  -5.786  -3.733  -3.978
  372    HA   VAL  48           HA       VAL  48  -6.534  -6.510  -4.213
  373    HB   VAL  48           HB       VAL  48  -4.510  -5.004  -2.564
  374   1HG1  VAL  48          1HG1      VAL  48  -5.405  -7.876  -2.232
  375   2HG1  VAL  48          2HG1      VAL  48  -3.817  -7.312  -1.714
  376   3HG1  VAL  48          3HG1      VAL  48  -5.274  -6.634  -0.988
  377   1HG2  VAL  48          1HG2      VAL  48  -4.367  -5.972  -5.067
  378   2HG2  VAL  48          2HG2      VAL  48  -2.975  -5.967  -3.985
  379   3HG2  VAL  48          3HG2      VAL  48  -3.930  -7.436  -4.188
  380    H    GLU  49           H        GLU  49  -8.339  -7.230  -3.330
  381    HA   GLU  49           HA       GLU  49  -9.918  -6.015  -1.414
  382   1HB   GLU  49          2HB       GLU  49  -9.636  -8.823  -2.396
  383   2HB   GLU  49          3HB       GLU  49 -10.618  -8.537  -0.959
  384   1HG   GLU  49          2HG       GLU  49 -11.891  -6.799  -2.230
  385   2HG   GLU  49          3HG       GLU  49 -10.970  -7.224  -3.671
  386    H    GLY  50           H        GLY  50  -8.992  -5.266   0.431
  387   1HA   GLY  50          1HA       GLY  50  -8.773  -6.664   2.720
  388   2HA   GLY  50          2HA       GLY  50  -7.186  -6.917   1.996
  389    H    VAL  51           H        VAL  51  -6.770  -4.461   0.781
  390    HA   VAL  51           HA       VAL  51  -6.001  -2.845   3.045
  391    HB   VAL  51           HB       VAL  51  -5.792  -2.222   0.089
  392   1HG1  VAL  51          1HG1      VAL  51  -5.518  -0.261   1.556
  393   2HG1  VAL  51          2HG1      VAL  51  -4.308  -1.129   2.501
  394   3HG1  VAL  51          3HG1      VAL  51  -3.979  -0.708   0.823
  395   1HG2  VAL  51          1HG2      VAL  51  -4.672  -4.362   0.781
  396   2HG2  VAL  51          2HG2      VAL  51  -3.545  -3.136   0.203
  397   3HG2  VAL  51          3HG2      VAL  51  -3.713  -3.435   1.933
  398    H    LYS  52           H        LYS  52  -6.693  -0.723   3.512
  399    HA   LYS  52           HA       LYS  52  -9.388  -0.112   2.474
  400   1HB   LYS  52          2HB       LYS  52  -9.460  -0.335   4.847
  401   2HB   LYS  52          3HB       LYS  52  -7.997   0.624   5.057
  402   1HG   LYS  52          2HG       LYS  52  -9.087   2.636   4.638
  403   2HG   LYS  52          3HG       LYS  52 -10.343   1.871   3.670
  404   1HD   LYS  52          2HD       LYS  52 -11.249   2.631   5.831
  405   2HD   LYS  52          3HD       LYS  52 -11.314   0.874   5.712
  406   1HE   LYS  52          2HE       LYS  52 -10.471   1.635   7.929
  407   2HE   LYS  52          3HE       LYS  52  -9.265   0.687   7.058
  408   1HZ   LYS  52          1HZ       LYS  52  -7.948   2.475   6.745
  409   2HZ   LYS  52          1HZ       LYS  52  -8.748   3.055   8.128
  410   3HZ   LYS  52          3HZ       LYS  52  -9.244   3.559   6.584
  411    H    SER  53           H        SER  53  -6.134   1.219   2.925
  412    HA   SER  53           HA       SER  53  -6.404   3.023   0.774
  413   1HB   SER  53          2HB       SER  53  -7.788   4.506   1.858
  414   2HB   SER  53          3HB       SER  53  -7.205   4.051   3.455
  415    HG   SER  53           HG       SER  53  -5.757   5.565   3.324
  416    H    ILE  54           H        ILE  54  -4.620   4.809   0.913
  417    HA   ILE  54           HA       ILE  54  -2.302   3.930   2.483
  418    HB   ILE  54           HB       ILE  54  -2.124   4.391  -0.503
  419   1HG1  ILE  54          2HG1      ILE  54  -1.984   1.754   1.002
  420   2HG1  ILE  54          3HG1      ILE  54  -3.396   2.303   0.100
  421   1HG2  ILE  54          1HG2      ILE  54  -0.150   3.337   1.552
  422   2HG2  ILE  54          2HG2      ILE  54   0.147   3.432  -0.185
  423   3HG2  ILE  54          3HG2      ILE  54  -0.077   4.906   0.751
  424   1HD1  ILE  54          1HD1      ILE  54  -0.704   1.471  -0.932
  425   2HD1  ILE  54          2HD1      ILE  54  -2.309   1.019  -1.509
  426   3HD1  ILE  54          3HD1      ILE  54  -1.670   2.620  -1.859
  427    H    PHE  55           H        PHE  55  -0.706   5.537   2.731
  428    HA   PHE  55           HA       PHE  55  -1.392   8.232   1.766
  429   1HB   PHE  55          2HB       PHE  55  -2.356   8.213   3.954
  430   2HB   PHE  55          3HB       PHE  55  -0.948   7.403   4.638
  431    HD1  PHE  55           HD1      PHE  55  -1.438  10.423   2.436
  432    HD2  PHE  55           HD2      PHE  55   0.271   8.808   6.032
  433    HE1  PHE  55           HE1      PHE  55  -0.400  12.623   2.935
  434    HE2  PHE  55           HE2      PHE  55   1.308  11.003   6.531
  435    HZ   PHE  55           HZ       PHE  55   0.976  12.914   4.981
  436    H    HIS  56           H        HIS  56   0.310   8.713   0.552
  437    HA   HIS  56           HA       HIS  56   3.007   7.885   1.362
  438   1HB   HIS  56          2HB       HIS  56   2.325   7.452  -0.958
  439   2HB   HIS  56          3HB       HIS  56   1.996   9.169  -1.189
  440    HD1  HIS  56           HD1      HIS  56   3.856   9.267  -3.046
  441    HD2  HIS  56           HD2      HIS  56   5.272   8.252   0.741
  442    HE1  HIS  56           HE1      HIS  56   6.375   9.505  -3.134
  443    H    VAL  57           H        VAL  57   4.480   9.256   2.138
  444    HA   VAL  57           HA       VAL  57   4.388  12.100   1.663
  445    HB   VAL  57           HB       VAL  57   2.680  11.706   3.500
  446   1HG1  VAL  57          1HG1      VAL  57   4.200   9.884   4.547
  447   2HG1  VAL  57          2HG1      VAL  57   5.092  11.228   5.259
  448   3HG1  VAL  57          3HG1      VAL  57   3.386  10.992   5.648
  449   1HG2  VAL  57          1HG2      VAL  57   4.949  13.299   4.650
  450   2HG2  VAL  57          2HG2      VAL  57   4.271  13.804   3.102
  451   3HG2  VAL  57          3HG2      VAL  57   3.240  13.720   4.528
  452    H    MET  58           H        MET  58   6.096  13.180   3.171
  453    HA   MET  58           HA       MET  58   8.405  13.374   3.306
  454   1HB   MET  58          2HB       MET  58   7.602  12.785   5.571
  455   2HB   MET  58          3HB       MET  58   7.856  11.079   5.207
  456   1HG   MET  58          2HG       MET  58  10.186  11.300   5.159
  457   2HG   MET  58          3HG       MET  58  10.112  13.032   4.839
  458   1HE   MET  58          1HE       MET  58  11.750  13.704   7.963
  459   2HE   MET  58          2HE       MET  58  11.825  13.435   6.223
  460   3HE   MET  58          3HE       MET  58  12.148  12.102   7.327
  461    H    ASP  59           H        ASP  59   8.850  10.065   4.177
  462    HA   ASP  59           HA       ASP  59   9.843   9.367   1.499
  463   1HB   ASP  59          2HB       ASP  59  11.968   8.561   2.417
  464   2HB   ASP  59          3HB       ASP  59  11.769  10.280   2.737
  465    H    PHE  60           H        PHE  60   7.744   8.585   3.734
  466    HA   PHE  60           HA       PHE  60   8.168   5.677   3.413
  467   1HB   PHE  60          2HB       PHE  60   7.366   5.277   5.639
  468   2HB   PHE  60          3HB       PHE  60   8.633   6.500   5.746
  469    HD1  PHE  60           HD1      PHE  60   8.110   8.820   6.303
  470    HD2  PHE  60           HD2      PHE  60   4.994   5.889   5.902
  471    HE1  PHE  60           HE1      PHE  60   6.501  10.386   7.348
  472    HE2  PHE  60           HE2      PHE  60   3.388   7.453   6.952
  473    HZ   PHE  60           HZ       PHE  60   4.135   9.703   7.678
  474    H    ILE  61           H        ILE  61   6.077   4.461   3.911
  475    HA   ILE  61           HA       ILE  61   3.716   5.935   2.934
  476    HB   ILE  61           HB       ILE  61   4.207   3.136   1.966
  477   1HG1  ILE  61          2HG1      ILE  61   5.390   5.659   0.749
  478   2HG1  ILE  61          3HG1      ILE  61   6.303   4.317   1.437
  479   1HG2  ILE  61          1HG2      ILE  61   2.735   3.797   0.218
  480   2HG2  ILE  61          2HG2      ILE  61   2.054   4.536   1.668
  481   3HG2  ILE  61          3HG2      ILE  61   2.995   5.512   0.540
  482   1HD1  ILE  61          1HD1      ILE  61   6.344   3.835  -0.856
  483   2HD1  ILE  61          2HD1      ILE  61   4.990   2.858  -0.291
  484   3HD1  ILE  61          3HD1      ILE  61   4.691   4.395  -1.105
  485    H    SER  62           H        SER  62   1.888   5.466   4.013
  486    HA   SER  62           HA       SER  62   2.015   3.349   6.064
  487   1HB   SER  62          2HB       SER  62   1.581   5.765   6.731
  488   2HB   SER  62          3HB       SER  62   0.023   5.613   5.921
  489    HG   SER  62           HG       SER  62  -0.257   5.051   8.056
  490    H    VAL  63           H        VAL  63   1.146   1.510   5.384
  491    HA   VAL  63           HA       VAL  63  -1.187   1.562   3.588
  492    HB   VAL  63           HB       VAL  63   0.463  -0.834   4.424
  493   1HG1  VAL  63          1HG1      VAL  63  -1.590  -1.527   3.443
  494   2HG1  VAL  63          2HG1      VAL  63  -1.532  -0.253   2.227
  495   3HG1  VAL  63          3HG1      VAL  63  -0.409  -1.610   2.136
  496   1HG2  VAL  63          1HG2      VAL  63   0.866   1.174   2.195
  497   2HG2  VAL  63          2HG2      VAL  63   2.037   0.627   3.395
  498   3HG2  VAL  63          3HG2      VAL  63   1.518  -0.462   2.110
  499    H    ASP  64           H        ASP  64  -3.107   1.514   4.554
  500    HA   ASP  64           HA       ASP  64  -3.411   0.052   7.106
  501   1HB   ASP  64          2HB       ASP  64  -5.526   1.445   7.312
  502   2HB   ASP  64          3HB       ASP  64  -4.014   2.338   7.404
  503    H    LYS  65           H        LYS  65  -4.940  -1.515   7.340
  504    HA   LYS  65           HA       LYS  65  -6.684  -2.118   5.030
  505   1HB   LYS  65          2HB       LYS  65  -6.217  -4.521   5.328
  506   2HB   LYS  65          3HB       LYS  65  -4.761  -3.629   4.895
  507   1HG   LYS  65          2HG       LYS  65  -3.784  -3.961   6.939
  508   2HG   LYS  65          3HG       LYS  65  -5.320  -3.881   7.803
  509   1HD   LYS  65          2HD       LYS  65  -5.896  -6.133   7.100
  510   2HD   LYS  65          3HD       LYS  65  -4.467  -6.221   6.071
  511   1HE   LYS  65          2HE       LYS  65  -4.479  -7.251   8.537
  512   2HE   LYS  65          3HE       LYS  65  -3.032  -6.519   7.850
  513   1HZ   LYS  65          1HZ       LYS  65  -3.388  -5.629  10.020
  514   2HZ   LYS  65          1HZ       LYS  65  -4.998  -5.227   9.661
  515   3HZ   LYS  65          3HZ       LYS  65  -3.724  -4.402   8.896
  516    H    GLU  66           H        GLU  66  -8.037  -4.248   5.920
  517    HA   GLU  66           HA       GLU  66  -9.493  -3.169   8.238
  518   1HB   GLU  66          2HB       GLU  66 -10.285  -5.279   6.215
  519   2HB   GLU  66          3HB       GLU  66 -11.319  -4.648   7.497
  520   1HG   GLU  66          2HG       GLU  66 -10.024  -2.740   5.562
  521   2HG   GLU  66          3HG       GLU  66 -11.480  -3.612   5.082
  522    H    ASN  67           H        ASN  67 -10.739  -5.303   9.275
  523    HA   ASN  67           HA       ASN  67  -8.571  -6.706  10.627
  524   1HB   ASN  67          2HB       ASN  67 -11.542  -6.484  11.094
  525   2HB   ASN  67          3HB       ASN  67 -10.540  -7.620  11.996
  526   1HD2  ASN  67          2HD2      ASN  67 -10.040  -6.712  13.996
  527   2HD2  ASN  67          1HD2      ASN  67  -9.616  -5.088  14.247
  528    H    ASP  68           H        ASP  68 -11.494  -7.538   8.779
  529    HA   ASP  68           HA       ASP  68 -11.404 -10.291   8.851
  530   1HB   ASP  68          2HB       ASP  68 -12.505 -10.234   6.626
  531   2HB   ASP  68          3HB       ASP  68 -13.220  -9.085   7.755
  532    H    ALA  69           H        ALA  69  -9.425  -8.086   6.964
  533    HA   ALA  69           HA       ALA  69  -8.148 -10.242   5.484
  534   1HB   ALA  69          1HB       ALA  69  -8.684  -7.834   4.648
  535   2HB   ALA  69          2HB       ALA  69  -7.215  -7.389   5.518
  536   3HB   ALA  69          3HB       ALA  69  -7.139  -8.565   4.207
  537    H    ASN  70           H        ASN  70  -5.693 -10.183   5.399
  538    HA   ASN  70           HA       ASN  70  -4.532  -9.642   8.056
  539   1HB   ASN  70          2HB       ASN  70  -4.480 -12.224   6.507
  540   2HB   ASN  70          3HB       ASN  70  -3.221 -11.838   7.674
  541   1HD2  ASN  70          2HD2      ASN  70  -5.002 -14.047   8.075
  542   2HD2  ASN  70          1HD2      ASN  70  -5.987 -13.697   9.412
  543    H    TRP  71           H        TRP  71  -2.060  -9.979   7.919
  544    HA   TRP  71           HA       TRP  71  -1.110  -8.307   5.737
  545   1HB   TRP  71          2HB       TRP  71   0.094  -9.342   8.294
  546   2HB   TRP  71          3HB       TRP  71   1.097  -8.580   7.059
  547    HD1  TRP  71           HD1      TRP  71  -0.664  -7.686  10.053
  548    HE1  TRP  71           HE1      TRP  71  -1.297  -5.186  10.102
  549    HE3  TRP  71           HE3      TRP  71   0.031  -6.510   5.132
  550    HZ2  TRP  71           HZ2      TRP  71  -1.489  -2.984   8.285
  551    HZ3  TRP  71           HZ3      TRP  71  -0.392  -4.208   4.320
  552    HH2  TRP  71           HH2      TRP  71  -1.148  -2.448   5.884
  553    H    GLU  72           H        GLU  72  -0.178 -11.466   7.137
  554    HA   GLU  72           HA       GLU  72   1.700 -12.224   5.236
  555   1HB   GLU  72          2HB       GLU  72  -0.238 -14.239   6.356
  556   2HB   GLU  72          3HB       GLU  72   1.485 -14.415   6.033
  557   1HG   GLU  72          2HG       GLU  72   0.183 -12.840   8.268
  558   2HG   GLU  72          3HG       GLU  72   1.251 -14.233   8.414
  559    H    THR  73           H        THR  73  -1.691 -11.864   4.934
  560    HA   THR  73           HA       THR  73  -1.930 -13.495   2.529
  561    HB   THR  73           HB       THR  73  -3.826 -11.812   4.169
  562    HG1  THR  73           HG1      THR  73  -4.704 -14.221   3.631
  563   1HG2  THR  73          1HG2      THR  73  -4.139 -12.861   1.372
  564   2HG2  THR  73          2HG2      THR  73  -5.533 -12.823   2.448
  565   3HG2  THR  73          3HG2      THR  73  -4.683 -11.328   2.055
  566    H    VAL  74           H        VAL  74  -2.076 -10.102   3.495
  567    HA   VAL  74           HA       VAL  74  -2.397  -9.096   0.829
  568    HB   VAL  74           HB       VAL  74  -2.415  -8.071   3.551
  569   1HG1  VAL  74          1HG1      VAL  74  -1.112  -6.390   1.399
  570   2HG1  VAL  74          2HG1      VAL  74  -1.690  -5.776   2.948
  571   3HG1  VAL  74          3HG1      VAL  74  -0.362  -6.934   2.899
  572   1HG2  VAL  74          1HG2      VAL  74  -3.495  -6.956   0.949
  573   2HG2  VAL  74          2HG2      VAL  74  -4.313  -8.178   1.923
  574   3HG2  VAL  74          3HG2      VAL  74  -4.053  -6.565   2.578
  575    H    LEU  75           H        LEU  75   0.308  -9.494   3.057
  576    HA   LEU  75           HA       LEU  75   2.292  -7.978   1.925
  577   1HB   LEU  75          2HB       LEU  75   2.182 -10.404   3.572
  578   2HB   LEU  75          3HB       LEU  75   3.630 -10.306   2.578
  579    HG   LEU  75           HG       LEU  75   3.762  -9.233   4.897
  580   1HD1  LEU  75          1HD1      LEU  75   4.283  -7.321   2.616
  581   2HD1  LEU  75          2HD1      LEU  75   5.198  -7.502   4.113
  582   3HD1  LEU  75          3HD1      LEU  75   5.261  -8.764   2.884
  583   1HD2  LEU  75          1HD2      LEU  75   1.397  -8.076   4.267
  584   2HD2  LEU  75          2HD2      LEU  75   2.532  -7.372   5.419
  585   3HD2  LEU  75          3HD2      LEU  75   2.498  -6.798   3.752
  586    HA   PRO  76           HA       PRO  76   3.583 -11.805  -0.946
  587   1HB   PRO  76          2HB       PRO  76   1.055 -13.007  -1.640
  588   2HB   PRO  76          3HB       PRO  76   2.457 -13.764  -0.871
  589   1HG   PRO  76          2HG       PRO  76  -0.010 -12.767   0.327
  590   2HG   PRO  76          3HG       PRO  76   1.176 -13.909   0.969
  591   1HD   PRO  76          2HD       PRO  76   0.881 -11.385   1.956
  592   2HD   PRO  76          3HD       PRO  76   2.434 -12.249   1.975
  593    H    LYS  77           H        LYS  77   0.527 -10.021  -1.158
  594    HA   LYS  77           HA       LYS  77   0.705  -9.749  -4.048
  595   1HB   LYS  77          2HB       LYS  77  -1.138  -8.426  -2.039
  596   2HB   LYS  77          3HB       LYS  77  -1.295  -8.339  -3.794
  597   1HG   LYS  77          2HG       LYS  77  -1.830 -10.617  -3.990
  598   2HG   LYS  77          3HG       LYS  77  -1.153 -11.004  -2.409
  599   1HD   LYS  77          2HD       LYS  77  -2.971  -9.790  -1.303
  600   2HD   LYS  77          3HD       LYS  77  -3.631  -9.322  -2.870
  601   1HE   LYS  77          2HE       LYS  77  -4.474 -11.510  -1.506
  602   2HE   LYS  77          3HE       LYS  77  -4.526 -11.393  -3.264
  603   1HZ   LYS  77          1HZ       LYS  77  -2.187 -12.344  -3.193
  604   2HZ   LYS  77          1HZ       LYS  77  -3.454 -13.407  -2.813
  605   3HZ   LYS  77          3HZ       LYS  77  -2.502 -12.741  -1.575
  606    H    VAL  78           H        VAL  78   0.937  -7.611  -1.224
  607    HA   VAL  78           HA       VAL  78   1.527  -5.227  -2.553
  608    HB   VAL  78           HB       VAL  78   2.164  -6.253   0.206
  609   1HG1  VAL  78          1HG1      VAL  78   2.845  -3.846   0.693
  610   2HG1  VAL  78          2HG1      VAL  78   4.012  -4.784  -0.236
  611   3HG1  VAL  78          3HG1      VAL  78   2.969  -3.613  -1.050
  612   1HG2  VAL  78          1HG2      VAL  78   0.463  -3.935  -0.745
  613   2HG2  VAL  78          2HG2      VAL  78  -0.167  -5.564  -0.513
  614   3HG2  VAL  78          3HG2      VAL  78   0.472  -4.664   0.861
  615    H    GLU  79           H        GLU  79   3.783  -7.660  -1.233
  616    HA   GLU  79           HA       GLU  79   6.182  -6.395  -1.828
  617   1HB   GLU  79          2HB       GLU  79   5.734  -8.648  -0.612
  618   2HB   GLU  79          3HB       GLU  79   5.857  -9.360  -2.222
  619   1HG   GLU  79          2HG       GLU  79   8.063  -8.088  -2.464
  620   2HG   GLU  79          3HG       GLU  79   7.962  -7.780  -0.733
  621    H    ALA  80           H        ALA  80   4.136  -8.384  -3.927
  622    HA   ALA  80           HA       ALA  80   5.776  -8.699  -6.130
  623   1HB   ALA  80          1HB       ALA  80   3.376  -9.554  -5.746
  624   2HB   ALA  80          2HB       ALA  80   2.858  -8.010  -6.423
  625   3HB   ALA  80          3HB       ALA  80   3.830  -9.117  -7.393
  626    H    VAL  81           H        VAL  81   3.960  -5.862  -5.116
  627    HA   VAL  81           HA       VAL  81   4.025  -4.308  -7.413
  628    HB   VAL  81           HB       VAL  81   4.470  -3.267  -4.604
  629   1HG1  VAL  81          1HG1      VAL  81   4.503  -1.850  -6.900
  630   2HG1  VAL  81          2HG1      VAL  81   2.764  -1.902  -6.627
  631   3HG1  VAL  81          3HG1      VAL  81   3.824  -1.208  -5.405
  632   1HG2  VAL  81          1HG2      VAL  81   1.747  -3.472  -5.816
  633   2HG2  VAL  81          2HG2      VAL  81   2.457  -4.953  -5.177
  634   3HG2  VAL  81          3HG2      VAL  81   2.231  -3.561  -4.125
  635    H    PHE  82           H        PHE  82   6.394  -4.138  -4.742
  636    HA   PHE  82           HA       PHE  82   8.262  -2.690  -6.431
  637   1HB   PHE  82          2HB       PHE  82   8.865  -3.724  -3.674
  638   2HB   PHE  82          3HB       PHE  82   9.456  -2.259  -4.464
  639    HD1  PHE  82           HD1      PHE  82   7.685  -0.460  -5.103
  640    HD2  PHE  82           HD2      PHE  82   6.974  -3.634  -2.291
  641    HE1  PHE  82           HE1      PHE  82   5.762   0.797  -4.166
  642    HE2  PHE  82           HE2      PHE  82   5.056  -2.376  -1.356
  643    HZ   PHE  82           HZ       PHE  82   4.447  -0.163  -2.296
  644    H    GLU  83           H        GLU  83   7.862  -5.074  -7.631
  645    HA   GLU  83           HA       GLU  83  10.514  -6.229  -7.572
  646   1HB   GLU  83          2HB       GLU  83   8.089  -7.787  -6.683
  647   2HB   GLU  83          3HB       GLU  83   9.487  -8.589  -7.397
  648   1HG   GLU  83          2HG       GLU  83  10.840  -7.176  -5.638
  649   2HG   GLU  83          3HG       GLU  83   9.290  -7.084  -4.806
  650    H    LEU  84           H        LEU  84   7.413  -7.578  -8.632
  651    HA   LEU  84           HA       LEU  84   6.617  -8.164 -10.707
  652   1HB   LEU  84          2HB       LEU  84   7.932  -5.535 -11.098
  653   2HB   LEU  84          3HB       LEU  84   7.659  -6.473 -12.563
  654    HG   LEU  84           HG       LEU  84   5.759  -4.950 -12.009
  655   1HD1  LEU  84          1HD1      LEU  84   4.650  -7.686 -11.599
  656   2HD1  LEU  84          2HD1      LEU  84   4.179  -6.443 -12.757
  657   3HD1  LEU  84          3HD1      LEU  84   5.622  -7.418 -13.044
  658   1HD2  LEU  84          1HD2      LEU  84   6.143  -5.398  -9.469
  659   2HD2  LEU  84          2HD2      LEU  84   4.493  -5.174 -10.049
  660   3HD2  LEU  84          3HD2      LEU  84   5.100  -6.798  -9.728
  661    H    GLU  85           H        GLU  85   9.636  -8.727  -9.781
  662    HA   GLU  85           HA       GLU  85  10.996  -9.298 -12.224
  663   1HB   GLU  85          2HB       GLU  85  11.450 -10.110  -9.359
  664   2HB   GLU  85          3HB       GLU  85  12.458 -10.724 -10.670
  665   1HG   GLU  85          2HG       GLU  85  12.763  -8.249 -11.351
  666   2HG   GLU  85          3HG       GLU  85  12.115  -7.863  -9.758
  667    H    HIS  86           H        HIS  86  10.628 -10.869 -13.582
  668    HA   HIS  86           HA       HIS  86   9.227 -13.306 -12.660
  669   1HB   HIS  86          2HB       HIS  86   9.373 -12.065 -15.418
  670   2HB   HIS  86          3HB       HIS  86   8.541 -13.567 -15.022
  671    HD1  HIS  86           HD1      HIS  86   7.916 -11.671 -12.151
  672    HD2  HIS  86           HD2      HIS  86   6.471 -11.413 -16.053
  673    HE1  HIS  86           HE1      HIS  86   5.748 -10.369 -12.028
  674    H    HIS  87           H        HIS  87   9.977 -15.328 -13.422
  675    HA   HIS  87           HA       HIS  87  11.641 -16.864 -13.801
  676   1HB   HIS  87          2HB       HIS  87  11.966 -14.863 -16.021
  677   2HB   HIS  87          3HB       HIS  87  13.078 -16.226 -15.886
  678    HD1  HIS  87           HD1      HIS  87  12.317 -18.247 -17.102
  679    HD2  HIS  87           HD2      HIS  87   9.086 -15.932 -15.852
  680    HE1  HIS  87           HE1      HIS  87  10.233 -19.419 -17.938
  681    H    HIS  88           H        HIS  88  12.369 -15.790 -11.644
  682    HA   HIS  88           HA       HIS  88  14.754 -14.200 -11.695
  683   1HB   HIS  88          2HB       HIS  88  14.809 -14.887  -9.224
  684   2HB   HIS  88          3HB       HIS  88  13.412 -13.961  -9.766
  685    HD1  HIS  88           HD1      HIS  88  14.427 -17.584  -9.174
  686    HD2  HIS  88           HD2      HIS  88  10.982 -15.247  -9.343
  687    HE1  HIS  88           HE1      HIS  88  12.507 -19.100  -8.534
  688    H    HIS  89           H        HIS  89  16.320 -15.263 -12.910
  689    HA   HIS  89           HA       HIS  89  17.084 -17.982 -12.167
  690   1HB   HIS  89          2HB       HIS  89  17.829 -16.109 -14.390
  691   2HB   HIS  89          3HB       HIS  89  18.854 -17.498 -14.026
  692    HD1  HIS  89           HD1      HIS  89  16.785 -19.620 -13.332
  693    HD2  HIS  89           HD2      HIS  89  16.332 -17.003 -16.548
  694    HE1  HIS  89           HE1      HIS  89  15.179 -20.734 -14.943
  695    H    HIS  90           H        HIS  90  17.466 -16.596  -9.987
  696    HA   HIS  90           HA       HIS  90  19.991 -15.268  -9.782
  697   1HB   HIS  90          2HB       HIS  90  18.259 -16.505  -7.622
  698   2HB   HIS  90          3HB       HIS  90  19.599 -15.388  -7.360
  699    HD1  HIS  90           HD1      HIS  90  17.924 -14.378 -10.370
  700    HD2  HIS  90           HD2      HIS  90  17.202 -13.823  -6.302
  701    HE1  HIS  90           HE1      HIS  90  16.341 -12.410 -10.188
  702    H    HIS  91           H        HIS  91  21.960 -16.059  -9.343
  703    HA   HIS  91           HA       HIS  91  22.759 -18.616  -9.901
  704   1HB   HIS  91          2HB       HIS  91  24.776 -18.108  -8.467
  705   2HB   HIS  91          3HB       HIS  91  24.398 -16.887  -9.683
  706    HD1  HIS  91           HD1      HIS  91  23.461 -14.612  -8.856
  707    HD2  HIS  91           HD2      HIS  91  24.306 -17.288  -5.771
  708    HE1  HIS  91           HE1      HIS  91  23.360 -13.281  -6.703