*HEADER    DE NOVO PROTEIN                         04-JUL-16   5KPH              
*TITLE     SOLUTION NMR STRUCTURE OF DENOVO BETA SHEET DESIGN PROTEIN, NORTHEAST 
*TITLE    2 STRUCTURAL GENOMICS CONSORTIUM (NESG) TARGET OR485                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DE NOVO BETA SHEET DESIGN PROTEIN OR485;                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SYNTHETIC CONSTRUCT;                            
*SOURCE   3 ORGANISM_TAXID: 32630;                                               
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    STRUCTURAL GENOMICS, PSI-BIOLOGY, NORTHEAST STRUCTURAL GENOMICS       
*KEYWDS   2 CONSORTIUM, NESG, DE NOVO PROTEIN                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.TANG,G.LIU,G.T.MONTELIONE,NORTHEAST STRUCTURAL GENOMICS CONSORTIUM  
*AUTHOR   2 (NESG)                                                               
*REVDAT   1   28-SEP-16 5KPH    0                                                
# Restraints file 1: OR485_cns.tbl
!
! ACO file produced by PDBStat
! Version:  5.1-Exp Compiled 2008-08-11 on (europa)
!
 dihedral
   assign (resid   3 and name C   )   (resid   4 and name N   )
          (resid   4 and name CA  )   (resid   4 and name C   )   1.0    -59.70    20.00   2 
   assign (resid   4 and name N   )   (resid   4 and name CA  )
          (resid   4 and name C   )   (resid   5 and name N   )   1.0    -39.40    20.00   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
          (resid   5 and name CA  )   (resid   5 and name C   )   1.0    -67.90    20.00   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name C   )   (resid   6 and name N   )   1.0    -43.60    20.00   2 
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0    -69.00    20.00   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name C   )   (resid   7 and name N   )   1.0    -35.60    20.00   2 
   assign (resid   6 and name C   )   (resid   7 and name N   )
          (resid   7 and name CA  )   (resid   7 and name C   )   1.0    -61.80    20.00   2 
   assign (resid   7 and name N   )   (resid   7 and name CA  )
          (resid   7 and name C   )   (resid   8 and name N   )   1.0    -45.30    20.00   2 
   assign (resid   7 and name C   )   (resid   8 and name N   )
          (resid   8 and name CA  )   (resid   8 and name C   )   1.0    -64.50    20.00   2 
   assign (resid   8 and name N   )   (resid   8 and name CA  )
          (resid   8 and name C   )   (resid   9 and name N   )   1.0    -40.20    20.00   2 
   assign (resid   8 and name C   )   (resid   9 and name N   )
          (resid   9 and name CA  )   (resid   9 and name C   )   1.0    -61.40    20.00   2 
   assign (resid   9 and name N   )   (resid   9 and name CA  )
          (resid   9 and name C   )   (resid  10 and name N   )   1.0    -43.40    20.00   2 
   assign (resid   9 and name C   )   (resid  10 and name N   )
          (resid  10 and name CA  )   (resid  10 and name C   )   1.0    -66.40    20.00   2 
   assign (resid  10 and name N   )   (resid  10 and name CA  )
          (resid  10 and name C   )   (resid  11 and name N   )   1.0    -42.00    20.00   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0    -66.00    20.00   2 
   assign (resid  11 and name N   )   (resid  11 and name CA  )
          (resid  11 and name C   )   (resid  12 and name N   )   1.0    -41.00    20.00   2 
   assign (resid  11 and name C   )   (resid  12 and name N   )
          (resid  12 and name CA  )   (resid  12 and name C   )   1.0    -59.10    20.00   2 
   assign (resid  12 and name N   )   (resid  12 and name CA  )
          (resid  12 and name C   )   (resid  13 and name N   )   1.0    -41.20    20.00   2 
   assign (resid  12 and name C   )   (resid  13 and name N   )
          (resid  13 and name CA  )   (resid  13 and name C   )   1.0    -62.30    20.00   2 
   assign (resid  13 and name N   )   (resid  13 and name CA  )
          (resid  13 and name C   )   (resid  14 and name N   )   1.0    -42.20    20.00   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0    -64.90    20.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    -38.00    20.00   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0    -64.50    20.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0    -39.30    20.00   2 
   assign (resid  15 and name C   )   (resid  16 and name N   )
          (resid  16 and name CA  )   (resid  16 and name C   )   1.0    -60.40    20.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name C   )   (resid  17 and name N   )   1.0    -46.60    20.00   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0    -59.90    20.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0    -45.70    20.00   2 
   assign (resid  17 and name C   )   (resid  18 and name N   )
          (resid  18 and name CA  )   (resid  18 and name C   )   1.0    -62.30    20.00   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name C   )   (resid  19 and name N   )   1.0    -35.50    20.00   2 
   assign (resid  18 and name C   )   (resid  19 and name N   )
          (resid  19 and name CA  )   (resid  19 and name C   )   1.0    -66.50    20.00   2 
   assign (resid  19 and name N   )   (resid  19 and name CA  )
          (resid  19 and name C   )   (resid  20 and name N   )   1.0    -36.00    20.00   2 
   assign (resid  19 and name C   )   (resid  20 and name N   )
          (resid  20 and name CA  )   (resid  20 and name C   )   1.0    -62.70    20.00   2 
   assign (resid  20 and name N   )   (resid  20 and name CA  )
          (resid  20 and name C   )   (resid  21 and name N   )   1.0    -37.60    20.00   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0    -71.15    21.35   2 
   assign (resid  21 and name N   )   (resid  21 and name CA  )
          (resid  21 and name C   )   (resid  22 and name N   )   1.0    -41.90    20.00   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0    -83.40    20.00   2 
   assign (resid  22 and name N   )   (resid  22 and name CA  )
          (resid  22 and name C   )   (resid  23 and name N   )   1.0    -19.90    31.60   2 
   assign (resid  22 and name C   )   (resid  23 and name N   )
          (resid  23 and name CA  )   (resid  23 and name C   )   1.0    -92.55    66.65   2 
   assign (resid  23 and name N   )   (resid  23 and name CA  )
          (resid  23 and name C   )   (resid  24 and name N   )   1.0    120.55    69.15   2 
   assign (resid  24 and name N   )   (resid  24 and name CA  )
          (resid  24 and name C   )   (resid  25 and name N   )   1.0    -23.10    20.00   2 
   assign (resid  24 and name C   )   (resid  25 and name N   )
          (resid  25 and name CA  )   (resid  25 and name C   )   1.0    -86.10    20.00   2 
   assign (resid  25 and name N   )   (resid  25 and name CA  )
          (resid  25 and name C   )   (resid  26 and name N   )   1.0     -3.45    22.05   2 
   assign (resid  26 and name C   )   (resid  27 and name N   )
          (resid  27 and name CA  )   (resid  27 and name C   )   1.0   -114.65    45.75   2 
   assign (resid  27 and name N   )   (resid  27 and name CA  )
          (resid  27 and name C   )   (resid  28 and name N   )   1.0    136.70    34.80   2 
   assign (resid  27 and name C   )   (resid  28 and name N   )
          (resid  28 and name CA  )   (resid  28 and name C   )   1.0   -128.15    28.25   2 
   assign (resid  28 and name N   )   (resid  28 and name CA  )
          (resid  28 and name C   )   (resid  29 and name N   )   1.0    142.60    27.40   2 
   assign (resid  28 and name C   )   (resid  29 and name N   )
          (resid  29 and name CA  )   (resid  29 and name C   )   1.0   -121.85    30.25   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    140.70    35.90   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0    -77.90    25.70   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0    123.75    23.45   2 
   assign (resid  30 and name C   )   (resid  31 and name N   )
          (resid  31 and name CA  )   (resid  31 and name C   )   1.0    -99.50    27.40   2 
   assign (resid  31 and name N   )   (resid  31 and name CA  )
          (resid  31 and name C   )   (resid  32 and name N   )   1.0    -36.20    22.30   2 
   assign (resid  31 and name C   )   (resid  32 and name N   )
          (resid  32 and name CA  )   (resid  32 and name C   )   1.0   -155.80    20.00   2 
   assign (resid  32 and name N   )   (resid  32 and name CA  )
          (resid  32 and name C   )   (resid  33 and name N   )   1.0    149.10    20.00   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0   -128.20    29.60   2 
   assign (resid  33 and name N   )   (resid  33 and name CA  )
          (resid  33 and name C   )   (resid  34 and name N   )   1.0    131.40    20.00   2 
   assign (resid  33 and name C   )   (resid  34 and name N   )
          (resid  34 and name CA  )   (resid  34 and name C   )   1.0   -115.90    26.60   2 
   assign (resid  34 and name N   )   (resid  34 and name CA  )
          (resid  34 and name C   )   (resid  35 and name N   )   1.0    137.80    27.20   2 
   assign (resid  34 and name C   )   (resid  35 and name N   )
          (resid  35 and name CA  )   (resid  35 and name C   )   1.0   -110.00    39.40   2 
   assign (resid  35 and name N   )   (resid  35 and name CA  )
          (resid  35 and name C   )   (resid  36 and name N   )   1.0    128.00    20.00   2 
   assign (resid  35 and name C   )   (resid  36 and name N   )
          (resid  36 and name CA  )   (resid  36 and name C   )   1.0   -121.75    47.65   2 
   assign (resid  36 and name N   )   (resid  36 and name CA  )
          (resid  36 and name C   )   (resid  37 and name N   )   1.0    109.85    52.85   2 
   assign (resid  36 and name C   )   (resid  37 and name N   )
          (resid  37 and name CA  )   (resid  37 and name C   )   1.0     58.30    70.00   2 
   assign (resid  37 and name N   )   (resid  37 and name CA  )
          (resid  37 and name C   )   (resid  38 and name N   )   1.0   -137.05    69.65   2 
   assign (resid  38 and name C   )   (resid  39 and name N   )
          (resid  39 and name CA  )   (resid  39 and name C   )   1.0   -104.35    44.25   2 
   assign (resid  39 and name N   )   (resid  39 and name CA  )
          (resid  39 and name C   )   (resid  40 and name N   )   1.0    131.65    39.25   2 
   assign (resid  39 and name C   )   (resid  40 and name N   )
          (resid  40 and name CA  )   (resid  40 and name C   )   1.0   -108.05    31.75   2 
   assign (resid  40 and name N   )   (resid  40 and name CA  )
          (resid  40 and name C   )   (resid  41 and name N   )   1.0    132.95    22.85   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0   -106.10    23.70   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name C   )   (resid  42 and name N   )   1.0    128.20    30.50   2 
   assign (resid  41 and name C   )   (resid  42 and name N   )
          (resid  42 and name CA  )   (resid  42 and name C   )   1.0   -110.45    31.55   2 
   assign (resid  42 and name N   )   (resid  42 and name CA  )
          (resid  42 and name C   )   (resid  43 and name N   )   1.0    121.00    24.20   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0   -111.65    36.05   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    131.05    26.45   2 
   assign (resid  43 and name C   )   (resid  44 and name N   )
          (resid  44 and name CA  )   (resid  44 and name C   )   1.0   -128.55    29.15   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    139.55    27.75   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0   -129.20    20.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    128.20    20.00   2 
   assign (resid  45 and name C   )   (resid  46 and name N   )
          (resid  46 and name CA  )   (resid  46 and name C   )   1.0   -120.50    22.80   2 
   assign (resid  46 and name N   )   (resid  46 and name CA  )
          (resid  46 and name C   )   (resid  47 and name N   )   1.0    129.40    22.80   2 
   assign (resid  46 and name C   )   (resid  47 and name N   )
          (resid  47 and name CA  )   (resid  47 and name C   )   1.0   -123.20    20.00   2 
   assign (resid  47 and name N   )   (resid  47 and name CA  )
          (resid  47 and name C   )   (resid  48 and name N   )   1.0    123.10    20.00   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0   -108.50    62.00   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name C   )   (resid  49 and name N   )   1.0    142.40    54.70   2 
   assign (resid  49 and name C   )   (resid  50 and name N   )
          (resid  50 and name CA  )   (resid  50 and name C   )   1.0     77.60    20.00   2 
   assign (resid  50 and name N   )   (resid  50 and name CA  )
          (resid  50 and name C   )   (resid  51 and name N   )   1.0      3.15    22.65   2 
   assign (resid  50 and name C   )   (resid  51 and name N   )
          (resid  51 and name CA  )   (resid  51 and name C   )   1.0    -82.45    31.25   2 
   assign (resid  51 and name N   )   (resid  51 and name CA  )
          (resid  51 and name C   )   (resid  52 and name N   )   1.0    147.00    20.00   2 
   assign (resid  51 and name C   )   (resid  52 and name N   )
          (resid  52 and name CA  )   (resid  52 and name C   )   1.0   -115.10    33.30   2 
   assign (resid  52 and name N   )   (resid  52 and name CA  )
          (resid  52 and name C   )   (resid  53 and name N   )   1.0    131.60    30.90   2 
   assign (resid  52 and name C   )   (resid  53 and name N   )
          (resid  53 and name CA  )   (resid  53 and name C   )   1.0   -130.10    32.90   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name C   )   (resid  54 and name N   )   1.0    144.00    30.10   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0   -119.60    43.50   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    133.90    31.00   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0   -129.10    20.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0    147.45    25.05   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0   -107.45    36.95   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0    124.30    20.00   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0   -114.80    20.00   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0    126.85    20.55   2 
   assign (resid  57 and name C   )   (resid  58 and name N   )
          (resid  58 and name CA  )   (resid  58 and name C   )   1.0   -113.75    35.15   2 
   assign (resid  58 and name N   )   (resid  58 and name CA  )
          (resid  58 and name C   )   (resid  59 and name N   )   1.0    122.60    20.00   2 
   assign (resid  58 and name C   )   (resid  59 and name N   )
          (resid  59 and name CA  )   (resid  59 and name C   )   1.0   -118.70    20.00   2 
   assign (resid  59 and name N   )   (resid  59 and name CA  )
          (resid  59 and name C   )   (resid  60 and name N   )   1.0    131.30    20.00   2 
   assign (resid  59 and name C   )   (resid  60 and name N   )
          (resid  60 and name CA  )   (resid  60 and name C   )   1.0   -125.95    22.05   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name C   )   (resid  61 and name N   )   1.0    134.30    24.40   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0    -93.25    33.45   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    126.00    20.00   2 
   assign (resid  61 and name C   )   (resid  62 and name N   )
          (resid  62 and name CA  )   (resid  62 and name C   )   1.0   -127.25    42.65   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name C   )   (resid  63 and name N   )   1.0    117.45    46.05   2 
   assign (resid  62 and name C   )   (resid  63 and name N   )
          (resid  63 and name CA  )   (resid  63 and name C   )   1.0     71.70    20.00   2 
   assign (resid  63 and name N   )   (resid  63 and name CA  )
          (resid  63 and name C   )   (resid  64 and name N   )   1.0   -121.50    20.00   2 
   assign (resid  64 and name C   )   (resid  65 and name N   )
          (resid  65 and name CA  )   (resid  65 and name C   )   1.0   -118.25    52.15   2 
   assign (resid  65 and name N   )   (resid  65 and name CA  )
          (resid  65 and name C   )   (resid  66 and name N   )   1.0    133.40    40.80   2 
   assign (resid  65 and name C   )   (resid  66 and name N   )
          (resid  66 and name CA  )   (resid  66 and name C   )   1.0   -100.70    43.60   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name C   )   (resid  67 and name N   )   1.0    138.75    31.05   2 
   assign (resid  66 and name C   )   (resid  67 and name N   )
          (resid  67 and name CA  )   (resid  67 and name C   )   1.0   -111.30    35.90   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name C   )   (resid  68 and name N   )   1.0    129.65    35.95   2 
   assign (resid  67 and name C   )   (resid  68 and name N   )
          (resid  68 and name CA  )   (resid  68 and name C   )   1.0    -79.40    20.00   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name C   )   (resid  69 and name N   )   1.0    123.60    20.00   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0    -93.85    27.55   2 
   assign (resid  69 and name N   )   (resid  69 and name CA  )
          (resid  69 and name C   )   (resid  70 and name N   )   1.0    -36.40    20.00   2 
   assign (resid  69 and name C   )   (resid  70 and name N   )
          (resid  70 and name CA  )   (resid  70 and name C   )   1.0   -154.75    21.15   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name C   )   (resid  71 and name N   )   1.0    145.70    20.00   2 
   assign (resid  70 and name C   )   (resid  71 and name N   )
          (resid  71 and name CA  )   (resid  71 and name C   )   1.0   -125.05    36.35   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name C   )   (resid  72 and name N   )   1.0    129.20    21.50   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0   -120.15    26.35   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    127.90    20.20   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -97.85    28.95   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    129.20    20.00   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0    -93.60    52.90   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    136.00    20.00   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0    -97.80    49.30   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    137.85    34.55   2 
   assign (resid  79 and name C   )   (resid  80 and name N   )
          (resid  80 and name CA  )   (resid  80 and name C   )   1.0    -93.65    61.35   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    107.50    60.90   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -84.30    46.40   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    142.30    20.50   2 
 end
 assign ((resid   5 and name HN   ))   ((resid   5 and name HB1  ))    3.74  1.94  0.56
 assign ((resid   4 and name HG2  ))   ((resid   5 and name HN   ))    4.77  2.97  0.72
 assign ((resid   4 and name HG1  ))   ((resid   5 and name HN   ))    4.77  2.97  0.72
 assign ((resid   5 and name HB2  ))   ((resid   6 and name HN   ))    4.43  2.63  0.66
 assign ((resid   5 and name HG2  ))   ((resid   6 and name HN   ))    5.24  3.44  0.79
 assign ((resid   5 and name HG1  ))   ((resid   6 and name HN   ))    5.24  3.44  0.79
 assign ((resid   6 and name HN   ))   ((resid   7 and name HN   ))    6.00  4.20  0.90
 assign ((resid   6 and name HG2  ))   ((resid   7 and name HN   ))    5.58  3.78  0.84
 assign ((resid   6 and name HG1  ))   ((resid   7 and name HN   ))    5.58  3.78  0.84
 assign ((resid   7 and name HB1  ))   ((resid   8 and name HN   ))    4.04  2.24  0.61
 assign ((resid   7 and name HG2  ))   ((resid   8 and name HN   ))    4.86  3.06  0.73
 assign ((resid   7 and name HG1  ))   ((resid   8 and name HN   ))    4.86  3.06  0.73
 assign ((resid   8 and name HN   ))   ((resid   9 and name HN   ))    3.30  1.50  0.50
 assign ((resid   8 and name HB2  ))   ((resid   9 and name HN   ))    2.90  1.10  0.44
 assign ((resid   8 and name HD2  ))   ((resid   9 and name HN   ))    5.17  3.37  0.78
 assign ((resid   8 and name HD1  ))   ((resid   9 and name HN   ))    5.50  3.70  0.83
 assign ((resid  10 and name HN   ))   ((resid  12 and name HB2  ))    5.70  3.90  0.86
 assign ((resid  10 and name HG2  ))   ((resid  11 and name HN   ))    5.41  3.61  0.81
 assign ((resid  10 and name HG1  ))   ((resid  11 and name HN   ))    5.41  3.61  0.81
 assign ((resid  11 and name HN   ))   ((resid  12 and name HN   ))    3.18  1.38  0.48
 assign ((resid  11 and name HG2* ))   ((resid  12 and name HN   ))    3.78  1.98  0.57
 assign ((resid  12 and name HB1  ))   ((resid  13 and name HN   ))    3.81  2.01  0.57
 assign ((resid  12 and name HB2  ))   ((resid  13 and name HN   ))    3.71  1.91  0.56
 assign ((resid  12 and name HG1  ))   ((resid  13 and name HN   ))    5.16  3.36  0.77
 assign ((resid  12 and name HG2  ))   ((resid  13 and name HN   ))    5.47  3.67  0.82
 assign ((resid  13 and name HN   ))   ((resid  14 and name HN   ))    3.28  1.48  0.49
 assign ((resid  13 and name HB2  ))   ((resid  14 and name HN   ))    4.18  2.38  0.63
 assign ((resid  13 and name HB1  ))   ((resid  14 and name HN   ))    3.18  1.38  0.48
 assign ((resid  13 and name HG2  ))   ((resid  14 and name HN   ))    4.00  2.20  0.60
 assign ((resid  13 and name HE21 ))   ((resid  14 and name HN   ))    4.46  2.66  0.67
 assign ((resid  14 and name HN   ))   ((resid  16 and name HN   ))    4.86  3.06  0.73
 assign ((resid  13 and name HE22 ))   ((resid  14 and name HN   ))    6.00  4.20  0.90
 assign ((resid  14 and name HB   ))   ((resid  15 and name HN   ))    3.22  1.42  0.48
 assign ((resid  15 and name HN   ))   ((resid  42 and name HG1* ))    4.35  2.55  0.65
 assign ((resid  14 and name HG2* ))   ((resid  15 and name HN   ))    4.05  2.25  0.61
 assign ((resid  15 and name HN   ))   ((resid  16 and name HN   ))    2.89  1.09  0.43
 assign ((resid  15 and name HB*  ))   ((resid  16 and name HN   ))    3.26  1.46  0.49
 assign ((resid  16 and name HN   ))   ((resid  17 and name HN   ))    3.24  1.44  0.49
 assign ((resid  16 and name HB2  ))   ((resid  17 and name HN   ))    4.25  2.45  0.64
 assign ((resid  16 and name HB1  ))   ((resid  17 and name HN   ))    3.92  2.12  0.59
 assign ((resid  16 and name HG2  ))   ((resid  17 and name HN   ))    4.36  2.56  0.65
 assign ((resid  16 and name HG1  ))   ((resid  17 and name HN   ))    4.61  2.81  0.69
 assign ((resid  16 and name HD2  ))   ((resid  17 and name HN   ))    5.69  3.89  0.85
 assign ((resid  16 and name HD1  ))   ((resid  17 and name HN   ))    5.69  3.89  0.85
 assign ((resid  16 and name HE2  ))   ((resid  17 and name HN   ))    6.00  4.20  0.90
 assign ((resid  16 and name HE1  ))   ((resid  17 and name HN   ))    6.00  4.20  0.90
 assign ((resid  17 and name HB2  ))   ((resid  18 and name HN   ))    3.47  1.67  0.52
 assign ((resid  17 and name HB1  ))   ((resid  18 and name HN   ))    3.66  1.86  0.55
 assign ((resid  17 and name HG2  ))   ((resid  18 and name HN   ))    4.59  2.79  0.69
 assign ((resid  17 and name HG1  ))   ((resid  18 and name HN   ))    4.59  2.79  0.69
 assign ((resid  18 and name HB1  ))   ((resid  19 and name HN   ))    3.74  1.94  0.56
 assign ((resid  18 and name HB2  ))   ((resid  19 and name HN   ))    3.53  1.73  0.53
 assign ((resid  18 and name HG2  ))   ((resid  19 and name HN   ))    4.21  2.41  0.63
 assign ((resid  19 and name HN   ))   ((resid  19 and name HG   ))    3.07  1.27  0.46
 assign ((resid  19 and name HN   ))   ((resid  20 and name HB2  ))    4.71  2.91  0.71
 assign ((resid  19 and name HN   ))   ((resid  20 and name HN   ))    3.22  1.42  0.48
 assign ((resid  19 and name HD1* ))   ((resid  20 and name HN   ))    4.99  3.19  0.75
 assign ((resid  19 and name HD2* ))   ((resid  20 and name HN   ))    5.10  3.30  0.77
 assign ((resid  20 and name HB2  ))   ((resid  21 and name HN   ))    3.83  2.03  0.57
 assign ((resid  20 and name HB1  ))   ((resid  21 and name HN   ))    3.93  2.13  0.59
 assign ((resid  20 and name HG   ))   ((resid  21 and name HN   ))    5.21  3.41  0.78
 assign ((resid  20 and name HD1* ))   ((resid  21 and name HN   ))    5.33  3.53  0.80
 assign ((resid  21 and name HN   ))   ((resid  22 and name HN   ))    3.03  1.23  0.45
 assign ((resid  19 and name HA   ))   ((resid  22 and name HN   ))    3.87  2.07  0.58
 assign ((resid  22 and name HB1  ))   ((resid  23 and name HN   ))    4.21  2.41  0.63
 assign ((resid  22 and name HB2  ))   ((resid  23 and name HN   ))    3.44  1.64  0.52
 assign ((resid  22 and name HG2  ))   ((resid  23 and name HN   ))    4.87  3.07  0.73
 assign ((resid  22 and name HG1  ))   ((resid  23 and name HN   ))    4.87  3.07  0.73
 assign ((resid  24 and name HG1  ))   ((resid  25 and name HN   ))    5.78  3.98  0.87
 assign ((resid  25 and name HN   ))   ((resid  26 and name HN   ))    4.24  2.44  0.64
 assign ((resid  25 and name HB2  ))   ((resid  26 and name HN   ))    4.79  2.99  0.72
 assign ((resid  25 and name HB1  ))   ((resid  26 and name HN   ))    4.79  2.99  0.72
 assign ((resid  26 and name HN   ))   ((resid  27 and name HN   ))    4.86  3.06  0.73
 assign ((resid  26 and name HB2  ))   ((resid  27 and name HN   ))    3.81  2.01  0.57
 assign ((resid  26 and name HB1  ))   ((resid  27 and name HN   ))    3.81  2.01  0.57
 assign ((resid  27 and name HA   ))   ((resid  28 and name HN   ))    3.10  1.30  0.47
 assign ((resid  27 and name HB2  ))   ((resid  28 and name HN   ))    4.19  2.39  0.63
 assign ((resid  27 and name HB1  ))   ((resid  28 and name HN   ))    4.19  2.39  0.63
 assign ((resid  27 and name HG2  ))   ((resid  28 and name HN   ))    4.67  2.87  0.70
 assign ((resid  27 and name HG1  ))   ((resid  28 and name HN   ))    4.67  2.87  0.70
 assign ((resid  27 and name HD2  ))   ((resid  28 and name HN   ))    6.00  4.20  0.90
 assign ((resid  27 and name HD1  ))   ((resid  28 and name HN   ))    6.00  4.20  0.90
 assign ((resid  28 and name HN   ))   ((resid  29 and name HN   ))    4.93  3.13  0.74
 assign ((resid  28 and name HA   ))   ((resid  29 and name HN   ))    2.85  1.05  0.43
 assign ((resid  28 and name HB   ))   ((resid  29 and name HN   ))    4.11  2.31  0.62
 assign ((resid  28 and name HG1* ))   ((resid  29 and name HN   ))    3.23  1.43  0.48
 assign ((resid  30 and name HA   ))   ((resid  31 and name HN   ))    2.99  1.19  0.45
 assign ((resid  30 and name HB   ))   ((resid  31 and name HN   ))    4.81  3.01  0.72
 assign ((resid  30 and name HG2* ))   ((resid  31 and name HN   ))    4.19  2.39  0.63
 assign ((resid  31 and name HN   ))   ((resid  32 and name HN   ))    3.05  1.25  0.46
 assign ((resid  32 and name HN   ))   ((resid  32 and name HB2  ))    3.81  2.01  0.57
 assign ((resid  32 and name HN   ))   ((resid  32 and name HB1  ))    3.81  2.01  0.57
 assign ((resid  31 and name HB1  ))   ((resid  32 and name HN   ))    3.31  1.51  0.50
 assign ((resid  31 and name HG2  ))   ((resid  32 and name HN   ))    4.47  2.67  0.67
 assign ((resid  31 and name HG1  ))   ((resid  32 and name HN   ))    4.47  2.67  0.67
 assign ((resid  32 and name HN   ))   ((resid  33 and name HN   ))    5.14  3.34  0.77
 assign ((resid  32 and name HA   ))   ((resid  33 and name HN   ))    3.33  1.53  0.50
 assign ((resid  32 and name HG2  ))   ((resid  33 and name HN   ))    4.52  2.72  0.68
 assign ((resid  32 and name HG1  ))   ((resid  33 and name HN   ))    4.52  2.72  0.68
 assign ((resid  33 and name HA   ))   ((resid  34 and name HN   ))    2.85  1.05  0.43
 assign ((resid  33 and name HG1* ))   ((resid  34 and name HN   ))    3.34  1.54  0.50
 assign ((resid  33 and name HG2* ))   ((resid  34 and name HN   ))    4.29  2.49  0.64
 assign ((resid  35 and name HA   ))   ((resid  36 and name HN   ))    2.99  1.19  0.45
 assign ((resid  35 and name HB2  ))   ((resid  36 and name HN   ))    4.39  2.59  0.66
 assign ((resid  35 and name HB1  ))   ((resid  36 and name HN   ))    4.39  2.59  0.66
 assign ((resid  35 and name HD2  ))   ((resid  36 and name HN   ))    4.83  3.03  0.72
 assign ((resid  35 and name HD1  ))   ((resid  36 and name HN   ))    4.83  3.03  0.72
 assign ((resid  35 and name HE2  ))   ((resid  36 and name HN   ))    5.70  3.90  0.86
 assign ((resid  35 and name HE1  ))   ((resid  36 and name HN   ))    5.70  3.90  0.86
 assign ((resid  38 and name HN   ))   ((resid  39 and name HN   ))    3.29  1.49  0.49
 assign ((resid  38 and name HA   ))   ((resid  39 and name HN   ))    3.49  1.69  0.52
 assign ((resid  38 and name HB2  ))   ((resid  39 and name HN   ))    4.68  2.88  0.70
 assign ((resid  38 and name HB1  ))   ((resid  39 and name HN   ))    4.68  2.88  0.70
 assign ((resid  39 and name HB   ))   ((resid  40 and name HN   ))    3.88  2.08  0.58
 assign ((resid  39 and name HG2* ))   ((resid  40 and name HN   ))    3.40  1.60  0.51
 assign ((resid  40 and name HN   ))   ((resid  41 and name HN   ))    4.44  2.64  0.67
 assign ((resid  58 and name HN   ))   ((resid  59 and name HN   ))    4.84  3.04  0.73
 assign ((resid  40 and name HA   ))   ((resid  41 and name HN   ))    2.87  1.07  0.43
 assign ((resid  40 and name HG12 ))   ((resid  41 and name HN   ))    4.69  2.89  0.70
 assign ((resid  40 and name HB   ))   ((resid  41 and name HN   ))    4.72  2.92  0.71
 assign ((resid  40 and name HG2* ))   ((resid  41 and name HN   ))    3.21  1.41  0.48
 assign ((resid  42 and name HA   ))   ((resid  43 and name HN   ))    2.86  1.06  0.43
 assign ((resid  43 and name HN   ))   ((resid  43 and name HB1  ))    3.77  1.97  0.57
 assign ((resid  42 and name HG1* ))   ((resid  43 and name HN   ))    3.38  1.58  0.51
 assign ((resid  42 and name HG2* ))   ((resid  43 and name HN   ))    4.47  2.67  0.67
 assign ((resid  43 and name HN   ))   ((resid  44 and name HD1* ))    4.72  2.92  0.71
 assign ((resid  43 and name HA   ))   ((resid  44 and name HN   ))    2.77  0.97  0.42
 assign ((resid  43 and name HB2  ))   ((resid  44 and name HN   ))    4.40  2.60  0.66
 assign ((resid  43 and name HB1  ))   ((resid  44 and name HN   ))    4.18  2.38  0.63
 assign ((resid  44 and name HN   ))   ((resid  45 and name HN   ))    4.68  2.88  0.70
 assign ((resid  44 and name HA   ))   ((resid  45 and name HN   ))    2.96  1.16  0.44
 assign ((resid  44 and name HB1  ))   ((resid  45 and name HN   ))    3.25  1.45  0.49
 assign ((resid  31 and name HB1  ))   ((resid  45 and name HN   ))    5.24  3.44  0.79
 assign ((resid  44 and name HG   ))   ((resid  45 and name HN   ))    5.49  3.69  0.82
 assign ((resid  44 and name HD1* ))   ((resid  45 and name HN   ))    4.87  3.07  0.73
 assign ((resid  44 and name HD2* ))   ((resid  45 and name HN   ))    4.23  2.43  0.63
 assign ((resid  46 and name HN   ))   ((resid  53 and name HN   ))    3.63  1.83  0.54
 assign ((resid  45 and name HA   ))   ((resid  46 and name HN   ))    2.85  1.05  0.43
 assign ((resid  46 and name HN   ))   ((resid  53 and name HB1  ))    5.57  3.77  0.84
 assign ((resid  45 and name HG2  ))   ((resid  46 and name HN   ))    3.92  2.12  0.59
 assign ((resid  45 and name HG1  ))   ((resid  46 and name HN   ))    3.92  2.12  0.59
 assign ((resid  46 and name HN   ))   ((resid  47 and name HN   ))    4.58  2.78  0.69
 assign ((resid  46 and name HA   ))   ((resid  47 and name HN   ))    2.93  1.13  0.44
 assign ((resid  46 and name HB2  ))   ((resid  47 and name HN   ))    4.28  2.48  0.64
 assign ((resid  46 and name HB1  ))   ((resid  47 and name HN   ))    4.34  2.54  0.65
 assign ((resid  46 and name HG   ))   ((resid  47 and name HN   ))    3.70  1.90  0.56
 assign ((resid  46 and name HD2* ))   ((resid  47 and name HN   ))    3.67  1.87  0.55
 assign ((resid  47 and name HN   ))   ((resid  48 and name HN   ))    4.66  2.86  0.70
 assign ((resid  47 and name HA   ))   ((resid  48 and name HN   ))    2.87  1.07  0.43
 assign ((resid  47 and name HB2  ))   ((resid  48 and name HN   ))    4.49  2.69  0.67
 assign ((resid  47 and name HB1  ))   ((resid  48 and name HN   ))    4.49  2.69  0.67
 assign ((resid  51 and name HA   ))   ((resid  52 and name HN   ))    3.02  1.22  0.45
 assign ((resid  70 and name HA   ))   ((resid  71 and name HN   ))    3.26  1.46  0.49
 assign ((resid  52 and name HA   ))   ((resid  53 and name HN   ))    2.86  1.06  0.43
 assign ((resid  52 and name HB2  ))   ((resid  53 and name HN   ))    4.36  2.56  0.65
 assign ((resid  52 and name HB1  ))   ((resid  53 and name HN   ))    4.36  2.56  0.65
 assign ((resid  52 and name HG2  ))   ((resid  53 and name HN   ))    4.31  2.51  0.65
 assign ((resid  52 and name HG1  ))   ((resid  53 and name HN   ))    4.31  2.51  0.65
 assign ((resid  52 and name HE2  ))   ((resid  53 and name HN   ))    6.00  4.20  0.90
 assign ((resid  52 and name HE1  ))   ((resid  53 and name HN   ))    6.00  4.20  0.90
 assign ((resid  53 and name HN   ))   ((resid  54 and name HN   ))    5.09  3.29  0.76
 assign ((resid  53 and name HA   ))   ((resid  54 and name HN   ))    3.02  1.22  0.45
 assign ((resid  53 and name HB2  ))   ((resid  54 and name HN   ))    4.49  2.69  0.67
 assign ((resid  53 and name HB1  ))   ((resid  54 and name HN   ))    3.95  2.15  0.59
 assign ((resid  54 and name HA   ))   ((resid  55 and name HN   ))    2.86  1.06  0.43
 assign ((resid  54 and name HB1  ))   ((resid  55 and name HN   ))    3.47  1.67  0.52
 assign ((resid  54 and name HB2  ))   ((resid  55 and name HN   ))    4.20  2.40  0.63
 assign ((resid  55 and name HN   ))   ((resid  56 and name HN   ))    4.48  2.68  0.67
 assign ((resid  55 and name HA   ))   ((resid  56 and name HN   ))    2.91  1.11  0.44
 assign ((resid  55 and name HB1  ))   ((resid  56 and name HN   ))    3.60  1.80  0.54
 assign ((resid  55 and name HB2  ))   ((resid  56 and name HN   ))    4.28  2.48  0.64
 assign ((resid  56 and name HN   ))   ((resid  57 and name HN   ))    4.30  2.50  0.65
 assign ((resid  56 and name HA   ))   ((resid  57 and name HN   ))    2.88  1.08  0.43
 assign ((resid  56 and name HB   ))   ((resid  57 and name HN   ))    4.48  2.68  0.67
 assign ((resid  56 and name HG2* ))   ((resid  57 and name HN   ))    3.42  1.62  0.51
 assign ((resid  57 and name HN   ))   ((resid  58 and name HN   ))    4.62  2.82  0.69
 assign ((resid  57 and name HA   ))   ((resid  58 and name HN   ))    2.99  1.19  0.45
 assign ((resid  58 and name HN   ))   ((resid  58 and name HB2  ))    3.22  1.42  0.48
 assign ((resid  58 and name HN   ))   ((resid  58 and name HG1  ))    3.67  1.87  0.55
 assign ((resid  57 and name HG1* ))   ((resid  58 and name HN   ))    3.20  1.40  0.48
 assign ((resid  39 and name HA   ))   ((resid  40 and name HN   ))    2.90  1.10  0.44
 assign ((resid  58 and name HA   ))   ((resid  59 and name HN   ))    3.08  1.28  0.46
 assign ((resid  59 and name HN   ))   ((resid  59 and name HB   ))    3.06  1.26  0.46
 assign ((resid  59 and name HN   ))   ((resid  60 and name HN   ))    4.68  2.88  0.70
 assign ((resid  59 and name HA   ))   ((resid  60 and name HN   ))    2.86  1.06  0.43
 assign ((resid  59 and name HG1* ))   ((resid  60 and name HN   ))    3.24  1.44  0.49
 assign ((resid  59 and name HG2* ))   ((resid  60 and name HN   ))    4.18  2.38  0.63
 assign ((resid  60 and name HN   ))   ((resid  61 and name HN   ))    4.59  2.79  0.69
 assign ((resid  60 and name HA   ))   ((resid  61 and name HN   ))    2.83  1.03  0.42
 assign ((resid  60 and name HB1  ))   ((resid  61 and name HN   ))    3.75  1.95  0.56
 assign ((resid  60 and name HB2  ))   ((resid  61 and name HN   ))    4.15  2.35  0.62
 assign ((resid  60 and name HG1  ))   ((resid  61 and name HN   ))    4.36  2.56  0.65
 assign ((resid  61 and name HA   ))   ((resid  62 and name HN   ))    2.80  1.00  0.42
 assign ((resid  61 and name HB1  ))   ((resid  62 and name HN   ))    4.28  2.48  0.64
 assign ((resid  61 and name HB2  ))   ((resid  62 and name HN   ))    4.36  2.56  0.65
 assign ((resid  61 and name HG2  ))   ((resid  62 and name HN   ))    4.36  2.56  0.65
 assign ((resid  61 and name HG1  ))   ((resid  62 and name HN   ))    3.85  2.05  0.58
 assign ((resid  61 and name HD2  ))   ((resid  62 and name HN   ))    4.46  2.66  0.67
 assign ((resid  61 and name HD1  ))   ((resid  62 and name HN   ))    4.18  2.38  0.63
 assign ((resid  64 and name HA   ))   ((resid  65 and name HN   ))    3.54  1.74  0.53
 assign ((resid  64 and name HB2  ))   ((resid  65 and name HN   ))    4.76  2.96  0.71
 assign ((resid  64 and name HB1  ))   ((resid  65 and name HN   ))    4.76  2.96  0.71
 assign ((resid  65 and name HA   ))   ((resid  66 and name HN   ))    3.20  1.40  0.48
 assign ((resid  65 and name HB   ))   ((resid  66 and name HN   ))    3.97  2.17  0.60
 assign ((resid  65 and name HG2* ))   ((resid  66 and name HN   ))    3.61  1.81  0.54
 assign ((resid  66 and name HA   ))   ((resid  67 and name HN   ))    2.93  1.13  0.44
 assign ((resid  66 and name HB1  ))   ((resid  67 and name HN   ))    3.84  2.04  0.58
 assign ((resid  67 and name HN   ))   ((resid  68 and name HN   ))    4.60  2.80  0.69
 assign ((resid  67 and name HA   ))   ((resid  68 and name HN   ))    2.96  1.16  0.44
 assign ((resid  67 and name HG2* ))   ((resid  68 and name HN   ))    4.10  2.30  0.62
 assign ((resid  68 and name HA   ))   ((resid  69 and name HN   ))    2.92  1.12  0.44
 assign ((resid  68 and name HB   ))   ((resid  69 and name HN   ))    4.63  2.83  0.69
 assign ((resid  68 and name HG1* ))   ((resid  69 and name HN   ))    3.31  1.51  0.50
 assign ((resid  69 and name HN   ))   ((resid  70 and name HN   ))    2.96  1.16  0.44
 assign ((resid  69 and name HB2  ))   ((resid  70 and name HN   ))    3.25  1.45  0.49
 assign ((resid  69 and name HB1  ))   ((resid  70 and name HN   ))    3.58  1.78  0.54
 assign ((resid  70 and name HN   ))   ((resid  71 and name HN   ))    4.61  2.81  0.69
 assign ((resid  71 and name HB   ))   ((resid  72 and name HN   ))    4.53  2.73  0.68
 assign ((resid  71 and name HG12 ))   ((resid  72 and name HN   ))    5.39  3.59  0.81
 assign ((resid  57 and name HG2* ))   ((resid  72 and name HN   ))    3.92  2.12  0.59
 assign ((resid  71 and name HG2* ))   ((resid  72 and name HN   ))    3.31  1.51  0.50
 assign ((resid  73 and name HA   ))   ((resid  74 and name HN   ))    2.95  1.15  0.44
 assign ((resid  73 and name HB2  ))   ((resid  74 and name HN   ))    4.35  2.55  0.65
 assign ((resid  73 and name HB1  ))   ((resid  74 and name HN   ))    4.32  2.52  0.65
 assign ((resid  73 and name HG2  ))   ((resid  74 and name HN   ))    4.03  2.23  0.60
 assign ((resid  73 and name HG1  ))   ((resid  74 and name HN   ))    4.03  2.23  0.60
 assign ((resid  73 and name HD2  ))   ((resid  74 and name HN   ))    5.14  3.34  0.77
 assign ((resid  73 and name HD1  ))   ((resid  74 and name HN   ))    5.14  3.34  0.77
 assign ((resid  74 and name HN   ))   ((resid  75 and name HN   ))    4.68  2.88  0.70
 assign ((resid  78 and name HA   ))   ((resid  79 and name HN   ))    3.56  1.76  0.53
 assign ((resid  78 and name HG   ))   ((resid  79 and name HN   ))    5.53  3.73  0.83
 assign ((resid  78 and name HD1* ))   ((resid  79 and name HN   ))    5.49  3.69  0.82
 assign ((resid  78 and name HD2* ))   ((resid  79 and name HN   ))    5.49  3.69  0.82
 assign ((resid  25 and name HA   ))   ((resid  25 and name HD21 ))    3.63  1.83  0.54
 assign ((resid  25 and name HA   ))   ((resid  25 and name HD22 ))    3.63  1.83  0.54
 assign ((resid  38 and name HA   ))   ((resid  38 and name HD21 ))    4.03  2.23  0.60
 assign ((resid  38 and name HA   ))   ((resid  38 and name HD22 ))    4.03  2.23  0.60
 assign ((resid  54 and name HA   ))   ((resid  54 and name HD21 ))    5.25  3.45  0.79
 assign ((resid  54 and name HN   ))   ((resid  54 and name HD22 ))    5.28  3.48  0.79
 assign ((resid  54 and name HA   ))   ((resid  54 and name HD22 ))    5.25  3.45  0.79
 assign ((resid   7 and name HA   ))   ((resid  10 and name HE21 ))    6.00  4.20  0.90
 assign ((resid  10 and name HA   ))   ((resid  10 and name HE21 ))    6.00  4.20  0.90
 assign ((resid  10 and name HB2  ))   ((resid  10 and name HE21 ))    5.65  3.85  0.85
 assign ((resid  10 and name HB1  ))   ((resid  10 and name HE21 ))    5.53  3.73  0.83
 assign ((resid  10 and name HG2  ))   ((resid  10 and name HE21 ))    4.03  2.23  0.60
 assign ((resid  10 and name HG1  ))   ((resid  10 and name HE21 ))    4.03  2.23  0.60
 assign ((resid   7 and name HA   ))   ((resid  10 and name HE22 ))    6.00  4.20  0.90
 assign ((resid  10 and name HA   ))   ((resid  10 and name HE22 ))    6.00  4.20  0.90
 assign ((resid  10 and name HB2  ))   ((resid  10 and name HE22 ))    5.65  3.85  0.85
 assign ((resid  10 and name HB1  ))   ((resid  10 and name HE22 ))    5.53  3.73  0.83
 assign ((resid  10 and name HG2  ))   ((resid  10 and name HE22 ))    4.03  2.23  0.60
 assign ((resid  10 and name HG1  ))   ((resid  10 and name HE22 ))    4.03  2.23  0.60
 assign ((resid  13 and name HB2  ))   ((resid  13 and name HE21 ))    4.92  3.12  0.74
 assign ((resid  13 and name HB1  ))   ((resid  13 and name HE21 ))    4.59  2.79  0.69
 assign ((resid  13 and name HG2  ))   ((resid  13 and name HE21 ))    3.37  1.57  0.51
 assign ((resid  13 and name HG2  ))   ((resid  13 and name HE22 ))    3.96  2.16  0.59
 assign ((resid  22 and name HB2  ))   ((resid  22 and name HE22 ))    4.99  3.19  0.75
 assign ((resid  29 and name HA   ))   ((resid  29 and name HE21 ))    4.03  2.23  0.60
 assign ((resid  29 and name HA   ))   ((resid  29 and name HE22 ))    4.03  2.23  0.60
 assign ((resid  34 and name HA   ))   ((resid  34 and name HE22 ))    4.59  2.79  0.69
 assign ((resid  36 and name HA   ))   ((resid  36 and name HE21 ))    5.56  3.76  0.83
 assign ((resid   5 and name HN   ))   ((resid   5 and name HB2  ))    3.74  1.94  0.56
 assign ((resid   5 and name HN   ))   ((resid   5 and name HG2  ))    4.70  2.90  0.70
 assign ((resid   5 and name HN   ))   ((resid   5 and name HG1  ))    4.70  2.90  0.70
 assign ((resid   5 and name HB1  ))   ((resid   6 and name HN   ))    4.43  2.63  0.66
 assign ((resid   7 and name HN   ))   ((resid   7 and name HB2  ))    3.77  1.97  0.57
 assign ((resid   7 and name HN   ))   ((resid   7 and name HG2  ))    3.85  2.05  0.58
 assign ((resid   7 and name HN   ))   ((resid   7 and name HG1  ))    3.85  2.05  0.58
 assign ((resid   8 and name HN   ))   ((resid   8 and name HB2  ))    3.06  1.26  0.46
 assign ((resid   8 and name HN   ))   ((resid   8 and name HB1  ))    3.68  1.88  0.55
 assign ((resid   8 and name HN   ))   ((resid   8 and name HD2  ))    3.21  1.41  0.48
 assign ((resid   8 and name HN   ))   ((resid   8 and name HD1  ))    3.60  1.80  0.54
 assign ((resid   8 and name HB1  ))   ((resid   9 and name HN   ))    4.14  2.34  0.62
 assign ((resid   9 and name HN   ))   ((resid   9 and name HG2  ))    4.56  2.76  0.68
 assign ((resid   9 and name HN   ))   ((resid   9 and name HG1  ))    4.56  2.76  0.68
 assign ((resid   9 and name HN   ))   ((resid   9 and name HD2  ))    5.12  3.32  0.77
 assign ((resid   9 and name HN   ))   ((resid   9 and name HD1  ))    5.12  3.32  0.77
 assign ((resid  10 and name HN   ))   ((resid  10 and name HB2  ))    3.20  1.40  0.48
 assign ((resid  10 and name HN   ))   ((resid  10 and name HB1  ))    3.77  1.97  0.57
 assign ((resid  10 and name HN   ))   ((resid  10 and name HG2  ))    3.94  2.14  0.59
 assign ((resid  10 and name HN   ))   ((resid  10 and name HG1  ))    3.94  2.14  0.59
 assign ((resid  11 and name HN   ))   ((resid  11 and name HB   ))    3.13  1.33  0.47
 assign ((resid  11 and name HN   ))   ((resid  11 and name HG1* ))    3.91  2.11  0.59
 assign ((resid  11 and name HN   ))   ((resid  11 and name HG2* ))    3.17  1.37  0.48
 assign ((resid  12 and name HN   ))   ((resid  12 and name HB1  ))    3.69  1.89  0.55
 assign ((resid  12 and name HN   ))   ((resid  12 and name HB2  ))    3.10  1.30  0.47
 assign ((resid  12 and name HN   ))   ((resid  12 and name HG2  ))    3.72  1.92  0.56
 assign ((resid  12 and name HN   ))   ((resid  12 and name HG1  ))    3.69  1.89  0.55
 assign ((resid  13 and name HN   ))   ((resid  13 and name HB2  ))    3.06  1.26  0.46
 assign ((resid  13 and name HN   ))   ((resid  13 and name HB1  ))    2.81  1.01  0.42
 assign ((resid  13 and name HN   ))   ((resid  13 and name HG2  ))    4.14  2.34  0.62
 assign ((resid  13 and name HN   ))   ((resid  13 and name HE21 ))    4.14  2.34  0.62
 assign ((resid  14 and name HN   ))   ((resid  14 and name HB   ))    2.96  1.16  0.44
 assign ((resid  14 and name HN   ))   ((resid  14 and name HG2* ))    2.97  1.17  0.45
 assign ((resid  15 and name HN   ))   ((resid  15 and name HB*  ))    2.93  1.13  0.44
 assign ((resid  16 and name HN   ))   ((resid  16 and name HB2  ))    3.61  1.81  0.54
 assign ((resid  16 and name HN   ))   ((resid  16 and name HB1  ))    3.05  1.25  0.46
 assign ((resid  16 and name HN   ))   ((resid  16 and name HG2  ))    3.59  1.79  0.54
 assign ((resid  16 and name HN   ))   ((resid  16 and name HG1  ))    4.24  2.44  0.64
 assign ((resid  16 and name HN   ))   ((resid  16 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  16 and name HN   ))   ((resid  16 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  17 and name HN   ))   ((resid  17 and name HB2  ))    3.04  1.24  0.46
 assign ((resid  17 and name HN   ))   ((resid  17 and name HB1  ))    3.66  1.86  0.55
 assign ((resid  17 and name HN   ))   ((resid  17 and name HG2  ))    3.67  1.87  0.55
 assign ((resid  17 and name HN   ))   ((resid  17 and name HG1  ))    3.67  1.87  0.55
 assign ((resid  18 and name HN   ))   ((resid  18 and name HB1  ))    3.62  1.82  0.54
 assign ((resid  18 and name HN   ))   ((resid  18 and name HB2  ))    3.03  1.23  0.45
 assign ((resid  18 and name HN   ))   ((resid  18 and name HG2  ))    3.78  1.98  0.57
 assign ((resid  18 and name HN   ))   ((resid  18 and name HG1  ))    3.87  2.07  0.58
 assign ((resid  18 and name HN   ))   ((resid  18 and name HD2  ))    4.32  2.52  0.65
 assign ((resid  18 and name HN   ))   ((resid  18 and name HD1  ))    4.32  2.52  0.65
 assign ((resid  19 and name HN   ))   ((resid  19 and name HB2  ))    2.84  1.04  0.43
 assign ((resid  19 and name HN   ))   ((resid  19 and name HD1* ))    4.04  2.24  0.61
 assign ((resid  19 and name HN   ))   ((resid  19 and name HD2* ))    4.37  2.57  0.66
 assign ((resid  20 and name HN   ))   ((resid  20 and name HB2  ))    3.08  1.28  0.46
 assign ((resid  19 and name HB2  ))   ((resid  20 and name HN   ))    3.15  1.35  0.47
 assign ((resid  20 and name HN   ))   ((resid  20 and name HG   ))    3.32  1.52  0.50
 assign ((resid  20 and name HN   ))   ((resid  28 and name HG2* ))    4.84  3.04  0.73
 assign ((resid  20 and name HN   ))   ((resid  20 and name HD1* ))    3.85  2.05  0.58
 assign ((resid  21 and name HN   ))   ((resid  21 and name HB2  ))    2.89  1.09  0.43
 assign ((resid  21 and name HN   ))   ((resid  21 and name HG2  ))    3.65  1.85  0.55
 assign ((resid  21 and name HN   ))   ((resid  21 and name HG1  ))    3.65  1.85  0.55
 assign ((resid  21 and name HB2  ))   ((resid  22 and name HN   ))    2.99  1.19  0.45
 assign ((resid  22 and name HN   ))   ((resid  22 and name HB2  ))    3.20  1.40  0.48
 assign ((resid  22 and name HN   ))   ((resid  22 and name HG2  ))    3.63  1.83  0.54
 assign ((resid  22 and name HN   ))   ((resid  22 and name HG1  ))    3.63  1.83  0.54
 assign ((resid  22 and name HN   ))   ((resid  23 and name HN   ))    2.87  1.07  0.43
 assign ((resid  23 and name HN   ))   ((resid  23 and name HB1  ))    3.45  1.65  0.52
 assign ((resid  23 and name HN   ))   ((resid  23 and name HB2  ))    3.33  1.53  0.50
 assign ((resid  26 and name HN   ))   ((resid  26 and name HB2  ))    3.85  2.05  0.58
 assign ((resid  26 and name HN   ))   ((resid  26 and name HB1  ))    3.85  2.05  0.58
 assign ((resid  26 and name HA   ))   ((resid  27 and name HN   ))    3.21  1.41  0.48
 assign ((resid  27 and name HN   ))   ((resid  27 and name HB2  ))    3.87  2.07  0.58
 assign ((resid  27 and name HN   ))   ((resid  27 and name HB1  ))    3.87  2.07  0.58
 assign ((resid  27 and name HN   ))   ((resid  27 and name HG2  ))    5.07  3.27  0.76
 assign ((resid  27 and name HN   ))   ((resid  46 and name HG   ))    5.51  3.71  0.83
 assign ((resid  27 and name HN   ))   ((resid  27 and name HG1  ))    5.07  3.27  0.76
 assign ((resid  27 and name HN   ))   ((resid  27 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  27 and name HN   ))   ((resid  27 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  28 and name HN   ))   ((resid  28 and name HB   ))    3.50  1.70  0.53
 assign ((resid  28 and name HN   ))   ((resid  28 and name HG2* ))    3.42  1.62  0.51
 assign ((resid  29 and name HN   ))   ((resid  45 and name HB1  ))    4.63  2.83  0.69
 assign ((resid  31 and name HN   ))   ((resid  31 and name HB2  ))    3.78  1.98  0.57
 assign ((resid  31 and name HN   ))   ((resid  31 and name HB1  ))    3.35  1.55  0.50
 assign ((resid  31 and name HN   ))   ((resid  44 and name HG   ))    3.95  2.15  0.59
 assign ((resid  31 and name HN   ))   ((resid  31 and name HD1  ))    5.45  3.65  0.82
 assign ((resid  33 and name HN   ))   ((resid  33 and name HB   ))    3.89  2.09  0.58
 assign ((resid  33 and name HN   ))   ((resid  33 and name HG1* ))    4.34  2.54  0.65
 assign ((resid  33 and name HN   ))   ((resid  33 and name HG2* ))    4.00  2.20  0.60
 assign ((resid  34 and name HN   ))   ((resid  34 and name HB2  ))    3.90  2.10  0.59
 assign ((resid  34 and name HN   ))   ((resid  34 and name HB1  ))    3.90  2.10  0.59
 assign ((resid  34 and name HN   ))   ((resid  34 and name HG2  ))    4.77  2.97  0.72
 assign ((resid  34 and name HN   ))   ((resid  34 and name HG1  ))    4.77  2.97  0.72
 assign ((resid  36 and name HN   ))   ((resid  40 and name HA   ))    3.87  2.07  0.58
 assign ((resid  36 and name HN   ))   ((resid  36 and name HB2  ))    3.85  2.05  0.58
 assign ((resid  36 and name HN   ))   ((resid  36 and name HB1  ))    3.85  2.05  0.58
 assign ((resid  36 and name HN   ))   ((resid  36 and name HG2  ))    5.71  3.91  0.86
 assign ((resid  36 and name HN   ))   ((resid  36 and name HG1  ))    5.71  3.91  0.86
 assign ((resid  39 and name HN   ))   ((resid  39 and name HB   ))    3.08  1.28  0.46
 assign ((resid  39 and name HN   ))   ((resid  39 and name HG2* ))    4.01  2.21  0.60
 assign ((resid  40 and name HN   ))   ((resid  40 and name HG12 ))    4.15  2.35  0.62
 assign ((resid  40 and name HN   ))   ((resid  40 and name HB   ))    3.30  1.50  0.50
 assign ((resid  40 and name HN   ))   ((resid  40 and name HG11 ))    3.63  1.83  0.54
 assign ((resid  40 and name HN   ))   ((resid  40 and name HG2* ))    4.03  2.23  0.60
 assign ((resid  41 and name HN   ))   ((resid  41 and name HB2  ))    3.43  1.63  0.51
 assign ((resid  41 and name HN   ))   ((resid  41 and name HB1  ))    3.79  1.99  0.57
 assign ((resid  41 and name HN   ))   ((resid  41 and name HG2  ))    4.12  2.32  0.62
 assign ((resid  41 and name HN   ))   ((resid  41 and name HG1  ))    4.35  2.55  0.65
 assign ((resid  41 and name HN   ))   ((resid  41 and name HD2  ))    5.39  3.59  0.81
 assign ((resid  41 and name HN   ))   ((resid  41 and name HD1  ))    5.39  3.59  0.81
 assign ((resid  43 and name HN   ))   ((resid  43 and name HB2  ))    3.57  1.77  0.54
 assign ((resid  44 and name HN   ))   ((resid  44 and name HB2  ))    3.39  1.59  0.51
 assign ((resid  44 and name HN   ))   ((resid  44 and name HG   ))    3.78  1.98  0.57
 assign ((resid  44 and name HN   ))   ((resid  44 and name HD1* ))    3.48  1.68  0.52
 assign ((resid  44 and name HN   ))   ((resid  44 and name HD2* ))    4.62  2.82  0.69
 assign ((resid  45 and name HN   ))   ((resid  45 and name HB2  ))    3.39  1.59  0.51
 assign ((resid  45 and name HN   ))   ((resid  45 and name HB1  ))    3.57  1.77  0.54
 assign ((resid  46 and name HN   ))   ((resid  46 and name HB2  ))    3.36  1.56  0.50
 assign ((resid  46 and name HN   ))   ((resid  46 and name HB1  ))    3.66  1.86  0.55
 assign ((resid  46 and name HN   ))   ((resid  46 and name HG   ))    4.63  2.83  0.69
 assign ((resid  46 and name HN   ))   ((resid  46 and name HD1* ))    4.71  2.91  0.71
 assign ((resid  46 and name HN   ))   ((resid  46 and name HD2* ))    5.05  3.25  0.76
 assign ((resid  47 and name HN   ))   ((resid  47 and name HB2  ))    3.93  2.13  0.59
 assign ((resid  47 and name HN   ))   ((resid  47 and name HB1  ))    3.93  2.13  0.59
 assign ((resid  47 and name HN   ))   ((resid  47 and name HG2  ))    4.17  2.37  0.63
 assign ((resid  47 and name HN   ))   ((resid  47 and name HG1  ))    4.17  2.37  0.63
 assign ((resid  47 and name HN   ))   ((resid  47 and name HD2  ))    5.24  3.44  0.79
 assign ((resid  47 and name HN   ))   ((resid  47 and name HD1  ))    5.24  3.44  0.79
 assign ((resid  48 and name HN   ))   ((resid  48 and name HB   ))    3.83  2.03  0.57
 assign ((resid  48 and name HN   ))   ((resid  48 and name HG2* ))    4.04  2.24  0.61
 assign ((resid  51 and name HN   ))   ((resid  51 and name HG2  ))    4.14  2.34  0.62
 assign ((resid  51 and name HN   ))   ((resid  51 and name HG1  ))    4.14  2.34  0.62
 assign ((resid  52 and name HN   ))   ((resid  52 and name HB2  ))    3.51  1.71  0.53
 assign ((resid  52 and name HN   ))   ((resid  52 and name HB1  ))    3.51  1.71  0.53
 assign ((resid  53 and name HN   ))   ((resid  53 and name HB2  ))    3.60  1.80  0.54
 assign ((resid  53 and name HN   ))   ((resid  53 and name HB1  ))    3.98  2.18  0.60
 assign ((resid  45 and name HG2  ))   ((resid  53 and name HN   ))    4.73  2.93  0.71
 assign ((resid  54 and name HN   ))   ((resid  54 and name HB1  ))    3.92  2.12  0.59
 assign ((resid  54 and name HN   ))   ((resid  54 and name HB2  ))    3.62  1.82  0.54
 assign ((resid  54 and name HN   ))   ((resid  54 and name HD21 ))    5.28  3.48  0.79
 assign ((resid  55 and name HN   ))   ((resid  55 and name HB2  ))    3.50  1.70  0.53
 assign ((resid  56 and name HN   ))   ((resid  56 and name HB   ))    3.29  1.49  0.49
 assign ((resid  56 and name HN   ))   ((resid  56 and name HG2* ))    4.11  2.31  0.62
 assign ((resid  57 and name HN   ))   ((resid  57 and name HB   ))    3.17  1.37  0.48
 assign ((resid  57 and name HN   ))   ((resid  57 and name HG2* ))    3.22  1.42  0.48
 assign ((resid  58 and name HN   ))   ((resid  58 and name HG2  ))    4.13  2.33  0.62
 assign ((resid  59 and name HN   ))   ((resid  59 and name HG1* ))    4.11  2.31  0.62
 assign ((resid  59 and name HN   ))   ((resid  59 and name HG2* ))    3.31  1.51  0.50
 assign ((resid  60 and name HN   ))   ((resid  60 and name HB1  ))    3.39  1.59  0.51
 assign ((resid  60 and name HN   ))   ((resid  60 and name HB2  ))    3.41  1.61  0.51
 assign ((resid  60 and name HN   ))   ((resid  60 and name HG1  ))    4.70  2.90  0.70
 assign ((resid  60 and name HN   ))   ((resid  60 and name HG2  ))    4.53  2.73  0.68
 assign ((resid  61 and name HN   ))   ((resid  61 and name HB1  ))    3.29  1.49  0.49
 assign ((resid  61 and name HN   ))   ((resid  61 and name HB2  ))    3.30  1.50  0.50
 assign ((resid  61 and name HN   ))   ((resid  61 and name HG2  ))    4.82  3.02  0.72
 assign ((resid  61 and name HN   ))   ((resid  61 and name HG1  ))    4.49  2.69  0.67
 assign ((resid  60 and name HG2  ))   ((resid  61 and name HN   ))    3.95  2.15  0.59
 assign ((resid  62 and name HN   ))   ((resid  62 and name HB2  ))    3.84  2.04  0.58
 assign ((resid  62 and name HN   ))   ((resid  62 and name HB1  ))    3.84  2.04  0.58
 assign ((resid  60 and name HG2  ))   ((resid  62 and name HN   ))    5.70  3.90  0.86
 assign ((resid  65 and name HN   ))   ((resid  65 and name HG2* ))    3.67  1.87  0.55
 assign ((resid  66 and name HN   ))   ((resid  66 and name HB2  ))    3.39  1.59  0.51
 assign ((resid  66 and name HN   ))   ((resid  66 and name HD1  ))    4.06  2.26  0.61
 assign ((resid  67 and name HN   ))   ((resid  67 and name HB   ))    3.45  1.65  0.52
 assign ((resid  67 and name HN   ))   ((resid  67 and name HG2* ))    3.77  1.97  0.57
 assign ((resid  68 and name HN   ))   ((resid  68 and name HB   ))    3.16  1.36  0.47
 assign ((resid  68 and name HN   ))   ((resid  68 and name HG2* ))    3.09  1.29  0.46
 assign ((resid  69 and name HN   ))   ((resid  69 and name HB2  ))    3.58  1.78  0.54
 assign ((resid  69 and name HN   ))   ((resid  69 and name HB1  ))    3.67  1.87  0.55
 assign ((resid  69 and name HN   ))   ((resid  69 and name HG2  ))    4.19  2.39  0.63
 assign ((resid  69 and name HN   ))   ((resid  69 and name HG1  ))    4.19  2.39  0.63
 assign ((resid  69 and name HN   ))   ((resid  69 and name HD2  ))    5.16  3.36  0.77
 assign ((resid  69 and name HN   ))   ((resid  69 and name HD1  ))    5.16  3.36  0.77
 assign ((resid  69 and name HN   ))   ((resid  69 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  69 and name HN   ))   ((resid  69 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  70 and name HN   ))   ((resid  70 and name HD2  ))    5.91  4.11  0.89
 assign ((resid  71 and name HN   ))   ((resid  71 and name HB   ))    3.29  1.49  0.49
 assign ((resid  71 and name HN   ))   ((resid  71 and name HG2* ))    4.00  2.20  0.60
 assign ((resid  71 and name HN   ))   ((resid  71 and name HD1* ))    4.43  2.63  0.66
 assign ((resid  71 and name HA   ))   ((resid  72 and name HN   ))    2.96  1.16  0.44
 assign ((resid  72 and name HN   ))   ((resid  72 and name HB   ))    3.59  1.79  0.54
 assign ((resid  74 and name HN   ))   ((resid  74 and name HB   ))    3.45  1.65  0.52
 assign ((resid  74 and name HN   ))   ((resid  74 and name HG2* ))    3.66  1.86  0.55
 assign ((resid  75 and name HN   ))   ((resid  75 and name HB   ))    4.21  2.41  0.63
 assign ((resid  75 and name HN   ))   ((resid  75 and name HG1* ))    4.43  2.63  0.66
 assign ((resid  75 and name HN   ))   ((resid  75 and name HG2* ))    4.43  2.63  0.66
 assign ((resid  79 and name HN   ))   ((resid  79 and name HB2  ))    4.02  2.22  0.60
 assign ((resid  79 and name HN   ))   ((resid  79 and name HB1  ))    4.02  2.22  0.60
 assign ((resid  79 and name HN   ))   ((resid  79 and name HG2  ))    4.46  2.66  0.67
 assign ((resid  79 and name HN   ))   ((resid  79 and name HG1  ))    4.46  2.66  0.67
 assign ((resid   5 and name HN   ))   ((resid   6 and name HN   ))    3.86  2.06  0.58
 assign ((resid  12 and name HN   ))   ((resid  13 and name HN   ))    3.33  1.53  0.50
 assign ((resid  14 and name HN   ))   ((resid  15 and name HN   ))    3.14  1.34  0.47
 assign ((resid  17 and name HN   ))   ((resid  18 and name HN   ))    3.28  1.48  0.49
 assign ((resid  18 and name HN   ))   ((resid  19 and name HN   ))    3.09  1.29  0.46
 assign ((resid  20 and name HN   ))   ((resid  21 and name HN   ))    3.27  1.47  0.49
 assign ((resid  27 and name HN   ))   ((resid  28 and name HN   ))    5.03  3.23  0.75
 assign ((resid  33 and name HN   ))   ((resid  34 and name HN   ))    5.42  3.62  0.81
 assign ((resid  39 and name HN   ))   ((resid  40 and name HN   ))    4.75  2.95  0.71
 assign ((resid  43 and name HN   ))   ((resid  44 and name HN   ))    4.57  2.77  0.69
 assign ((resid  45 and name HN   ))   ((resid  46 and name HN   ))    4.54  2.74  0.68
 assign ((resid  51 and name HN   ))   ((resid  52 and name HN   ))    4.96  3.16  0.74
 assign ((resid  52 and name HN   ))   ((resid  53 and name HN   ))    5.11  3.31  0.77
 assign ((resid  54 and name HN   ))   ((resid  55 and name HN   ))    4.67  2.87  0.70
 assign ((resid  57 and name HN   ))   ((resid  72 and name HN   ))    5.42  3.62  0.81
 assign ((resid  40 and name HN   ))   ((resid  60 and name HN   ))    5.70  3.90  0.86
 assign ((resid  65 and name HN   ))   ((resid  66 and name HN   ))    4.85  3.05  0.73
 assign ((resid  66 and name HN   ))   ((resid  67 and name HN   ))    5.07  3.27  0.76
 assign ((resid  68 and name HN   ))   ((resid  69 and name HN   ))    4.76  2.96  0.71
 assign ((resid  71 and name HN   ))   ((resid  72 and name HN   ))    4.75  2.95  0.71
 assign ((resid   5 and name HN   ))   ((resid   7 and name HN   ))    4.43  2.63  0.66
 assign ((resid   5 and name HA   ))   ((resid   7 and name HN   ))    4.22  2.42  0.63
 assign ((resid   7 and name HN   ))   ((resid   8 and name HN   ))    3.12  1.32  0.47
 assign ((resid   8 and name HN   ))   ((resid  11 and name HN   ))    6.00  4.20  0.90
 assign ((resid   7 and name HA   ))   ((resid   9 and name HN   ))    4.45  2.65  0.67
 assign ((resid   7 and name HN   ))   ((resid   9 and name HN   ))    4.46  2.66  0.67
 assign ((resid   6 and name HA   ))   ((resid   9 and name HN   ))    3.83  2.03  0.57
 assign ((resid   9 and name HN   ))   ((resid  10 and name HN   ))    3.25  1.45  0.49
 assign ((resid   8 and name HA   ))   ((resid  10 and name HN   ))    4.91  3.11  0.74
 assign ((resid   8 and name HN   ))   ((resid  10 and name HN   ))    5.70  3.90  0.86
 assign ((resid   6 and name HA   ))   ((resid  10 and name HN   ))    4.82  3.02  0.72
 assign ((resid  10 and name HN   ))   ((resid  12 and name HN   ))    4.78  2.98  0.72
 assign ((resid   9 and name HN   ))   ((resid  11 and name HN   ))    6.00  4.20  0.90
 assign ((resid  10 and name HA   ))   ((resid  12 and name HN   ))    4.89  3.09  0.73
 assign ((resid   9 and name HA   ))   ((resid  12 and name HN   ))    4.34  2.54  0.65
 assign ((resid  11 and name HA   ))   ((resid  13 and name HN   ))    4.79  2.99  0.72
 assign ((resid   9 and name HA   ))   ((resid  13 and name HN   ))    4.94  3.14  0.74
 assign ((resid  11 and name HN   ))   ((resid  13 and name HN   ))    4.39  2.59  0.66
 assign ((resid  13 and name HN   ))   ((resid  15 and name HN   ))    4.64  2.84  0.70
 assign ((resid  12 and name HA   ))   ((resid  14 and name HN   ))    4.99  3.19  0.75
 assign ((resid  11 and name HA   ))   ((resid  14 and name HN   ))    3.67  1.87  0.55
 assign ((resid  13 and name HA   ))   ((resid  15 and name HN   ))    4.73  2.93  0.71
 assign ((resid  12 and name HA   ))   ((resid  15 and name HN   ))    4.21  2.41  0.63
 assign ((resid  11 and name HA   ))   ((resid  15 and name HN   ))    4.35  2.55  0.65
 assign ((resid  13 and name HA   ))   ((resid  16 and name HN   ))    3.91  2.11  0.59
 assign ((resid  12 and name HA   ))   ((resid  16 and name HN   ))    4.67  2.87  0.70
 assign ((resid  15 and name HN   ))   ((resid  17 and name HN   ))    4.04  2.24  0.61
 assign ((resid  14 and name HA   ))   ((resid  17 and name HN   ))    4.25  2.45  0.64
 assign ((resid  15 and name HA   ))   ((resid  17 and name HN   ))    4.55  2.75  0.68
 assign ((resid  13 and name HA   ))   ((resid  17 and name HN   ))    4.45  2.65  0.67
 assign ((resid  17 and name HN   ))   ((resid  19 and name HN   ))    4.66  2.86  0.70
 assign ((resid  16 and name HA   ))   ((resid  18 and name HN   ))    4.84  3.04  0.73
 assign ((resid  16 and name HN   ))   ((resid  18 and name HN   ))    5.59  3.79  0.84
 assign ((resid  15 and name HA   ))   ((resid  18 and name HN   ))    3.54  1.74  0.53
 assign ((resid  18 and name HN   ))   ((resid  20 and name HN   ))    4.50  2.70  0.68
 assign ((resid  17 and name HA   ))   ((resid  19 and name HN   ))    4.86  3.06  0.73
 assign ((resid  16 and name HA   ))   ((resid  19 and name HN   ))    4.06  2.26  0.61
 assign ((resid  15 and name HA   ))   ((resid  19 and name HN   ))    4.58  2.78  0.69
 assign ((resid  18 and name HA   ))   ((resid  20 and name HN   ))    4.70  2.90  0.70
 assign ((resid  17 and name HA   ))   ((resid  20 and name HN   ))    3.77  1.97  0.57
 assign ((resid  16 and name HA   ))   ((resid  20 and name HN   ))    4.59  2.79  0.69
 assign ((resid  19 and name HN   ))   ((resid  21 and name HN   ))    4.70  2.90  0.70
 assign ((resid  21 and name HN   ))   ((resid  23 and name HN   ))    4.98  3.18  0.75
 assign ((resid  18 and name HA   ))   ((resid  21 and name HN   ))    3.87  2.07  0.58
 assign ((resid  17 and name HA   ))   ((resid  21 and name HN   ))    4.80  3.00  0.72
 assign ((resid  20 and name HN   ))   ((resid  22 and name HN   ))    4.65  2.85  0.70
 assign ((resid  18 and name HA   ))   ((resid  22 and name HN   ))    5.43  3.63  0.81
 assign ((resid   4 and name HA   ))   ((resid   6 and name HN   ))    4.31  2.51  0.65
 assign ((resid   7 and name HN   ))   ((resid   8 and name HD2  ))    5.04  3.24  0.76
 assign ((resid   7 and name HN   ))   ((resid   8 and name HD1  ))    5.50  3.70  0.83
 assign ((resid   8 and name HN   ))   ((resid  40 and name HD1* ))    5.40  3.60  0.81
 assign ((resid   8 and name HN   ))   ((resid  11 and name HG2* ))    5.18  3.38  0.78
 assign ((resid   5 and name HA   ))   ((resid   8 and name HN   ))    4.57  2.77  0.69
 assign ((resid   6 and name HA   ))   ((resid   8 and name HN   ))    5.28  3.48  0.79
 assign ((resid   9 and name HN   ))   ((resid  10 and name HB2  ))    6.00  4.20  0.90
 assign ((resid   9 and name HA   ))   ((resid  11 and name HN   ))    5.12  3.32  0.77
 assign ((resid   7 and name HA   ))   ((resid  11 and name HN   ))    4.16  2.36  0.62
 assign ((resid  10 and name HB2  ))   ((resid  11 and name HN   ))    3.44  1.64  0.52
 assign ((resid  10 and name HB1  ))   ((resid  11 and name HN   ))    3.77  1.97  0.57
 assign ((resid  12 and name HN   ))   ((resid  33 and name HG1* ))    5.03  3.23  0.75
 assign ((resid  12 and name HN   ))   ((resid  42 and name HG2* ))    5.19  3.39  0.78
 assign ((resid  11 and name HG1* ))   ((resid  12 and name HN   ))    3.94  2.14  0.59
 assign ((resid  11 and name HB   ))   ((resid  12 and name HN   ))    3.62  1.82  0.54
 assign ((resid  10 and name HB2  ))   ((resid  12 and name HN   ))    5.39  3.59  0.81
 assign ((resid  12 and name HN   ))   ((resid  13 and name HB1  ))    5.71  3.91  0.86
 assign ((resid  13 and name HN   ))   ((resid  14 and name HG2* ))    4.64  2.84  0.70
 assign ((resid  13 and name HN   ))   ((resid  42 and name HG1* ))    5.10  3.30  0.77
 assign ((resid  12 and name HB2  ))   ((resid  14 and name HN   ))    5.72  3.92  0.86
 assign ((resid  14 and name HN   ))   ((resid  16 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  14 and name HN   ))   ((resid  15 and name HB*  ))    4.56  2.76  0.68
 assign ((resid  11 and name HG1* ))   ((resid  14 and name HN   ))    5.19  3.39  0.78
 assign ((resid  11 and name HG2* ))   ((resid  14 and name HN   ))    5.11  3.31  0.77
 assign ((resid  15 and name HN   ))   ((resid  18 and name HG2  ))    5.45  3.65  0.82
 assign ((resid  15 and name HN   ))   ((resid  16 and name HB1  ))    4.52  2.72  0.68
 assign ((resid  15 and name HN   ))   ((resid  42 and name HG2* ))    4.29  2.49  0.64
 assign ((resid  16 and name HN   ))   ((resid  28 and name HG1* ))    4.77  2.97  0.72
 assign ((resid  16 and name HN   ))   ((resid  42 and name HG1* ))    4.99  3.19  0.75
 assign ((resid  16 and name HN   ))   ((resid  44 and name HD2* ))    4.12  2.32  0.62
 assign ((resid  14 and name HB   ))   ((resid  16 and name HN   ))    5.29  3.49  0.79
 assign ((resid  16 and name HN   ))   ((resid  17 and name HB2  ))    5.26  3.46  0.79
 assign ((resid  17 and name HN   ))   ((resid  18 and name HA   ))    5.43  3.63  0.81
 assign ((resid  15 and name HB*  ))   ((resid  17 and name HN   ))    4.80  3.00  0.72
 assign ((resid  17 and name HN   ))   ((resid  20 and name HD1* ))    4.42  2.62  0.66
 assign ((resid  14 and name HG1* ))   ((resid  18 and name HN   ))    5.05  3.25  0.76
 assign ((resid  18 and name HN   ))   ((resid  68 and name HG2* ))    5.31  3.51  0.80
 assign ((resid  19 and name HN   ))   ((resid  71 and name HG2* ))    4.46  2.66  0.67
 assign ((resid  19 and name HN   ))   ((resid  71 and name HD1* ))    4.46  2.66  0.67
 assign ((resid  17 and name HB2  ))   ((resid  19 and name HN   ))    5.38  3.58  0.81
 assign ((resid  19 and name HB1  ))   ((resid  22 and name HN   ))    5.71  3.91  0.86
 assign ((resid  20 and name HB1  ))   ((resid  22 and name HN   ))    6.00  4.20  0.90
 assign ((resid  22 and name HN   ))   ((resid  46 and name HD1* ))    5.22  3.42  0.78
 assign ((resid  22 and name HN   ))   ((resid  24 and name HD1  ))    4.52  2.72  0.68
 assign ((resid  22 and name HE21 ))   ((resid  71 and name HG2* ))    4.84  3.04  0.73
 assign ((resid  22 and name HE21 ))   ((resid  71 and name HD1* ))    5.10  3.30  0.77
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HE21 ))    5.29  3.49  0.79
 assign ((resid  22 and name HE22 ))   ((resid  71 and name HG2* ))    4.84  3.04  0.73
 assign ((resid  22 and name HE22 ))   ((resid  71 and name HD1* ))    5.10  3.30  0.77
 assign ((resid  19 and name HD1* ))   ((resid  22 and name HE22 ))    5.75  3.95  0.86
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HE22 ))    5.29  3.49  0.79
 assign ((resid  19 and name HD1* ))   ((resid  22 and name HE21 ))    5.75  3.95  0.86
 assign ((resid  23 and name HN   ))   ((resid  24 and name HB1  ))    5.08  3.28  0.76
 assign ((resid  19 and name HB1  ))   ((resid  23 and name HN   ))    5.71  3.91  0.86
 assign ((resid  20 and name HB1  ))   ((resid  23 and name HN   ))    6.00  4.20  0.90
 assign ((resid  23 and name HN   ))   ((resid  46 and name HD1* ))    4.08  2.28  0.61
 assign ((resid  19 and name HD2* ))   ((resid  23 and name HN   ))    5.41  3.61  0.81
 assign ((resid  23 and name HN   ))   ((resid  24 and name HD2  ))    3.95  2.15  0.59
 assign ((resid  24 and name HA   ))   ((resid  26 and name HN   ))    4.03  2.23  0.60
 assign ((resid  27 and name HN   ))   ((resid  47 and name HN   ))    3.82  2.02  0.57
 assign ((resid  27 and name HN   ))   ((resid  28 and name HA   ))    5.38  3.58  0.81
 assign ((resid  27 and name HN   ))   ((resid  28 and name HG2* ))    5.27  3.47  0.79
 assign ((resid  27 and name HN   ))   ((resid  46 and name HD2* ))    5.60  3.80  0.84
 assign ((resid  31 and name HN   ))   ((resid  44 and name HA   ))    3.53  1.73  0.53
 assign ((resid  31 and name HN   ))   ((resid  44 and name HD2* ))    4.72  2.92  0.71
 assign ((resid  32 and name HN   ))   ((resid  43 and name HA   ))    4.87  3.07  0.73
 assign ((resid  32 and name HN   ))   ((resid  44 and name HA   ))    5.14  3.34  0.77
 assign ((resid  30 and name HA   ))   ((resid  32 and name HN   ))    4.39  2.59  0.66
 assign ((resid  32 and name HN   ))   ((resid  43 and name HB1  ))    3.49  1.69  0.52
 assign ((resid  32 and name HN   ))   ((resid  43 and name HB2  ))    3.75  1.95  0.56
 assign ((resid  32 and name HN   ))   ((resid  43 and name HN   ))    3.68  1.88  0.55
 assign ((resid  34 and name HN   ))   ((resid  41 and name HB2  ))    4.24  2.44  0.64
 assign ((resid  34 and name HN   ))   ((resid  41 and name HB1  ))    4.96  3.16  0.74
 assign ((resid  34 and name HN   ))   ((resid  40 and name HG2* ))    3.71  1.91  0.56
 assign ((resid  36 and name HN   ))   ((resid  39 and name HN   ))    4.28  2.48  0.64
 assign ((resid  36 and name HN   ))   ((resid  39 and name HB   ))    4.62  2.82  0.69
 assign ((resid  36 and name HN   ))   ((resid  40 and name HG12 ))    4.36  2.56  0.65
 assign ((resid  36 and name HN   ))   ((resid  40 and name HG2* ))    5.01  3.21  0.75
 assign ((resid  36 and name HN   ))   ((resid  40 and name HD1* ))    5.46  3.66  0.82
 assign ((resid  40 and name HN   ))   ((resid  60 and name HA   ))    4.03  2.23  0.60
 assign ((resid  40 and name HN   ))   ((resid  59 and name HG1* ))    5.82  4.02  0.87
 assign ((resid  31 and name HN   ))   ((resid  43 and name HN   ))    4.70  2.90  0.70
 assign ((resid  31 and name HB1  ))   ((resid  43 and name HN   ))    4.74  2.94  0.71
 assign ((resid  43 and name HN   ))   ((resid  44 and name HG   ))    4.99  3.19  0.75
 assign ((resid  31 and name HN   ))   ((resid  44 and name HN   ))    4.94  3.14  0.74
 assign ((resid  44 and name HN   ))   ((resid  56 and name HG2* ))    5.50  3.70  0.83
 assign ((resid  44 and name HN   ))   ((resid  56 and name HA   ))    4.07  2.27  0.61
 assign ((resid  44 and name HN   ))   ((resid  54 and name HA   ))    5.05  3.25  0.76
 assign ((resid  44 and name HN   ))   ((resid  55 and name HB2  ))    4.83  3.03  0.72
 assign ((resid  44 and name HN   ))   ((resid  54 and name HB1  ))    5.43  3.63  0.81
 assign ((resid  44 and name HN   ))   ((resid  55 and name HB1  ))    5.78  3.98  0.87
 assign ((resid  31 and name HN   ))   ((resid  45 and name HN   ))    4.59  2.79  0.69
 assign ((resid  29 and name HN   ))   ((resid  45 and name HN   ))    3.63  1.83  0.54
 assign ((resid  30 and name HA   ))   ((resid  45 and name HN   ))    4.52  2.72  0.68
 assign ((resid  46 and name HN   ))   ((resid  54 and name HA   ))    4.11  2.31  0.62
 assign ((resid  46 and name HN   ))   ((resid  55 and name HD2  ))    4.48  2.68  0.67
 assign ((resid  46 and name HN   ))   ((resid  55 and name HN   ))    4.89  3.09  0.73
 assign ((resid  29 and name HN   ))   ((resid  46 and name HN   ))    5.94  4.14  0.89
 assign ((resid  46 and name HN   ))   ((resid  54 and name HN   ))    6.00  4.20  0.90
 assign ((resid  26 and name HB2  ))   ((resid  47 and name HN   ))    5.03  3.23  0.75
 assign ((resid  26 and name HB1  ))   ((resid  47 and name HN   ))    5.03  3.23  0.75
 assign ((resid  48 and name HN   ))   ((resid  51 and name HN   ))    3.75  1.95  0.56
 assign ((resid  48 and name HN   ))   ((resid  52 and name HA   ))    4.32  2.52  0.65
 assign ((resid  46 and name HD2* ))   ((resid  48 and name HN   ))    4.72  2.92  0.71
 assign ((resid  48 and name HG2* ))   ((resid  49 and name HD21 ))    5.03  3.23  0.75
 assign ((resid  48 and name HG2* ))   ((resid  49 and name HD22 ))    5.03  3.23  0.75
 assign ((resid  48 and name HG2* ))   ((resid  51 and name HN   ))    5.01  3.21  0.75
 assign ((resid  47 and name HA   ))   ((resid  51 and name HN   ))    4.78  2.98  0.72
 assign ((resid  46 and name HD2* ))   ((resid  53 and name HN   ))    5.33  3.53  0.80
 assign ((resid  47 and name HA   ))   ((resid  53 and name HN   ))    4.20  2.40  0.63
 assign ((resid  54 and name HN   ))   ((resid  55 and name HE2  ))    5.36  3.56  0.80
 assign ((resid  54 and name HN   ))   ((resid  55 and name HD2  ))    5.67  3.87  0.85
 assign ((resid  54 and name HN   ))   ((resid  74 and name HB   ))    5.21  3.41  0.78
 assign ((resid  45 and name HA   ))   ((resid  55 and name HN   ))    3.91  2.11  0.59
 assign ((resid  55 and name HN   ))   ((resid  73 and name HA   ))    5.61  3.81  0.84
 assign ((resid  43 and name HB1  ))   ((resid  55 and name HN   ))    5.97  4.17  0.90
 assign ((resid  45 and name HB2  ))   ((resid  55 and name HN   ))    6.00  4.20  0.90
 assign ((resid  55 and name HN   ))   ((resid  74 and name HG2* ))    5.14  3.34  0.77
 assign ((resid  44 and name HD1* ))   ((resid  55 and name HN   ))    4.37  2.57  0.66
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HN   ))    4.99  3.19  0.75
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HN   ))    5.09  3.29  0.76
 assign ((resid  44 and name HN   ))   ((resid  55 and name HN   ))    3.82  2.02  0.57
 assign ((resid  56 and name HN   ))   ((resid  73 and name HA   ))    3.99  2.19  0.60
 assign ((resid  56 and name HN   ))   ((resid  72 and name HG2* ))    4.57  2.77  0.69
 assign ((resid  56 and name HN   ))   ((resid  71 and name HG2* ))    4.15  2.35  0.62
 assign ((resid  41 and name HA   ))   ((resid  57 and name HN   ))    5.12  3.32  0.77
 assign ((resid  43 and name HA   ))   ((resid  57 and name HN   ))    4.05  2.25  0.61
 assign ((resid  43 and name HN   ))   ((resid  57 and name HN   ))    5.43  3.63  0.81
 assign ((resid  41 and name HG2  ))   ((resid  57 and name HN   ))    6.00  4.20  0.90
 assign ((resid  44 and name HG   ))   ((resid  57 and name HN   ))    6.00  4.20  0.90
 assign ((resid  15 and name HB*  ))   ((resid  57 and name HN   ))    4.46  2.66  0.67
 assign ((resid  44 and name HD1* ))   ((resid  57 and name HN   ))    3.81  2.01  0.57
 assign ((resid  56 and name HG2* ))   ((resid  58 and name HN   ))    4.51  2.71  0.68
 assign ((resid  39 and name HG2* ))   ((resid  41 and name HN   ))    4.65  2.85  0.70
 assign ((resid  40 and name HN   ))   ((resid  41 and name HG1  ))    5.65  3.85  0.85
 assign ((resid  11 and name HG1* ))   ((resid  40 and name HN   ))    5.23  3.43  0.78
 assign ((resid  11 and name HG1* ))   ((resid  59 and name HN   ))    5.51  3.71  0.83
 assign ((resid  60 and name HN   ))   ((resid  68 and name HA   ))    3.90  2.10  0.59
 assign ((resid  60 and name HN   ))   ((resid  67 and name HB   ))    5.39  3.59  0.81
 assign ((resid  60 and name HN   ))   ((resid  66 and name HE3  ))    4.54  2.74  0.68
 assign ((resid  60 and name HN   ))   ((resid  67 and name HG2* ))    4.57  2.77  0.69
 assign ((resid  39 and name HA   ))   ((resid  61 and name HN   ))    4.18  2.38  0.63
 assign ((resid  61 and name HN   ))   ((resid  66 and name HE3  ))    4.32  2.52  0.65
 assign ((resid  61 and name HN   ))   ((resid  62 and name HN   ))    4.59  2.79  0.69
 assign ((resid  62 and name HN   ))   ((resid  67 and name HN   ))    4.37  2.57  0.66
 assign ((resid  62 and name HN   ))   ((resid  66 and name HE3  ))    4.67  2.87  0.70
 assign ((resid  62 and name HN   ))   ((resid  66 and name HA   ))    3.67  1.87  0.55
 assign ((resid  62 and name HN   ))   ((resid  67 and name HG2* ))    4.30  2.50  0.65
 assign ((resid  62 and name HE21 ))   ((resid  67 and name HG2* ))    5.12  3.32  0.77
 assign ((resid  62 and name HE22 ))   ((resid  67 and name HG2* ))    5.12  3.32  0.77
 assign ((resid  62 and name HN   ))   ((resid  65 and name HN   ))    3.82  2.02  0.57
 assign ((resid  63 and name HA2  ))   ((resid  65 and name HN   ))    4.92  3.12  0.74
 assign ((resid  63 and name HA1  ))   ((resid  65 and name HN   ))    4.92  3.12  0.74
 assign ((resid  61 and name HD2  ))   ((resid  65 and name HN   ))    5.19  3.39  0.78
 assign ((resid  61 and name HD1  ))   ((resid  65 and name HN   ))    5.54  3.74  0.83
 assign ((resid  62 and name HB2  ))   ((resid  65 and name HN   ))    4.93  3.13  0.74
 assign ((resid  62 and name HB1  ))   ((resid  65 and name HN   ))    4.93  3.13  0.74
 assign ((resid  61 and name HG1  ))   ((resid  65 and name HN   ))    4.64  2.84  0.70
 assign ((resid  14 and name HG2* ))   ((resid  66 and name HN   ))    4.84  3.04  0.73
 assign ((resid  14 and name HG1* ))   ((resid  66 and name HN   ))    5.07  3.27  0.76
 assign ((resid  60 and name HA   ))   ((resid  67 and name HN   ))    5.03  3.23  0.75
 assign ((resid  60 and name HG2  ))   ((resid  67 and name HN   ))    5.29  3.49  0.79
 assign ((resid  60 and name HB1  ))   ((resid  67 and name HN   ))    4.64  2.84  0.70
 assign ((resid  62 and name HB2  ))   ((resid  67 and name HN   ))    5.54  3.74  0.83
 assign ((resid  62 and name HB1  ))   ((resid  67 and name HN   ))    5.54  3.74  0.83
 assign ((resid  59 and name HA   ))   ((resid  68 and name HN   ))    5.31  3.51  0.80
 assign ((resid  59 and name HG1* ))   ((resid  67 and name HN   ))    3.64  1.84  0.55
 assign ((resid  59 and name HG2* ))   ((resid  67 and name HN   ))    5.57  3.77  0.84
 assign ((resid  67 and name HN   ))   ((resid  68 and name HG2* ))    5.87  4.07  0.88
 assign ((resid  66 and name HB2  ))   ((resid  68 and name HN   ))    6.00  4.20  0.90
 assign ((resid  66 and name HB1  ))   ((resid  68 and name HN   ))    6.00  4.20  0.90
 assign ((resid  59 and name HA   ))   ((resid  69 and name HN   ))    3.44  1.64  0.52
 assign ((resid  58 and name HN   ))   ((resid  69 and name HN   ))    5.01  3.21  0.75
 assign ((resid  67 and name HG2* ))   ((resid  69 and name HN   ))    4.72  2.92  0.71
 assign ((resid  59 and name HG1* ))   ((resid  69 and name HN   ))    4.38  2.58  0.66
 assign ((resid  58 and name HN   ))   ((resid  70 and name HN   ))    3.64  1.84  0.55
 assign ((resid  57 and name HA   ))   ((resid  70 and name HN   ))    5.13  3.33  0.77
 assign ((resid  59 and name HA   ))   ((resid  70 and name HN   ))    5.02  3.22  0.75
 assign ((resid  58 and name HB2  ))   ((resid  70 and name HN   ))    3.70  1.90  0.56
 assign ((resid  68 and name HG1* ))   ((resid  70 and name HN   ))    3.16  1.36  0.47
 assign ((resid  55 and name HA   ))   ((resid  72 and name HN   ))    5.42  3.62  0.81
 assign ((resid  55 and name HD1  ))   ((resid  72 and name HN   ))    5.20  3.40  0.78
 assign ((resid  56 and name HN   ))   ((resid  72 and name HN   ))    3.88  2.08  0.58
 assign ((resid  55 and name HB1  ))   ((resid  72 and name HN   ))    4.82  3.02  0.72
 assign ((resid  56 and name HG2* ))   ((resid  72 and name HN   ))    5.13  3.33  0.77
 assign ((resid  55 and name HN   ))   ((resid  74 and name HN   ))    5.32  3.52  0.80
 assign ((resid  56 and name HN   ))   ((resid  74 and name HN   ))    4.89  3.09  0.73
 assign ((resid  55 and name HA   ))   ((resid  74 and name HN   ))    3.53  1.73  0.53
 assign ((resid  55 and name HB1  ))   ((resid  74 and name HN   ))    5.40  3.60  0.81
 assign ((resid  54 and name HB2  ))   ((resid  74 and name HN   ))    4.73  2.93  0.71
 assign ((resid  10 and name HN   ))   ((resid  13 and name HN   ))    5.35  3.55  0.80
 assign ((resid  10 and name HN   ))   ((resid  11 and name HG1* ))    6.00  4.20  0.90
 assign ((resid  10 and name HN   ))   ((resid  11 and name HG2* ))    4.64  2.84  0.70
 assign ((resid  26 and name HN   ))   ((resid  46 and name HG   ))    6.00  4.20  0.90
 assign ((resid  39 and name HN   ))   ((resid  40 and name HG11 ))    5.39  3.59  0.81
 assign ((resid  36 and name HB1  ))   ((resid  39 and name HN   ))    5.04  3.24  0.76
 assign ((resid  36 and name HB2  ))   ((resid  39 and name HN   ))    5.04  3.24  0.76
 assign ((resid  43 and name HN   ))   ((resid  56 and name HG2* ))    5.31  3.51  0.80
 assign ((resid  26 and name HA   ))   ((resid  47 and name HN   ))    5.13  3.33  0.77
 assign ((resid  40 and name HN   ))   ((resid  61 and name HN   ))    5.26  3.46  0.79
 assign ((resid  59 and name HG1* ))   ((resid  68 and name HN   ))    4.79  2.99  0.72
 assign ((resid  20 and name HA   ))   ((resid  23 and name HN   ))    3.35  1.55  0.50
 assign ((resid  34 and name HN   ))   ((resid  42 and name HA   ))    4.24  2.44  0.64
 assign ((resid  33 and name HA   ))   ((resid  43 and name HN   ))    3.96  2.16  0.59
 assign ((resid  11 and name HN   ))   ((resid  66 and name HE1  ))    5.20  3.40  0.78
 assign ((resid   7 and name HA   ))   ((resid  66 and name HE1  ))    4.26  2.46  0.64
 assign ((resid  66 and name HB2  ))   ((resid  66 and name HE1  ))    4.87  3.07  0.73
 assign ((resid  61 and name HD2  ))   ((resid  66 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  10 and name HB2  ))   ((resid  66 and name HE1  ))    3.63  1.83  0.54
 assign ((resid  40 and name HD1* ))   ((resid  66 and name HE1  ))    5.12  3.32  0.77
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HE1  ))    5.72  3.92  0.86
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HE1  ))    4.47  2.67  0.67
 assign ((resid  18 and name HN   ))   ((resid  71 and name HD1* ))    4.83  3.03  0.72
 assign ((resid  31 and name HN   ))   ((resid  43 and name HB1  ))    4.45  2.65  0.67
 assign ((resid  33 and name HG1* ))   ((resid  41 and name HN   ))    4.98  3.18  0.75
 assign ((resid  41 and name HN   ))   ((resid  42 and name HG2* ))    5.53  3.73  0.83
 assign ((resid  31 and name HB2  ))   ((resid  45 and name HN   ))    4.79  2.99  0.72
 assign ((resid   7 and name HN   ))   ((resid   8 and name HB2  ))    5.03  3.23  0.75
 assign ((resid  20 and name HB2  ))   ((resid  22 and name HN   ))    5.31  3.51  0.80
 assign ((resid   5 and name HA   ))   ((resid   5 and name HG2  ))    4.10  2.30  0.62
 assign ((resid   5 and name HA   ))   ((resid   5 and name HG1  ))    4.10  2.30  0.62
 assign ((resid   6 and name HN   ))   ((resid   6 and name HG2  ))    5.25  3.45  0.79
 assign ((resid   6 and name HN   ))   ((resid   6 and name HG1  ))    5.25  3.45  0.79
 assign ((resid   7 and name HA   ))   ((resid   7 and name HG1  ))    3.95  2.15  0.59
 assign ((resid   7 and name HN   ))   ((resid   7 and name HB1  ))    3.77  1.97  0.57
 assign ((resid   7 and name HA   ))   ((resid   7 and name HG2  ))    3.95  2.15  0.59
 assign ((resid   8 and name HA   ))   ((resid   8 and name HG2  ))    3.87  2.07  0.58
 assign ((resid   8 and name HA   ))   ((resid   8 and name HD2  ))    3.80  2.00  0.57
 assign ((resid   8 and name HN   ))   ((resid   8 and name HE2  ))    5.87  4.07  0.88
 assign ((resid   8 and name HN   ))   ((resid   8 and name HE1  ))    5.87  4.07  0.88
 assign ((resid   9 and name HA   ))   ((resid   9 and name HG1  ))    3.95  2.15  0.59
 assign ((resid   9 and name HA   ))   ((resid   9 and name HD2  ))    5.35  3.55  0.80
 assign ((resid   9 and name HA   ))   ((resid   9 and name HD1  ))    5.35  3.55  0.80
 assign ((resid  10 and name HA   ))   ((resid  10 and name HG1  ))    3.90  2.10  0.59
 assign ((resid  13 and name HA   ))   ((resid  13 and name HG2  ))    4.11  2.31  0.62
 assign ((resid  10 and name HA   ))   ((resid  10 and name HG2  ))    3.90  2.10  0.59
 assign ((resid  11 and name HG1* ))   ((resid  15 and name HN   ))    4.57  2.77  0.69
 assign ((resid  11 and name HA   ))   ((resid  11 and name HG1* ))    3.50  1.70  0.53
 assign ((resid  11 and name HA   ))   ((resid  11 and name HG2* ))    3.45  1.65  0.52
 assign ((resid  12 and name HA   ))   ((resid  12 and name HG1  ))    3.68  1.88  0.55
 assign ((resid  12 and name HA   ))   ((resid  12 and name HG2  ))    3.73  1.93  0.56
 assign ((resid  12 and name HA   ))   ((resid  12 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  12 and name HA   ))   ((resid  12 and name HE1  ))    6.00  4.20  0.90
 assign ((resid   8 and name HB2  ))   ((resid   8 and name HD1  ))    3.00  1.20  0.45
 assign ((resid  12 and name HN   ))   ((resid  12 and name HD2  ))    5.86  4.06  0.88
 assign ((resid  12 and name HN   ))   ((resid  12 and name HD1  ))    5.86  4.06  0.88
 assign ((resid  12 and name HB1  ))   ((resid  12 and name HE2  ))    4.72  2.92  0.71
 assign ((resid  12 and name HB1  ))   ((resid  12 and name HE1  ))    4.72  2.92  0.71
 assign ((resid  12 and name HB2  ))   ((resid  12 and name HE2  ))    4.54  2.74  0.68
 assign ((resid  12 and name HB2  ))   ((resid  12 and name HE1  ))    4.54  2.74  0.68
 assign ((resid  21 and name HA   ))   ((resid  21 and name HB1  ))    2.78  0.98  0.42
 assign ((resid  10 and name HA   ))   ((resid  13 and name HB1  ))    3.59  1.79  0.54
 assign ((resid  13 and name HA   ))   ((resid  13 and name HG1  ))    3.30  1.50  0.50
 assign ((resid  13 and name HB2  ))   ((resid  13 and name HG1  ))    2.99  1.19  0.45
 assign ((resid  13 and name HB1  ))   ((resid  13 and name HG2  ))    2.68  0.88  0.40
 assign ((resid  14 and name HN   ))   ((resid  14 and name HG1* ))    3.80  2.00  0.57
 assign ((resid  14 and name HA   ))   ((resid  14 and name HG1* ))    3.27  1.47  0.49
 assign ((resid  14 and name HA   ))   ((resid  14 and name HG2* ))    3.15  1.35  0.47
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HE2  ))    5.42  3.62  0.81
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HE1  ))    5.42  3.62  0.81
 assign ((resid  16 and name HB1  ))   ((resid  16 and name HE2  ))    5.38  3.58  0.81
 assign ((resid  16 and name HB1  ))   ((resid  16 and name HE1  ))    5.38  3.58  0.81
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HD2  ))    4.13  2.33  0.62
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HD1  ))    4.13  2.33  0.62
 assign ((resid  16 and name HA   ))   ((resid  16 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  16 and name HA   ))   ((resid  16 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  17 and name HA   ))   ((resid  17 and name HG2  ))    3.76  1.96  0.56
 assign ((resid  17 and name HA   ))   ((resid  17 and name HG1  ))    3.76  1.96  0.56
 assign ((resid  18 and name HA   ))   ((resid  18 and name HG2  ))    4.07  2.27  0.61
 assign ((resid  18 and name HA   ))   ((resid  18 and name HG1  ))    4.09  2.29  0.61
 assign ((resid  18 and name HA   ))   ((resid  18 and name HD2  ))    3.61  1.81  0.54
 assign ((resid  18 and name HA   ))   ((resid  18 and name HD1  ))    3.61  1.81  0.54
 assign ((resid  18 and name HB2  ))   ((resid  18 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  18 and name HB2  ))   ((resid  18 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  18 and name HN   ))   ((resid  18 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  18 and name HN   ))   ((resid  18 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  18 and name HA   ))   ((resid  18 and name HE2  ))    5.33  3.53  0.80
 assign ((resid  18 and name HA   ))   ((resid  18 and name HE1  ))    5.33  3.53  0.80
 assign ((resid  18 and name HG1  ))   ((resid  18 and name HE2  ))    3.97  2.17  0.60
 assign ((resid  19 and name HA   ))   ((resid  19 and name HD1* ))    3.90  2.10  0.59
 assign ((resid  19 and name HB1  ))   ((resid  19 and name HD1* ))    4.22  2.42  0.63
 assign ((resid  19 and name HA   ))   ((resid  19 and name HG   ))    4.14  2.34  0.62
 assign ((resid  19 and name HB2  ))   ((resid  19 and name HD1* ))    3.39  1.59  0.51
 assign ((resid  19 and name HA   ))   ((resid  19 and name HD2* ))    3.37  1.57  0.51
 assign ((resid  19 and name HB1  ))   ((resid  19 and name HD2* ))    3.59  1.79  0.54
 assign ((resid  20 and name HA   ))   ((resid  20 and name HG   ))    3.82  2.02  0.57
 assign ((resid  20 and name HA   ))   ((resid  20 and name HD2* ))    3.00  1.20  0.45
 assign ((resid  20 and name HN   ))   ((resid  20 and name HB1  ))    3.78  1.98  0.57
 assign ((resid  20 and name HB2  ))   ((resid  20 and name HG   ))    3.01  1.21  0.45
 assign ((resid  20 and name HA   ))   ((resid  20 and name HD1* ))    4.21  2.41  0.63
 assign ((resid  20 and name HB2  ))   ((resid  20 and name HD1* ))    3.28  1.48  0.49
 assign ((resid  20 and name HB1  ))   ((resid  20 and name HD1* ))    3.25  1.45  0.49
 assign ((resid  20 and name HN   ))   ((resid  20 and name HD2* ))    4.22  2.42  0.63
 assign ((resid  20 and name HB2  ))   ((resid  20 and name HD2* ))    3.45  1.65  0.52
 assign ((resid  20 and name HB1  ))   ((resid  20 and name HD2* ))    3.13  1.33  0.47
 assign ((resid  13 and name HA   ))   ((resid  13 and name HB2  ))    2.94  1.14  0.44
 assign ((resid  21 and name HA   ))   ((resid  21 and name HG1  ))    3.76  1.96  0.56
 assign ((resid  21 and name HB2  ))   ((resid  21 and name HG2  ))    2.96  1.16  0.44
 assign ((resid  21 and name HA   ))   ((resid  21 and name HG2  ))    3.76  1.96  0.56
 assign ((resid  21 and name HB2  ))   ((resid  21 and name HG1  ))    2.96  1.16  0.44
 assign ((resid  22 and name HA   ))   ((resid  22 and name HG2  ))    3.90  2.10  0.59
 assign ((resid  22 and name HA   ))   ((resid  22 and name HG1  ))    3.90  2.10  0.59
 assign ((resid  22 and name HB2  ))   ((resid  22 and name HE21 ))    4.99  3.19  0.75
 assign ((resid  27 and name HA   ))   ((resid  27 and name HD2  ))    5.35  3.55  0.80
 assign ((resid  27 and name HA   ))   ((resid  27 and name HD1  ))    5.35  3.55  0.80
 assign ((resid  28 and name HA   ))   ((resid  28 and name HG1* ))    3.62  1.82  0.54
 assign ((resid  28 and name HA   ))   ((resid  28 and name HG2* ))    3.89  2.09  0.58
 assign ((resid  16 and name HB2  ))   ((resid  28 and name HG1* ))    3.26  1.46  0.49
 assign ((resid  30 and name HA   ))   ((resid  30 and name HG1* ))    3.29  1.49  0.49
 assign ((resid  30 and name HA   ))   ((resid  30 and name HG2* ))    3.29  1.49  0.49
 assign ((resid  31 and name HA   ))   ((resid  31 and name HG2  ))    3.99  2.19  0.60
 assign ((resid  31 and name HA   ))   ((resid  31 and name HG1  ))    3.99  2.19  0.60
 assign ((resid  31 and name HA   ))   ((resid  31 and name HD1  ))    3.88  2.08  0.58
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HG2  ))    2.70  0.90  0.41
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HG1  ))    2.70  0.90  0.41
 assign ((resid  31 and name HN   ))   ((resid  31 and name HD2  ))    5.45  3.65  0.82
 assign ((resid  31 and name HA   ))   ((resid  31 and name HD2  ))    3.88  2.08  0.58
 assign ((resid  31 and name HB2  ))   ((resid  31 and name HD2  ))    4.06  2.26  0.61
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HD2  ))    3.85  2.05  0.58
 assign ((resid  31 and name HB2  ))   ((resid  31 and name HD1  ))    4.06  2.26  0.61
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HD1  ))    3.85  2.05  0.58
 assign ((resid  32 and name HA   ))   ((resid  32 and name HG1  ))    4.25  2.45  0.64
 assign ((resid  32 and name HN   ))   ((resid  32 and name HD2  ))    6.00  4.20  0.90
 assign ((resid  70 and name HA   ))   ((resid  70 and name HD1  ))    5.28  3.48  0.79
 assign ((resid  32 and name HN   ))   ((resid  32 and name HD1  ))    6.00  4.20  0.90
 assign ((resid  47 and name HB2  ))   ((resid  47 and name HD1  ))    3.73  1.93  0.56
 assign ((resid  33 and name HA   ))   ((resid  33 and name HG1* ))    3.39  1.59  0.51
 assign ((resid  33 and name HA   ))   ((resid  33 and name HG2* ))    3.33  1.53  0.50
 assign ((resid  42 and name HG2* ))   ((resid  59 and name HG2* ))    2.80  1.00  0.42
 assign ((resid  34 and name HA   ))   ((resid  34 and name HE21 ))    4.59  2.79  0.69
 assign ((resid  35 and name HA   ))   ((resid  35 and name HE2  ))    5.98  4.18  0.90
 assign ((resid  35 and name HA   ))   ((resid  35 and name HE1  ))    5.98  4.18  0.90
 assign ((resid  15 and name HB*  ))   ((resid  57 and name HB   ))    3.38  1.58  0.51
 assign ((resid  35 and name HB2  ))   ((resid  35 and name HD2  ))    3.83  2.03  0.57
 assign ((resid  35 and name HB2  ))   ((resid  35 and name HD1  ))    3.83  2.03  0.57
 assign ((resid  35 and name HB1  ))   ((resid  35 and name HD1  ))    3.83  2.03  0.57
 assign ((resid  35 and name HB1  ))   ((resid  35 and name HE2  ))    5.68  3.88  0.85
 assign ((resid  35 and name HB1  ))   ((resid  35 and name HE1  ))    5.68  3.88  0.85
 assign ((resid  35 and name HB1  ))   ((resid  35 and name HD2  ))    3.83  2.03  0.57
 assign ((resid  35 and name HB2  ))   ((resid  35 and name HE2  ))    5.68  3.88  0.85
 assign ((resid  35 and name HB2  ))   ((resid  35 and name HE1  ))    5.68  3.88  0.85
 assign ((resid  36 and name HA   ))   ((resid  36 and name HG2  ))    4.23  2.43  0.63
 assign ((resid  36 and name HA   ))   ((resid  36 and name HG1  ))    4.23  2.43  0.63
 assign ((resid  36 and name HA   ))   ((resid  36 and name HE22 ))    5.56  3.76  0.83
 assign ((resid  39 and name HA   ))   ((resid  39 and name HG2* ))    3.20  1.40  0.48
 assign ((resid  40 and name HA   ))   ((resid  40 and name HG12 ))    4.04  2.24  0.61
 assign ((resid  40 and name HA   ))   ((resid  40 and name HG11 ))    3.92  2.12  0.59
 assign ((resid  40 and name HA   ))   ((resid  40 and name HG2* ))    3.49  1.69  0.52
 assign ((resid  40 and name HG2* ))   ((resid  40 and name HG12 ))    3.40  1.60  0.51
 assign ((resid  40 and name HN   ))   ((resid  40 and name HD1* ))    4.37  2.57  0.66
 assign ((resid  40 and name HA   ))   ((resid  40 and name HD1* ))    4.42  2.62  0.66
 assign ((resid  40 and name HB   ))   ((resid  40 and name HD1* ))    3.43  1.63  0.51
 assign ((resid  41 and name HA   ))   ((resid  41 and name HD1  ))    5.26  3.46  0.79
 assign ((resid  41 and name HG2  ))   ((resid  58 and name HA   ))    4.75  2.95  0.71
 assign ((resid  41 and name HB1  ))   ((resid  41 and name HG2  ))    2.70  0.90  0.41
 assign ((resid  41 and name HA   ))   ((resid  41 and name HG1  ))    4.25  2.45  0.64
 assign ((resid  41 and name HA   ))   ((resid  41 and name HD2  ))    5.26  3.46  0.79
 assign ((resid  41 and name HD2  ))   ((resid  58 and name HA   ))    6.00  4.20  0.90
 assign ((resid  41 and name HB1  ))   ((resid  41 and name HD2  ))    3.69  1.89  0.55
 assign ((resid  41 and name HD1  ))   ((resid  58 and name HA   ))    6.00  4.20  0.90
 assign ((resid  41 and name HB1  ))   ((resid  41 and name HD1  ))    3.69  1.89  0.55
 assign ((resid  42 and name HA   ))   ((resid  42 and name HG1* ))    3.88  2.08  0.58
 assign ((resid  42 and name HG1* ))   ((resid  44 and name HD1* ))    3.47  1.67  0.52
 assign ((resid  42 and name HA   ))   ((resid  42 and name HG2* ))    3.59  1.79  0.54
 assign ((resid  44 and name HA   ))   ((resid  44 and name HG   ))    3.73  1.93  0.56
 assign ((resid  44 and name HA   ))   ((resid  44 and name HD1* ))    3.82  2.02  0.57
 assign ((resid  44 and name HB1  ))   ((resid  44 and name HG   ))    2.70  0.90  0.41
 assign ((resid  43 and name HA   ))   ((resid  44 and name HD1* ))    4.10  2.30  0.62
 assign ((resid  44 and name HB2  ))   ((resid  44 and name HD1* ))    3.18  1.38  0.48
 assign ((resid  44 and name HA   ))   ((resid  44 and name HD2* ))    3.85  2.05  0.58
 assign ((resid  44 and name HB1  ))   ((resid  44 and name HD2* ))    3.26  1.46  0.49
 assign ((resid  45 and name HA   ))   ((resid  45 and name HG2  ))    4.15  2.35  0.62
 assign ((resid  45 and name HG1  ))   ((resid  53 and name HN   ))    4.73  2.93  0.71
 assign ((resid  45 and name HA   ))   ((resid  45 and name HG1  ))    4.15  2.35  0.62
 assign ((resid  46 and name HA   ))   ((resid  46 and name HG   ))    3.94  2.14  0.59
 assign ((resid  46 and name HB2  ))   ((resid  46 and name HD1* ))    3.75  1.95  0.56
 assign ((resid  46 and name HA   ))   ((resid  46 and name HD1* ))    3.75  1.95  0.56
 assign ((resid  46 and name HB1  ))   ((resid  46 and name HD1* ))    3.17  1.37  0.48
 assign ((resid  46 and name HA   ))   ((resid  46 and name HD2* ))    4.19  2.39  0.63
 assign ((resid  46 and name HB2  ))   ((resid  46 and name HD2* ))    3.38  1.58  0.51
 assign ((resid  46 and name HB1  ))   ((resid  46 and name HD2* ))    3.19  1.39  0.48
 assign ((resid  47 and name HA   ))   ((resid  47 and name HG2  ))    4.23  2.43  0.63
 assign ((resid  47 and name HA   ))   ((resid  47 and name HG1  ))    4.23  2.43  0.63
 assign ((resid  47 and name HA   ))   ((resid  47 and name HD2  ))    5.56  3.76  0.83
 assign ((resid  47 and name HB2  ))   ((resid  47 and name HD2  ))    3.73  1.93  0.56
 assign ((resid  47 and name HB1  ))   ((resid  47 and name HD2  ))    3.73  1.93  0.56
 assign ((resid  47 and name HA   ))   ((resid  47 and name HD1  ))    5.56  3.76  0.83
 assign ((resid  47 and name HB1  ))   ((resid  47 and name HD1  ))    3.73  1.93  0.56
 assign ((resid  48 and name HA   ))   ((resid  48 and name HG2* ))    3.47  1.67  0.52
 assign ((resid  49 and name HA   ))   ((resid  49 and name HD21 ))    6.00  4.20  0.90
 assign ((resid  49 and name HA   ))   ((resid  49 and name HD22 ))    6.00  4.20  0.90
 assign ((resid  51 and name HA   ))   ((resid  51 and name HG2  ))    4.22  2.42  0.63
 assign ((resid  51 and name HA   ))   ((resid  51 and name HG1  ))    4.22  2.42  0.63
 assign ((resid  51 and name HA   ))   ((resid  51 and name HD2  ))    5.33  3.53  0.80
 assign ((resid  51 and name HA   ))   ((resid  51 and name HD1  ))    5.33  3.53  0.80
 assign ((resid  51 and name HA   ))   ((resid  51 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  51 and name HA   ))   ((resid  51 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  51 and name HN   ))   ((resid  51 and name HD2  ))    5.91  4.11  0.89
 assign ((resid  51 and name HN   ))   ((resid  51 and name HD1  ))    5.91  4.11  0.89
 assign ((resid  51 and name HN   ))   ((resid  51 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  51 and name HN   ))   ((resid  51 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  52 and name HB2  ))   ((resid  52 and name HE2  ))    5.36  3.56  0.80
 assign ((resid  52 and name HB2  ))   ((resid  52 and name HE1  ))    5.36  3.56  0.80
 assign ((resid  52 and name HB1  ))   ((resid  52 and name HE2  ))    5.36  3.56  0.80
 assign ((resid  52 and name HB1  ))   ((resid  52 and name HE1  ))    5.36  3.56  0.80
 assign ((resid  52 and name HG2  ))   ((resid  54 and name HN   ))    6.00  4.20  0.90
 assign ((resid  52 and name HG1  ))   ((resid  54 and name HN   ))    6.00  4.20  0.90
 assign ((resid  52 and name HA   ))   ((resid  52 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  52 and name HA   ))   ((resid  52 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  53 and name HA   ))   ((resid  53 and name HG2  ))    3.96  2.16  0.59
 assign ((resid  53 and name HA   ))   ((resid  53 and name HG1  ))    3.96  2.16  0.59
 assign ((resid  55 and name HB1  ))   ((resid  55 and name HE1  ))    4.95  3.15  0.74
 assign ((resid  55 and name HB2  ))   ((resid  55 and name HE2  ))    5.05  3.25  0.76
 assign ((resid  56 and name HA   ))   ((resid  56 and name HG2* ))    3.33  1.53  0.50
 assign ((resid  57 and name HA   ))   ((resid  57 and name HG1* ))    3.43  1.63  0.51
 assign ((resid  57 and name HA   ))   ((resid  57 and name HG2* ))    3.73  1.93  0.56
 assign ((resid  58 and name HA   ))   ((resid  58 and name HG2  ))    3.93  2.13  0.59
 assign ((resid  58 and name HA   ))   ((resid  58 and name HG1  ))    3.88  2.08  0.58
 assign ((resid  59 and name HA   ))   ((resid  59 and name HG1* ))    3.32  1.52  0.50
 assign ((resid  59 and name HA   ))   ((resid  59 and name HG2* ))    3.40  1.60  0.51
 assign ((resid  60 and name HA   ))   ((resid  60 and name HG2  ))    3.88  2.08  0.58
 assign ((resid  60 and name HB1  ))   ((resid  60 and name HG2  ))    2.98  1.18  0.45
 assign ((resid  61 and name HA   ))   ((resid  61 and name HG1  ))    4.07  2.27  0.61
 assign ((resid  60 and name HG2  ))   ((resid  61 and name HB1  ))    4.89  3.09  0.73
 assign ((resid  61 and name HA   ))   ((resid  61 and name HG2  ))    4.24  2.44  0.64
 assign ((resid  61 and name HN   ))   ((resid  61 and name HD2  ))    5.91  4.11  0.89
 assign ((resid  61 and name HA   ))   ((resid  61 and name HD2  ))    4.13  2.33  0.62
 assign ((resid  61 and name HB2  ))   ((resid  61 and name HD2  ))    4.10  2.30  0.62
 assign ((resid  61 and name HN   ))   ((resid  61 and name HD1  ))    5.73  3.93  0.86
 assign ((resid  61 and name HA   ))   ((resid  61 and name HD1  ))    4.55  2.75  0.68
 assign ((resid  61 and name HB1  ))   ((resid  61 and name HD1  ))    4.13  2.33  0.62
 assign ((resid  61 and name HB2  ))   ((resid  61 and name HD1  ))    3.94  2.14  0.59
 assign ((resid  62 and name HA   ))   ((resid  62 and name HG2  ))    4.03  2.23  0.60
 assign ((resid  62 and name HA   ))   ((resid  62 and name HG1  ))    4.03  2.23  0.60
 assign ((resid  62 and name HB2  ))   ((resid  62 and name HE21 ))    6.00  4.20  0.90
 assign ((resid  62 and name HB1  ))   ((resid  62 and name HE21 ))    6.00  4.20  0.90
 assign ((resid  65 and name HN   ))   ((resid  65 and name HB   ))    3.88  2.08  0.58
 assign ((resid  65 and name HA   ))   ((resid  65 and name HG2* ))    3.43  1.63  0.51
 assign ((resid  67 and name HA   ))   ((resid  67 and name HG2* ))    3.70  1.90  0.56
 assign ((resid  68 and name HA   ))   ((resid  68 and name HG1* ))    3.38  1.58  0.51
 assign ((resid  68 and name HA   ))   ((resid  68 and name HG2* ))    3.44  1.64  0.52
 assign ((resid  69 and name HA   ))   ((resid  69 and name HG2  ))    3.87  2.07  0.58
 assign ((resid  69 and name HA   ))   ((resid  69 and name HG1  ))    3.87  2.07  0.58
 assign ((resid  69 and name HB1  ))   ((resid  69 and name HE1  ))    4.42  2.62  0.66
 assign ((resid  69 and name HA   ))   ((resid  69 and name HE2  ))    5.34  3.54  0.80
 assign ((resid  69 and name HB1  ))   ((resid  69 and name HE2  ))    4.42  2.62  0.66
 assign ((resid  69 and name HA   ))   ((resid  69 and name HE1  ))    5.34  3.54  0.80
 assign ((resid  18 and name HG1  ))   ((resid  18 and name HE1  ))    3.97  2.17  0.60
 assign ((resid  32 and name HA   ))   ((resid  32 and name HG2  ))    4.25  2.45  0.64
 assign ((resid  70 and name HA   ))   ((resid  70 and name HD2  ))    5.28  3.48  0.79
 assign ((resid  70 and name HN   ))   ((resid  70 and name HD1  ))    5.91  4.11  0.89
 assign ((resid  57 and name HG1* ))   ((resid  71 and name HA   ))    4.34  2.54  0.65
 assign ((resid  57 and name HG2* ))   ((resid  71 and name HA   ))    4.66  2.86  0.70
 assign ((resid  71 and name HG2* ))   ((resid  71 and name HG12 ))    3.24  1.44  0.49
 assign ((resid  71 and name HG2* ))   ((resid  71 and name HG11 ))    3.24  1.44  0.49
 assign ((resid  71 and name HA   ))   ((resid  71 and name HG2* ))    3.59  1.79  0.54
 assign ((resid  57 and name HG2* ))   ((resid  71 and name HG2* ))    3.19  1.39  0.48
 assign ((resid  71 and name HA   ))   ((resid  71 and name HD1* ))    4.57  2.77  0.69
 assign ((resid  71 and name HB   ))   ((resid  71 and name HD1* ))    3.37  1.57  0.51
 assign ((resid  71 and name HG2* ))   ((resid  71 and name HD1* ))    2.70  0.90  0.41
 assign ((resid  72 and name HA   ))   ((resid  72 and name HG2* ))    3.41  1.61  0.51
 assign ((resid  72 and name HN   ))   ((resid  72 and name HG2* ))    4.03  2.23  0.60
 assign ((resid  73 and name HA   ))   ((resid  73 and name HG2  ))    4.23  2.43  0.63
 assign ((resid  73 and name HA   ))   ((resid  73 and name HG1  ))    4.23  2.43  0.63
 assign ((resid  73 and name HA   ))   ((resid  73 and name HD1  ))    4.91  3.11  0.74
 assign ((resid  73 and name HB2  ))   ((resid  73 and name HD1  ))    4.19  2.39  0.63
 assign ((resid  73 and name HB1  ))   ((resid  73 and name HD1  ))    4.01  2.21  0.60
 assign ((resid  73 and name HA   ))   ((resid  73 and name HD2  ))    4.91  3.11  0.74
 assign ((resid  73 and name HB2  ))   ((resid  73 and name HD2  ))    4.19  2.39  0.63
 assign ((resid  73 and name HB1  ))   ((resid  73 and name HD2  ))    4.01  2.21  0.60
 assign ((resid  74 and name HA   ))   ((resid  74 and name HG2* ))    3.27  1.47  0.49
 assign ((resid  75 and name HA   ))   ((resid  75 and name HG1* ))    3.55  1.75  0.53
 assign ((resid  75 and name HA   ))   ((resid  75 and name HG2* ))    3.55  1.75  0.53
 assign ((resid  78 and name HA   ))   ((resid  78 and name HD1* ))    4.28  2.48  0.64
 assign ((resid  78 and name HA   ))   ((resid  78 and name HD2* ))    4.28  2.48  0.64
 assign ((resid  78 and name HB2  ))   ((resid  78 and name HD1* ))    3.62  1.82  0.54
 assign ((resid  78 and name HB2  ))   ((resid  78 and name HD2* ))    3.62  1.82  0.54
 assign ((resid  20 and name HG   ))   ((resid  28 and name HG2* ))    4.55  2.75  0.68
 assign ((resid  78 and name HN   ))   ((resid  78 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  78 and name HB1  ))   ((resid  78 and name HD1* ))    3.62  1.82  0.54
 assign ((resid  78 and name HN   ))   ((resid  78 and name HD2* ))    6.00  4.20  0.90
 assign ((resid  78 and name HB1  ))   ((resid  78 and name HD2* ))    3.62  1.82  0.54
 assign ((resid  18 and name HA   ))   ((resid  21 and name HG2  ))    4.17  2.37  0.63
 assign ((resid   4 and name HB2  ))   ((resid   5 and name HN   ))    4.94  3.14  0.74
 assign ((resid   4 and name HB1  ))   ((resid   5 and name HN   ))    4.94  3.14  0.74
 assign ((resid   7 and name HB2  ))   ((resid   8 and name HN   ))    4.04  2.24  0.61
 assign ((resid  10 and name HA   ))   ((resid  14 and name HN   ))    4.93  3.13  0.74
 assign ((resid  14 and name HG1* ))   ((resid  15 and name HN   ))    3.84  2.04  0.58
 assign ((resid  11 and name HN   ))   ((resid  14 and name HG2* ))    4.42  2.62  0.66
 assign ((resid  18 and name HG1  ))   ((resid  19 and name HN   ))    5.47  3.67  0.82
 assign ((resid  19 and name HG   ))   ((resid  20 and name HN   ))    4.97  3.17  0.75
 assign ((resid  19 and name HA   ))   ((resid  21 and name HN   ))    4.74  2.94  0.71
 assign ((resid  20 and name HD2* ))   ((resid  21 and name HN   ))    5.10  3.30  0.77
 assign ((resid  21 and name HG2  ))   ((resid  22 and name HN   ))    5.09  3.29  0.76
 assign ((resid  21 and name HG1  ))   ((resid  22 and name HN   ))    5.09  3.29  0.76
 assign ((resid  24 and name HG2  ))   ((resid  25 and name HN   ))    5.78  3.98  0.87
 assign ((resid  27 and name HE2  ))   ((resid  28 and name HN   ))    6.00  4.20  0.90
 assign ((resid  27 and name HE1  ))   ((resid  28 and name HN   ))    6.00  4.20  0.90
 assign ((resid  30 and name HG1* ))   ((resid  31 and name HN   ))    4.19  2.39  0.63
 assign ((resid  31 and name HB2  ))   ((resid  32 and name HN   ))    4.26  2.46  0.64
 assign ((resid  31 and name HD2  ))   ((resid  32 and name HN   ))    5.85  4.05  0.88
 assign ((resid  31 and name HD1  ))   ((resid  32 and name HN   ))    5.85  4.05  0.88
 assign ((resid  32 and name HD2  ))   ((resid  33 and name HN   ))    5.85  4.05  0.88
 assign ((resid  32 and name HD1  ))   ((resid  33 and name HN   ))    5.85  4.05  0.88
 assign ((resid  33 and name HB   ))   ((resid  34 and name HN   ))    4.88  3.08  0.73
 assign ((resid  58 and name HN   ))   ((resid  68 and name HG1* ))    4.83  3.03  0.72
 assign ((resid  40 and name HD1* ))   ((resid  41 and name HN   ))    5.28  3.48  0.79
 assign ((resid  45 and name HB2  ))   ((resid  46 and name HN   ))    4.91  3.11  0.74
 assign ((resid  45 and name HB1  ))   ((resid  46 and name HN   ))    5.22  3.42  0.78
 assign ((resid  46 and name HD1* ))   ((resid  47 and name HN   ))    4.56  2.76  0.68
 assign ((resid  51 and name HD2  ))   ((resid  52 and name HN   ))    6.00  4.20  0.90
 assign ((resid  51 and name HD1  ))   ((resid  52 and name HN   ))    6.00  4.20  0.90
 assign ((resid  51 and name HE2  ))   ((resid  52 and name HN   ))    6.00  4.20  0.90
 assign ((resid  51 and name HE1  ))   ((resid  52 and name HN   ))    6.00  4.20  0.90
 assign ((resid  52 and name HD2  ))   ((resid  53 and name HN   ))    6.00  4.20  0.90
 assign ((resid  52 and name HD1  ))   ((resid  53 and name HN   ))    6.00  4.20  0.90
 assign ((resid  57 and name HB   ))   ((resid  58 and name HN   ))    4.88  3.08  0.73
 assign ((resid  58 and name HB2  ))   ((resid  59 and name HN   ))    5.05  3.25  0.76
 assign ((resid  58 and name HB1  ))   ((resid  59 and name HN   ))    5.20  3.40  0.78
 assign ((resid  58 and name HG2  ))   ((resid  59 and name HN   ))    4.68  2.88  0.70
 assign ((resid  58 and name HG1  ))   ((resid  59 and name HN   ))    5.00  3.20  0.75
 assign ((resid  59 and name HB   ))   ((resid  60 and name HN   ))    4.24  2.44  0.64
 assign ((resid  66 and name HB2  ))   ((resid  67 and name HN   ))    4.92  3.12  0.74
 assign ((resid  67 and name HB   ))   ((resid  68 and name HN   ))    4.24  2.44  0.64
 assign ((resid  70 and name HB2  ))   ((resid  71 and name HN   ))    5.60  3.80  0.84
 assign ((resid  70 and name HB1  ))   ((resid  71 and name HN   ))    5.60  3.80  0.84
 assign ((resid  71 and name HG11 ))   ((resid  72 and name HN   ))    5.39  3.59  0.81
 assign ((resid  71 and name HD1* ))   ((resid  72 and name HN   ))    5.44  3.64  0.82
 assign ((resid  74 and name HB   ))   ((resid  75 and name HN   ))    4.17  2.37  0.63
 assign ((resid  74 and name HG2* ))   ((resid  75 and name HN   ))    4.13  2.33  0.62
 assign ((resid   5 and name HA   ))   ((resid   8 and name HB2  ))    5.13  3.33  0.77
 assign ((resid   5 and name HA   ))   ((resid   8 and name HB1  ))    6.00  4.20  0.90
 assign ((resid   5 and name HA   ))   ((resid   9 and name HN   ))    5.84  4.04  0.88
 assign ((resid   5 and name HN   ))   ((resid   6 and name HA   ))    5.61  3.81  0.84
 assign ((resid   7 and name HA   ))   ((resid  10 and name HB2  ))    3.84  2.04  0.58
 assign ((resid   7 and name HA   ))   ((resid  10 and name HN   ))    4.29  2.49  0.64
 assign ((resid   8 and name HA   ))   ((resid  11 and name HN   ))    4.06  2.26  0.61
 assign ((resid   8 and name HA   ))   ((resid  11 and name HB   ))    3.90  2.10  0.59
 assign ((resid   8 and name HA   ))   ((resid  12 and name HN   ))    4.16  2.36  0.62
 assign ((resid   8 and name HB2  ))   ((resid   9 and name HA   ))    5.26  3.46  0.79
 assign ((resid   9 and name HA   ))   ((resid  12 and name HB1  ))    5.59  3.79  0.84
 assign ((resid   9 and name HA   ))   ((resid   9 and name HG2  ))    3.95  2.15  0.59
 assign ((resid   9 and name HA   ))   ((resid  12 and name HB2  ))    4.08  2.28  0.61
 assign ((resid  11 and name HA   ))   ((resid  14 and name HB   ))    3.48  1.68  0.52
 assign ((resid  12 and name HA   ))   ((resid  15 and name HB*  ))    3.86  2.06  0.58
 assign ((resid  10 and name HA   ))   ((resid  13 and name HE21 ))    4.35  2.55  0.65
 assign ((resid  13 and name HA   ))   ((resid  16 and name HB2  ))    4.16  2.36  0.62
 assign ((resid  13 and name HA   ))   ((resid  16 and name HB1  ))    3.67  1.87  0.55
 assign ((resid  14 and name HA   ))   ((resid  16 and name HN   ))    5.14  3.34  0.77
 assign ((resid  14 and name HA   ))   ((resid  17 and name HB2  ))    3.79  1.99  0.57
 assign ((resid  15 and name HA   ))   ((resid  57 and name HB   ))    4.00  2.20  0.60
 assign ((resid  15 and name HA   ))   ((resid  18 and name HB1  ))    5.07  3.27  0.76
 assign ((resid  15 and name HA   ))   ((resid  18 and name HB2  ))    4.03  2.23  0.60
 assign ((resid   8 and name HA   ))   ((resid   8 and name HG1  ))    3.87  2.07  0.58
 assign ((resid  16 and name HA   ))   ((resid  19 and name HB2  ))    4.10  2.30  0.62
 assign ((resid  17 and name HA   ))   ((resid  20 and name HB2  ))    3.46  1.66  0.52
 assign ((resid  16 and name HG2  ))   ((resid  17 and name HA   ))    4.16  2.36  0.62
 assign ((resid  17 and name HA   ))   ((resid  20 and name HB1  ))    4.20  2.40  0.63
 assign ((resid  18 and name HA   ))   ((resid  21 and name HB2  ))    3.78  1.98  0.57
 assign ((resid  20 and name HA   ))   ((resid  22 and name HN   ))    4.90  3.10  0.74
 assign ((resid  19 and name HA   ))   ((resid  21 and name HB2  ))    5.47  3.67  0.82
 assign ((resid  19 and name HA   ))   ((resid  22 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  19 and name HA   ))   ((resid  22 and name HB2  ))    4.02  2.22  0.60
 assign ((resid  65 and name HA   ))   ((resid  66 and name HB2  ))    4.79  2.99  0.72
 assign ((resid   6 and name HA   ))   ((resid   9 and name HG2  ))    5.15  3.35  0.77
 assign ((resid   6 and name HA   ))   ((resid   9 and name HG1  ))    5.15  3.35  0.77
 assign ((resid   7 and name HA   ))   ((resid  11 and name HG1* ))    5.98  4.18  0.90
 assign ((resid   7 and name HG2  ))   ((resid  40 and name HD1* ))    5.50  3.70  0.83
 assign ((resid   7 and name HG2  ))   ((resid  11 and name HG2* ))    5.40  3.60  0.81
 assign ((resid   7 and name HG1  ))   ((resid  40 and name HD1* ))    5.50  3.70  0.83
 assign ((resid   7 and name HG1  ))   ((resid  11 and name HG2* ))    5.40  3.60  0.81
 assign ((resid   7 and name HG1  ))   ((resid  66 and name HH2  ))    6.00  4.20  0.90
 assign ((resid   6 and name HA   ))   ((resid   9 and name HD2  ))    5.39  3.59  0.81
 assign ((resid   6 and name HA   ))   ((resid   9 and name HD1  ))    5.39  3.59  0.81
 assign ((resid  11 and name HA   ))   ((resid  12 and name HA   ))    5.20  3.40  0.78
 assign ((resid  10 and name HA   ))   ((resid  11 and name HA   ))    5.55  3.75  0.83
 assign ((resid   7 and name HA   ))   ((resid  11 and name HB   ))    5.51  3.71  0.83
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HB1  ))    5.14  3.34  0.77
 assign ((resid   8 and name HA   ))   ((resid  11 and name HG1* ))    4.71  2.91  0.71
 assign ((resid  11 and name HG1* ))   ((resid  42 and name HA   ))    5.54  3.74  0.83
 assign ((resid  11 and name HG1* ))   ((resid  41 and name HA   ))    5.51  3.71  0.83
 assign ((resid  11 and name HG1* ))   ((resid  59 and name HA   ))    5.93  4.13  0.89
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HB1  ))    4.78  2.98  0.72
 assign ((resid   8 and name HA   ))   ((resid  11 and name HG2* ))    3.72  1.92  0.56
 assign ((resid   7 and name HA   ))   ((resid  11 and name HG2* ))    5.02  3.22  0.75
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HA   ))    5.55  3.75  0.83
 assign ((resid  55 and name HA   ))   ((resid  73 and name HB1  ))    5.97  4.17  0.90
 assign ((resid  10 and name HB2  ))   ((resid  11 and name HA   ))    5.37  3.57  0.81
 assign ((resid  10 and name HB2  ))   ((resid  11 and name HB   ))    5.53  3.73  0.83
 assign ((resid  10 and name HB2  ))   ((resid  11 and name HG1* ))    5.55  3.75  0.83
 assign ((resid  11 and name HG1* ))   ((resid  59 and name HB   ))    3.68  1.88  0.55
 assign ((resid  10 and name HB2  ))   ((resid  11 and name HG2* ))    4.68  2.88  0.70
 assign ((resid  11 and name HG2* ))   ((resid  59 and name HB   ))    3.95  2.15  0.59
 assign ((resid   8 and name HB1  ))   ((resid  11 and name HG2* ))    6.00  4.20  0.90
 assign ((resid  11 and name HG2* ))   ((resid  12 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  11 and name HG1* ))   ((resid  12 and name HB2  ))    5.35  3.55  0.80
 assign ((resid  11 and name HA   ))   ((resid  15 and name HB*  ))    5.70  3.90  0.86
 assign ((resid  11 and name HA   ))   ((resid  59 and name HG2* ))    4.81  3.01  0.72
 assign ((resid  11 and name HA   ))   ((resid  42 and name HG2* ))    4.96  3.16  0.74
 assign ((resid  11 and name HA   ))   ((resid  40 and name HG2* ))    5.95  4.15  0.89
 assign ((resid  11 and name HA   ))   ((resid  40 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  11 and name HB   ))   ((resid  59 and name HG1* ))    5.44  3.64  0.82
 assign ((resid  11 and name HB   ))   ((resid  33 and name HG2* ))    4.73  2.93  0.71
 assign ((resid  11 and name HB   ))   ((resid  42 and name HG2* ))    5.23  3.43  0.78
 assign ((resid  11 and name HB   ))   ((resid  40 and name HG2* ))    4.41  2.61  0.66
 assign ((resid  11 and name HB   ))   ((resid  40 and name HD1* ))    4.99  3.19  0.75
 assign ((resid  11 and name HG1* ))   ((resid  15 and name HB*  ))    4.45  2.65  0.67
 assign ((resid  11 and name HG1* ))   ((resid  59 and name HG2* ))    3.30  1.50  0.50
 assign ((resid  11 and name HG1* ))   ((resid  42 and name HG2* ))    3.20  1.40  0.48
 assign ((resid  11 and name HG1* ))   ((resid  40 and name HG2* ))    3.21  1.41  0.48
 assign ((resid  11 and name HG2* ))   ((resid  59 and name HG2* ))    4.59  2.79  0.69
 assign ((resid  11 and name HG2* ))   ((resid  33 and name HG1* ))    4.63  2.83  0.69
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HG2* ))    3.37  1.57  0.51
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HN   ))    5.58  3.78  0.84
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HE3  ))    4.44  2.64  0.67
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HZ3  ))    5.26  3.46  0.79
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HB1  ))    4.24  2.44  0.64
 assign ((resid  11 and name HA   ))   ((resid  66 and name HD1  ))    5.59  3.79  0.84
 assign ((resid  12 and name HA   ))   ((resid  42 and name HG1* ))    3.41  1.61  0.51
 assign ((resid  12 and name HA   ))   ((resid  42 and name HG2* ))    3.84  2.04  0.58
 assign ((resid  11 and name HG1* ))   ((resid  12 and name HA   ))    4.78  2.98  0.72
 assign ((resid  11 and name HG2* ))   ((resid  12 and name HA   ))    5.37  3.57  0.81
 assign ((resid  20 and name HD2* ))   ((resid  24 and name HB1  ))    4.59  2.79  0.69
 assign ((resid  12 and name HA   ))   ((resid  13 and name HA   ))    4.86  3.06  0.73
 assign ((resid  12 and name HG1  ))   ((resid  33 and name HG2* ))    3.46  1.66  0.52
 assign ((resid  12 and name HG1  ))   ((resid  40 and name HG2* ))    5.20  3.40  0.78
 assign ((resid  11 and name HG1* ))   ((resid  12 and name HG1  ))    6.00  4.20  0.90
 assign ((resid  11 and name HG2* ))   ((resid  12 and name HG1  ))    5.66  3.86  0.85
 assign ((resid  12 and name HG2  ))   ((resid  30 and name HA   ))    5.30  3.50  0.80
 assign ((resid  13 and name HA   ))   ((resid  16 and name HG2  ))    5.02  3.22  0.75
 assign ((resid  10 and name HA   ))   ((resid  14 and name HG2* ))    5.35  3.55  0.80
 assign ((resid  20 and name HD2* ))   ((resid  21 and name HA   ))    5.99  4.19  0.90
 assign ((resid  13 and name HA   ))   ((resid  28 and name HG1* ))    6.00  4.20  0.90
 assign ((resid  13 and name HG2  ))   ((resid  17 and name HN   ))    5.34  3.54  0.80
 assign ((resid  13 and name HG1  ))   ((resid  17 and name HN   ))    5.65  3.85  0.85
 assign ((resid  13 and name HG2  ))   ((resid  14 and name HG2* ))    4.85  3.05  0.73
 assign ((resid  13 and name HG2  ))   ((resid  14 and name HG1* ))    5.01  3.21  0.75
 assign ((resid  13 and name HG2  ))   ((resid  14 and name HA   ))    4.69  2.89  0.70
 assign ((resid  14 and name HA   ))   ((resid  15 and name HB*  ))    5.34  3.54  0.80
 assign ((resid  14 and name HA   ))   ((resid  18 and name HG2  ))    5.52  3.72  0.83
 assign ((resid  14 and name HA   ))   ((resid  16 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  11 and name HA   ))   ((resid  14 and name HG1* ))    4.18  2.38  0.63
 assign ((resid  14 and name HG1* ))   ((resid  66 and name HB1  ))    3.75  1.95  0.56
 assign ((resid  11 and name HA   ))   ((resid  14 and name HG2* ))    3.53  1.73  0.53
 assign ((resid  14 and name HG2* ))   ((resid  66 and name HB2  ))    3.77  1.97  0.57
 assign ((resid  15 and name HB*  ))   ((resid  19 and name HN   ))    5.34  3.54  0.80
 assign ((resid  13 and name HA   ))   ((resid  15 and name HB*  ))    5.34  3.54  0.80
 assign ((resid  15 and name HB*  ))   ((resid  42 and name HB   ))    3.76  1.96  0.56
 assign ((resid  15 and name HB*  ))   ((resid  18 and name HB2  ))    4.48  2.68  0.67
 assign ((resid  15 and name HB*  ))   ((resid  42 and name HG1* ))    3.01  1.21  0.45
 assign ((resid  15 and name HB*  ))   ((resid  57 and name HG2* ))    3.46  1.66  0.52
 assign ((resid  15 and name HB*  ))   ((resid  42 and name HG2* ))    3.22  1.42  0.48
 assign ((resid  15 and name HA   ))   ((resid  16 and name HG2  ))    6.00  4.20  0.90
 assign ((resid  15 and name HA   ))   ((resid  19 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  14 and name HG1* ))   ((resid  15 and name HA   ))    4.05  2.25  0.61
 assign ((resid  15 and name HA   ))   ((resid  68 and name HG2* ))    4.26  2.46  0.64
 assign ((resid  15 and name HA   ))   ((resid  42 and name HG2* ))    5.32  3.52  0.80
 assign ((resid  15 and name HA   ))   ((resid  71 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  15 and name HB*  ))   ((resid  59 and name HN   ))    5.47  3.67  0.82
 assign ((resid  15 and name HB*  ))   ((resid  18 and name HN   ))    5.76  3.96  0.86
 assign ((resid  15 and name HB*  ))   ((resid  16 and name HA   ))    4.73  2.93  0.71
 assign ((resid  16 and name HA   ))   ((resid  28 and name HG1* ))    3.41  1.61  0.51
 assign ((resid   8 and name HA   ))   ((resid   9 and name HA   ))    5.24  3.44  0.79
 assign ((resid  15 and name HA   ))   ((resid  16 and name HA   ))    5.65  3.85  0.85
 assign ((resid  13 and name HA   ))   ((resid  16 and name HA   ))    5.36  3.56  0.80
 assign ((resid   9 and name HA   ))   ((resid  12 and name HD2  ))    6.00  4.20  0.90
 assign ((resid   9 and name HA   ))   ((resid  12 and name HD1  ))    6.00  4.20  0.90
 assign ((resid  16 and name HB1  ))   ((resid  28 and name HG1* ))    3.56  1.76  0.53
 assign ((resid  16 and name HG2  ))   ((resid  20 and name HD1* ))    3.84  2.04  0.58
 assign ((resid  16 and name HG2  ))   ((resid  44 and name HD2* ))    4.60  2.80  0.69
 assign ((resid  16 and name HG1  ))   ((resid  20 and name HD1* ))    3.10  1.30  0.47
 assign ((resid  16 and name HG1  ))   ((resid  44 and name HD2* ))    4.68  2.88  0.70
 assign ((resid  18 and name HE2  ))   ((resid  68 and name HG2* ))    4.48  2.68  0.67
 assign ((resid  17 and name HA   ))   ((resid  18 and name HA   ))    5.05  3.25  0.76
 assign ((resid  17 and name HA   ))   ((resid  20 and name HG   ))    4.32  2.52  0.65
 assign ((resid  16 and name HG1  ))   ((resid  17 and name HA   ))    5.04  3.24  0.76
 assign ((resid  17 and name HA   ))   ((resid  20 and name HD1* ))    3.50  1.70  0.53
 assign ((resid  18 and name HB1  ))   ((resid  68 and name HG1* ))    3.83  2.03  0.57
 assign ((resid  18 and name HB2  ))   ((resid  68 and name HG1* ))    4.51  2.71  0.68
 assign ((resid  18 and name HB2  ))   ((resid  68 and name HG2* ))    5.18  3.38  0.78
 assign ((resid  18 and name HB2  ))   ((resid  71 and name HG2* ))    5.18  3.38  0.78
 assign ((resid  18 and name HG2  ))   ((resid  68 and name HG2* ))    3.83  2.03  0.57
 assign ((resid  16 and name HA   ))   ((resid  19 and name HD1* ))    5.32  3.52  0.80
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HB1  ))    4.46  2.66  0.67
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HB2  ))    4.23  2.43  0.63
 assign ((resid  19 and name HG   ))   ((resid  71 and name HG2* ))    3.75  1.95  0.56
 assign ((resid  19 and name HD1* ))   ((resid  44 and name HD1* ))    2.97  1.17  0.45
 assign ((resid  19 and name HD2* ))   ((resid  71 and name HG2* ))    3.15  1.35  0.47
 assign ((resid  19 and name HD2* ))   ((resid  46 and name HD1* ))    3.51  1.71  0.53
 assign ((resid  19 and name HD2* ))   ((resid  71 and name HD1* ))    3.98  2.18  0.60
 assign ((resid  19 and name HG   ))   ((resid  44 and name HD1* ))    3.57  1.77  0.54
 assign ((resid  19 and name HD1* ))   ((resid  46 and name HA   ))    4.97  3.17  0.75
 assign ((resid  60 and name HG2  ))   ((resid  61 and name HB2  ))    5.76  3.96  0.86
 assign ((resid  18 and name HA   ))   ((resid  21 and name HG1  ))    4.17  2.37  0.63
 assign ((resid  53 and name HG2  ))   ((resid  55 and name HE2  ))    5.78  3.98  0.87
 assign ((resid  53 and name HG1  ))   ((resid  55 and name HE2  ))    5.78  3.98  0.87
 assign ((resid  22 and name HA   ))   ((resid  24 and name HD1  ))    4.78  2.98  0.72
 assign ((resid  21 and name HA   ))   ((resid  22 and name HA   ))    4.88  3.08  0.73
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HB1  ))    5.11  3.31  0.77
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HG2  ))    5.43  3.63  0.81
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HG1  ))    5.43  3.63  0.81
 assign ((resid  22 and name HG1  ))   ((resid  71 and name HG2* ))    5.87  4.07  0.88
 assign ((resid  22 and name HB2  ))   ((resid  23 and name HB1  ))    5.21  3.41  0.78
 assign ((resid  22 and name HB1  ))   ((resid  23 and name HB2  ))    5.52  3.72  0.83
 assign ((resid  22 and name HB2  ))   ((resid  23 and name HB2  ))    5.76  3.96  0.86
 assign ((resid  19 and name HB1  ))   ((resid  23 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  23 and name HB1  ))   ((resid  46 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  19 and name HD2* ))   ((resid  23 and name HB1  ))    5.50  3.70  0.83
 assign ((resid  19 and name HB1  ))   ((resid  23 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  23 and name HB2  ))   ((resid  46 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  23 and name HB2  ))   ((resid  46 and name HD1* ))    3.94  2.14  0.59
 assign ((resid  23 and name HB2  ))   ((resid  46 and name HD2* ))    4.15  2.35  0.62
 assign ((resid  19 and name HD2* ))   ((resid  23 and name HB2  ))    5.60  3.80  0.84
 assign ((resid  23 and name HB2  ))   ((resid  24 and name HD2  ))    4.78  2.98  0.72
 assign ((resid  22 and name HN   ))   ((resid  23 and name HB1  ))    5.55  3.75  0.83
 assign ((resid  23 and name HN   ))   ((resid  24 and name HD1  ))    4.25  2.45  0.64
 assign ((resid  22 and name HN   ))   ((resid  24 and name HD2  ))    5.88  4.08  0.88
 assign ((resid  16 and name HG1  ))   ((resid  28 and name HB   ))    4.75  2.95  0.71
 assign ((resid  20 and name HG   ))   ((resid  28 and name HB   ))    4.33  2.53  0.65
 assign ((resid  27 and name HA   ))   ((resid  28 and name HB   ))    5.10  3.30  0.77
 assign ((resid  16 and name HA   ))   ((resid  28 and name HB   ))    5.47  3.67  0.82
 assign ((resid  16 and name HE2  ))   ((resid  28 and name HB   ))    6.00  4.20  0.90
 assign ((resid  16 and name HE1  ))   ((resid  28 and name HB   ))    6.00  4.20  0.90
 assign ((resid  18 and name HE1  ))   ((resid  68 and name HG2* ))    4.48  2.68  0.67
 assign ((resid  30 and name HA   ))   ((resid  44 and name HA   ))    3.61  1.81  0.54
 assign ((resid  30 and name HA   ))   ((resid  44 and name HG   ))    3.99  2.19  0.60
 assign ((resid  30 and name HA   ))   ((resid  44 and name HB1  ))    4.41  2.61  0.66
 assign ((resid  31 and name HB2  ))   ((resid  44 and name HA   ))    5.75  3.95  0.86
 assign ((resid  31 and name HB1  ))   ((resid  44 and name HA   ))    5.53  3.73  0.83
 assign ((resid  32 and name HB2  ))   ((resid  43 and name HA   ))    6.00  4.20  0.90
 assign ((resid  32 and name HB1  ))   ((resid  43 and name HA   ))    6.00  4.20  0.90
 assign ((resid  32 and name HA   ))   ((resid  33 and name HG2* ))    4.84  3.04  0.73
 assign ((resid  68 and name HG1* ))   ((resid  70 and name HA   ))    4.78  2.98  0.72
 assign ((resid  32 and name HB2  ))   ((resid  43 and name HB2  ))    4.17  2.37  0.63
 assign ((resid  32 and name HB1  ))   ((resid  43 and name HB2  ))    4.17  2.37  0.63
 assign ((resid  12 and name HG2  ))   ((resid  33 and name HG1* ))    3.91  2.11  0.59
 assign ((resid  11 and name HB   ))   ((resid  33 and name HG1* ))    3.96  2.16  0.59
 assign ((resid  33 and name HB   ))   ((resid  40 and name HG2* ))    4.68  2.88  0.70
 assign ((resid  35 and name HB1  ))   ((resid  40 and name HG12 ))    4.82  3.02  0.72
 assign ((resid  35 and name HG2  ))   ((resid  40 and name HG12 ))    4.33  2.53  0.65
 assign ((resid  38 and name HB2  ))   ((resid  60 and name HG2  ))    5.61  3.81  0.84
 assign ((resid  38 and name HB1  ))   ((resid  60 and name HG2  ))    5.61  3.81  0.84
 assign ((resid  39 and name HG2* ))   ((resid  60 and name HN   ))    4.98  3.18  0.75
 assign ((resid  39 and name HG2* ))   ((resid  61 and name HN   ))    4.58  2.78  0.69
 assign ((resid  39 and name HA   ))   ((resid  40 and name HB   ))    4.67  2.87  0.70
 assign ((resid  40 and name HG2* ))   ((resid  41 and name HA   ))    4.49  2.69  0.67
 assign ((resid   8 and name HA   ))   ((resid  40 and name HG2* ))    4.64  2.84  0.70
 assign ((resid  35 and name HE2  ))   ((resid  40 and name HG2* ))    6.00  4.20  0.90
 assign ((resid  35 and name HE1  ))   ((resid  40 and name HG2* ))    6.00  4.20  0.90
 assign ((resid  11 and name HG1* ))   ((resid  40 and name HB   ))    3.98  2.18  0.60
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HB   ))    4.43  2.63  0.66
 assign ((resid  39 and name HG2* ))   ((resid  40 and name HB   ))    5.10  3.30  0.77
 assign ((resid  33 and name HG1* ))   ((resid  40 and name HG2* ))    2.95  1.15  0.44
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HG12 ))    5.47  3.67  0.82
 assign ((resid  11 and name HG1* ))   ((resid  40 and name HG11 ))    5.00  3.20  0.75
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HG11 ))    5.04  3.24  0.76
 assign ((resid  11 and name HG1* ))   ((resid  40 and name HD1* ))    3.67  1.87  0.55
 assign ((resid  11 and name HG2* ))   ((resid  40 and name HD1* ))    3.56  1.76  0.53
 assign ((resid   8 and name HD2  ))   ((resid  40 and name HD1* ))    4.10  2.30  0.62
 assign ((resid  35 and name HG1  ))   ((resid  40 and name HG12 ))    4.33  2.53  0.65
 assign ((resid  35 and name HB2  ))   ((resid  40 and name HG12 ))    4.82  3.02  0.72
 assign ((resid  35 and name HE2  ))   ((resid  40 and name HG12 ))    6.00  4.20  0.90
 assign ((resid  35 and name HE1  ))   ((resid  40 and name HG12 ))    6.00  4.20  0.90
 assign ((resid  39 and name HA   ))   ((resid  40 and name HG12 ))    5.07  3.27  0.76
 assign ((resid  40 and name HG12 ))   ((resid  66 and name HH2  ))    5.43  3.63  0.81
 assign ((resid  40 and name HG2* ))   ((resid  66 and name HZ3  ))    6.00  4.20  0.90
 assign ((resid  40 and name HB   ))   ((resid  66 and name HZ3  ))    5.76  3.96  0.86
 assign ((resid  40 and name HD1* ))   ((resid  60 and name HA   ))    5.85  4.05  0.88
 assign ((resid  39 and name HA   ))   ((resid  40 and name HD1* ))    5.23  3.43  0.78
 assign ((resid  11 and name HN   ))   ((resid  40 and name HD1* ))    5.27  3.47  0.79
 assign ((resid  11 and name HN   ))   ((resid  40 and name HG2* ))    5.65  3.85  0.85
 assign ((resid  41 and name HG1  ))   ((resid  58 and name HB1  ))    5.35  3.55  0.80
 assign ((resid  41 and name HG1  ))   ((resid  58 and name HG1  ))    5.60  3.80  0.84
 assign ((resid  41 and name HG1  ))   ((resid  58 and name HG2  ))    4.58  2.78  0.69
 assign ((resid  41 and name HG1  ))   ((resid  56 and name HG2* ))    4.54  2.74  0.68
 assign ((resid  39 and name HG2* ))   ((resid  41 and name HG1  ))    4.91  3.11  0.74
 assign ((resid  41 and name HD2  ))   ((resid  56 and name HG2* ))    4.19  2.39  0.63
 assign ((resid  41 and name HB1  ))   ((resid  56 and name HG2* ))    4.16  2.36  0.62
 assign ((resid  41 and name HB1  ))   ((resid  58 and name HG2  ))    4.95  3.15  0.74
 assign ((resid  41 and name HD1  ))   ((resid  56 and name HG2* ))    4.19  2.39  0.63
 assign ((resid  40 and name HN   ))   ((resid  41 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  41 and name HB2  ))   ((resid  59 and name HN   ))    6.00  4.20  0.90
 assign ((resid  41 and name HB1  ))   ((resid  59 and name HN   ))    5.95  4.15  0.89
 assign ((resid  41 and name HG1  ))   ((resid  59 and name HN   ))    4.98  3.18  0.75
 assign ((resid  42 and name HG2* ))   ((resid  59 and name HN   ))    4.01  2.21  0.60
 assign ((resid  31 and name HN   ))   ((resid  43 and name HB2  ))    5.86  4.06  0.88
 assign ((resid  15 and name HA   ))   ((resid  42 and name HB   ))    5.24  3.44  0.79
 assign ((resid  12 and name HA   ))   ((resid  42 and name HB   ))    5.64  3.84  0.85
 assign ((resid  43 and name HA   ))   ((resid  56 and name HA   ))    3.69  1.89  0.55
 assign ((resid  41 and name HA   ))   ((resid  42 and name HG2* ))    4.43  2.63  0.66
 assign ((resid  11 and name HG2* ))   ((resid  42 and name HG2* ))    4.35  2.55  0.65
 assign ((resid  19 and name HD1* ))   ((resid  44 and name HB2  ))    4.19  2.39  0.63
 assign ((resid  19 and name HD2* ))   ((resid  44 and name HB2  ))    4.76  2.96  0.71
 assign ((resid  19 and name HD2* ))   ((resid  44 and name HD1* ))    4.10  2.30  0.62
 assign ((resid  19 and name HD1* ))   ((resid  44 and name HD2* ))    4.33  2.53  0.65
 assign ((resid  19 and name HD2* ))   ((resid  44 and name HD2* ))    5.15  3.35  0.77
 assign ((resid  15 and name HB*  ))   ((resid  44 and name HD1* ))    3.38  1.58  0.51
 assign ((resid  15 and name HB*  ))   ((resid  44 and name HD2* ))    3.72  1.92  0.56
 assign ((resid  44 and name HD1* ))   ((resid  56 and name HA   ))    4.43  2.63  0.66
 assign ((resid  28 and name HA   ))   ((resid  44 and name HD2* ))    5.04  3.24  0.76
 assign ((resid  30 and name HA   ))   ((resid  44 and name HD2* ))    3.86  2.06  0.58
 assign ((resid  16 and name HA   ))   ((resid  44 and name HD2* ))    3.74  1.94  0.56
 assign ((resid  15 and name HA   ))   ((resid  44 and name HD2* ))    5.33  3.53  0.80
 assign ((resid  30 and name HA   ))   ((resid  44 and name HD1* ))    5.17  3.37  0.78
 assign ((resid  15 and name HA   ))   ((resid  44 and name HD1* ))    5.06  3.26  0.76
 assign ((resid  16 and name HA   ))   ((resid  44 and name HD1* ))    4.14  2.34  0.62
 assign ((resid  44 and name HB2  ))   ((resid  55 and name HD2  ))    5.23  3.43  0.78
 assign ((resid  44 and name HD1* ))   ((resid  55 and name HD2  ))    5.47  3.67  0.82
 assign ((resid  42 and name HB   ))   ((resid  44 and name HD1* ))    3.56  1.76  0.53
 assign ((resid  44 and name HD1* ))   ((resid  55 and name HB2  ))    4.84  3.04  0.73
 assign ((resid  44 and name HD1* ))   ((resid  55 and name HB1  ))    4.64  2.84  0.70
 assign ((resid  16 and name HB2  ))   ((resid  44 and name HD2* ))    4.35  2.55  0.65
 assign ((resid  42 and name HB   ))   ((resid  44 and name HD2* ))    4.55  2.75  0.68
 assign ((resid  31 and name HN   ))   ((resid  44 and name HB1  ))    5.15  3.35  0.77
 assign ((resid  44 and name HB2  ))   ((resid  55 and name HN   ))    5.13  3.33  0.77
 assign ((resid  29 and name HN   ))   ((resid  44 and name HB1  ))    5.54  3.74  0.83
 assign ((resid  31 and name HN   ))   ((resid  44 and name HD1* ))    5.67  3.87  0.85
 assign ((resid  44 and name HD1* ))   ((resid  56 and name HN   ))    6.00  4.20  0.90
 assign ((resid  19 and name HN   ))   ((resid  44 and name HD2* ))    5.46  3.66  0.82
 assign ((resid  29 and name HN   ))   ((resid  44 and name HD2* ))    5.44  3.64  0.82
 assign ((resid  15 and name HN   ))   ((resid  44 and name HD1* ))    5.80  4.00  0.87
 assign ((resid  19 and name HN   ))   ((resid  44 and name HD1* ))    5.79  3.99  0.87
 assign ((resid  32 and name HN   ))   ((resid  44 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  41 and name HG2  ))   ((resid  58 and name HG1  ))    3.93  2.13  0.59
 assign ((resid  56 and name HG2* ))   ((resid  58 and name HG1  ))    4.74  2.94  0.71
 assign ((resid  45 and name HN   ))   ((resid  46 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  46 and name HB2  ))   ((resid  53 and name HN   ))    6.00  4.20  0.90
 assign ((resid  46 and name HB1  ))   ((resid  53 and name HN   ))    5.42  3.62  0.81
 assign ((resid  46 and name HG   ))   ((resid  55 and name HE2  ))    5.15  3.35  0.77
 assign ((resid  46 and name HD1* ))   ((resid  55 and name HD2  ))    4.67  2.87  0.70
 assign ((resid  46 and name HD2* ))   ((resid  55 and name HE2  ))    3.71  1.91  0.56
 assign ((resid  23 and name HB1  ))   ((resid  46 and name HG   ))    4.66  2.86  0.70
 assign ((resid  26 and name HB2  ))   ((resid  46 and name HG   ))    5.09  3.29  0.76
 assign ((resid  26 and name HB1  ))   ((resid  46 and name HG   ))    5.09  3.29  0.76
 assign ((resid  23 and name HB1  ))   ((resid  46 and name HD1* ))    3.68  1.88  0.55
 assign ((resid  23 and name HB1  ))   ((resid  46 and name HD2* ))    3.68  1.88  0.55
 assign ((resid  19 and name HD1* ))   ((resid  46 and name HB2  ))    4.90  3.10  0.74
 assign ((resid  19 and name HD2* ))   ((resid  46 and name HB2  ))    5.56  3.76  0.83
 assign ((resid  19 and name HD1* ))   ((resid  46 and name HB1  ))    4.88  3.08  0.73
 assign ((resid  19 and name HD2* ))   ((resid  46 and name HB1  ))    5.16  3.36  0.77
 assign ((resid  19 and name HD2* ))   ((resid  46 and name HG   ))    5.43  3.63  0.81
 assign ((resid  19 and name HD1* ))   ((resid  46 and name HD1* ))    3.83  2.03  0.57
 assign ((resid  19 and name HD2* ))   ((resid  46 and name HD2* ))    4.50  2.70  0.68
 assign ((resid  19 and name HD1* ))   ((resid  46 and name HD2* ))    5.13  3.33  0.77
 assign ((resid  47 and name HA   ))   ((resid  52 and name HA   ))    3.85  2.05  0.58
 assign ((resid  16 and name HB2  ))   ((resid  28 and name HA   ))    6.00  4.20  0.90
 assign ((resid  46 and name HD2* ))   ((resid  47 and name HA   ))    5.40  3.60  0.81
 assign ((resid  48 and name HG2* ))   ((resid  49 and name HB1  ))    4.72  2.92  0.71
 assign ((resid  47 and name HA   ))   ((resid  52 and name HG2  ))    5.76  3.96  0.86
 assign ((resid  47 and name HA   ))   ((resid  52 and name HG1  ))    5.76  3.96  0.86
 assign ((resid  46 and name HB1  ))   ((resid  53 and name HB2  ))    5.13  3.33  0.77
 assign ((resid  46 and name HD2* ))   ((resid  53 and name HB2  ))    4.73  2.93  0.71
 assign ((resid  46 and name HD2* ))   ((resid  53 and name HB1  ))    4.95  3.15  0.74
 assign ((resid  45 and name HN   ))   ((resid  54 and name HA   ))    5.72  3.92  0.86
 assign ((resid  53 and name HN   ))   ((resid  54 and name HA   ))    6.00  4.20  0.90
 assign ((resid  54 and name HB1  ))   ((resid  74 and name HN   ))    5.68  3.88  0.85
 assign ((resid  45 and name HA   ))   ((resid  54 and name HA   ))    3.70  1.90  0.56
 assign ((resid  45 and name HA   ))   ((resid  54 and name HB1  ))    5.45  3.65  0.82
 assign ((resid  45 and name HA   ))   ((resid  54 and name HB2  ))    5.62  3.82  0.84
 assign ((resid  53 and name HA   ))   ((resid  54 and name HB1  ))    5.90  4.10  0.89
 assign ((resid  53 and name HA   ))   ((resid  54 and name HB2  ))    5.32  3.52  0.80
 assign ((resid  54 and name HB2  ))   ((resid  74 and name HB   ))    4.51  2.71  0.68
 assign ((resid  53 and name HA   ))   ((resid  54 and name HA   ))    5.13  3.33  0.77
 assign ((resid  45 and name HB2  ))   ((resid  54 and name HA   ))    4.93  3.13  0.74
 assign ((resid  53 and name HB1  ))   ((resid  54 and name HA   ))    5.37  3.57  0.81
 assign ((resid  54 and name HB1  ))   ((resid  74 and name HG2* ))    4.94  3.14  0.74
 assign ((resid  54 and name HB2  ))   ((resid  74 and name HG2* ))    4.96  3.16  0.74
 assign ((resid  44 and name HB2  ))   ((resid  55 and name HB1  ))    5.20  3.40  0.78
 assign ((resid  55 and name HB1  ))   ((resid  57 and name HG2* ))    4.49  2.69  0.67
 assign ((resid  55 and name HB1  ))   ((resid  71 and name HG2* ))    4.69  2.89  0.70
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HB1  ))    4.59  2.79  0.69
 assign ((resid  44 and name HB2  ))   ((resid  55 and name HB2  ))    4.62  2.82  0.69
 assign ((resid  55 and name HB2  ))   ((resid  71 and name HG2* ))    4.53  2.73  0.68
 assign ((resid  46 and name HD1* ))   ((resid  55 and name HB2  ))    4.91  3.11  0.74
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HE1  ))    6.00  4.20  0.90
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  55 and name HB2  ))   ((resid  73 and name HA   ))    5.57  3.77  0.84
 assign ((resid  54 and name HA   ))   ((resid  55 and name HB2  ))    5.44  3.64  0.82
 assign ((resid  55 and name HA   ))   ((resid  73 and name HA   ))    3.67  1.87  0.55
 assign ((resid  55 and name HA   ))   ((resid  56 and name HB   ))    5.18  3.38  0.78
 assign ((resid  55 and name HA   ))   ((resid  74 and name HB   ))    5.38  3.58  0.81
 assign ((resid  44 and name HN   ))   ((resid  55 and name HA   ))    6.00  4.20  0.90
 assign ((resid  55 and name HA   ))   ((resid  57 and name HN   ))    6.00  4.20  0.90
 assign ((resid  55 and name HB1  ))   ((resid  57 and name HN   ))    6.00  4.20  0.90
 assign ((resid  73 and name HA   ))   ((resid  74 and name HB   ))    4.87  3.07  0.73
 assign ((resid  43 and name HA   ))   ((resid  56 and name HG2* ))    3.96  2.16  0.59
 assign ((resid  56 and name HB   ))   ((resid  72 and name HG2* ))    4.40  2.60  0.66
 assign ((resid  56 and name HB   ))   ((resid  57 and name HG2* ))    5.30  3.50  0.80
 assign ((resid  15 and name HA   ))   ((resid  57 and name HG1* ))    3.53  1.73  0.53
 assign ((resid  15 and name HA   ))   ((resid  57 and name HG2* ))    4.01  2.21  0.60
 assign ((resid  56 and name HN   ))   ((resid  57 and name HG2* ))    4.59  2.79  0.69
 assign ((resid  57 and name HG1* ))   ((resid  59 and name HN   ))    4.95  3.15  0.74
 assign ((resid  19 and name HD1* ))   ((resid  57 and name HG2* ))    3.99  2.19  0.60
 assign ((resid  19 and name HD2* ))   ((resid  57 and name HG2* ))    4.25  2.45  0.64
 assign ((resid  15 and name HN   ))   ((resid  59 and name HG1* ))    5.33  3.53  0.80
 assign ((resid  59 and name HG1* ))   ((resid  66 and name HZ3  ))    4.27  2.47  0.64
 assign ((resid  59 and name HG1* ))   ((resid  60 and name HA   ))    4.70  2.90  0.70
 assign ((resid  59 and name HB   ))   ((resid  68 and name HA   ))    5.25  3.45  0.79
 assign ((resid  59 and name HG1* ))   ((resid  68 and name HA   ))    3.86  2.06  0.58
 assign ((resid  14 and name HA   ))   ((resid  59 and name HG1* ))    6.00  4.20  0.90
 assign ((resid  15 and name HA   ))   ((resid  59 and name HG1* ))    6.00  4.20  0.90
 assign ((resid  11 and name HA   ))   ((resid  59 and name HG1* ))    4.19  2.39  0.63
 assign ((resid  59 and name HG1* ))   ((resid  66 and name HB1  ))    3.27  1.47  0.49
 assign ((resid  59 and name HB   ))   ((resid  66 and name HB1  ))    5.03  3.23  0.75
 assign ((resid  40 and name HG2* ))   ((resid  59 and name HB   ))    4.36  2.56  0.65
 assign ((resid  11 and name HG1* ))   ((resid  59 and name HG1* ))    3.46  1.66  0.52
 assign ((resid  11 and name HG2* ))   ((resid  59 and name HG1* ))    3.73  1.93  0.56
 assign ((resid  40 and name HB   ))   ((resid  59 and name HG1* ))    4.59  2.79  0.69
 assign ((resid  39 and name HA   ))   ((resid  60 and name HA   ))    3.75  1.95  0.56
 assign ((resid  61 and name HA   ))   ((resid  67 and name HN   ))    4.50  2.70  0.68
 assign ((resid  60 and name HA   ))   ((resid  66 and name HE3  ))    4.69  2.89  0.70
 assign ((resid  39 and name HA   ))   ((resid  60 and name HG1  ))    4.29  2.49  0.64
 assign ((resid  60 and name HG1  ))   ((resid  61 and name HB1  ))    5.73  3.93  0.86
 assign ((resid  39 and name HG2* ))   ((resid  60 and name HG1  ))    4.91  3.11  0.74
 assign ((resid  61 and name HA   ))   ((resid  66 and name HB1  ))    5.58  3.78  0.84
 assign ((resid  61 and name HA   ))   ((resid  66 and name HA   ))    3.75  1.95  0.56
 assign ((resid  60 and name HA   ))   ((resid  61 and name HA   ))    5.36  3.56  0.80
 assign ((resid  39 and name HA   ))   ((resid  61 and name HB1  ))    5.53  3.73  0.83
 assign ((resid  60 and name HA   ))   ((resid  61 and name HB1  ))    5.07  3.27  0.76
 assign ((resid  60 and name HA   ))   ((resid  61 and name HB2  ))    5.39  3.59  0.81
 assign ((resid  61 and name HG1  ))   ((resid  66 and name HA   ))    5.21  3.41  0.78
 assign ((resid  61 and name HD2  ))   ((resid  66 and name HA   ))    5.20  3.40  0.78
 assign ((resid  61 and name HD2  ))   ((resid  64 and name HA   ))    5.33  3.53  0.80
 assign ((resid  61 and name HD1  ))   ((resid  64 and name HA   ))    6.00  4.20  0.90
 assign ((resid  61 and name HB1  ))   ((resid  66 and name HE3  ))    5.67  3.87  0.85
 assign ((resid  61 and name HD2  ))   ((resid  66 and name HZ3  ))    5.77  3.97  0.87
 assign ((resid  61 and name HD2  ))   ((resid  66 and name HZ2  ))    5.23  3.43  0.78
 assign ((resid  62 and name HN   ))   ((resid  65 and name HB   ))    5.40  3.60  0.81
 assign ((resid  64 and name HB1  ))   ((resid  65 and name HG2* ))    5.34  3.54  0.80
 assign ((resid  64 and name HB2  ))   ((resid  65 and name HG2* ))    5.34  3.54  0.80
 assign ((resid  59 and name HG1* ))   ((resid  66 and name HB2  ))    3.92  2.12  0.59
 assign ((resid  14 and name HG1* ))   ((resid  66 and name HB2  ))    4.12  2.32  0.62
 assign ((resid  14 and name HG2* ))   ((resid  66 and name HB1  ))    4.14  2.34  0.62
 assign ((resid   7 and name HG2  ))   ((resid  66 and name HZ2  ))    4.61  2.81  0.69
 assign ((resid   7 and name HG2  ))   ((resid  66 and name HH2  ))    6.00  4.20  0.90
 assign ((resid  66 and name HA   ))   ((resid  67 and name HB   ))    4.62  2.82  0.69
 assign ((resid  59 and name HA   ))   ((resid  68 and name HA   ))    3.51  1.71  0.53
 assign ((resid  59 and name HA   ))   ((resid  67 and name HG2* ))    5.51  3.71  0.83
 assign ((resid  66 and name HA   ))   ((resid  67 and name HG2* ))    5.67  3.87  0.85
 assign ((resid  66 and name HB1  ))   ((resid  67 and name HB   ))    5.88  4.08  0.88
 assign ((resid  60 and name HB1  ))   ((resid  67 and name HB   ))    5.10  3.30  0.77
 assign ((resid  62 and name HB2  ))   ((resid  67 and name HB   ))    4.38  2.58  0.66
 assign ((resid  62 and name HB1  ))   ((resid  67 and name HB   ))    4.38  2.58  0.66
 assign ((resid  66 and name HB1  ))   ((resid  67 and name HG2* ))    5.75  3.95  0.86
 assign ((resid  60 and name HG2  ))   ((resid  67 and name HG2* ))    4.02  2.22  0.60
 assign ((resid  60 and name HB1  ))   ((resid  67 and name HG2* ))    4.07  2.27  0.61
 assign ((resid  62 and name HB2  ))   ((resid  67 and name HG2* ))    4.02  2.22  0.60
 assign ((resid  62 and name HB1  ))   ((resid  67 and name HG2* ))    4.02  2.22  0.60
 assign ((resid  67 and name HB   ))   ((resid  68 and name HG2* ))    5.85  4.05  0.88
 assign ((resid  68 and name HA   ))   ((resid  69 and name HB2  ))    4.89  3.09  0.73
 assign ((resid  68 and name HA   ))   ((resid  69 and name HD2  ))    6.00  4.20  0.90
 assign ((resid  68 and name HA   ))   ((resid  69 and name HD1  ))    6.00  4.20  0.90
 assign ((resid  68 and name HA   ))   ((resid  70 and name HN   ))    4.45  2.65  0.67
 assign ((resid  67 and name HG2* ))   ((resid  69 and name HA   ))    4.82  3.02  0.72
 assign ((resid  68 and name HG1* ))   ((resid  69 and name HA   ))    4.34  2.54  0.65
 assign ((resid  19 and name HD1* ))   ((resid  71 and name HG2* ))    4.03  2.23  0.60
 assign ((resid  22 and name HG2  ))   ((resid  71 and name HG2* ))    5.87  4.07  0.88
 assign ((resid  19 and name HA   ))   ((resid  71 and name HG2* ))    4.92  3.12  0.74
 assign ((resid  18 and name HB2  ))   ((resid  71 and name HD1* ))    4.22  2.42  0.63
 assign ((resid  68 and name HB   ))   ((resid  71 and name HD1* ))    5.85  4.05  0.88
 assign ((resid  18 and name HE2  ))   ((resid  71 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  18 and name HE1  ))   ((resid  71 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  19 and name HA   ))   ((resid  71 and name HD1* ))    4.21  2.41  0.63
 assign ((resid  19 and name HD1* ))   ((resid  71 and name HD1* ))    4.72  2.92  0.71
 assign ((resid  55 and name HD1  ))   ((resid  71 and name HG2* ))    3.26  1.46  0.49
 assign ((resid  20 and name HN   ))   ((resid  71 and name HG2* ))    6.00  4.20  0.90
 assign ((resid  55 and name HD1  ))   ((resid  71 and name HD1* ))    5.54  3.74  0.83
 assign ((resid  55 and name HD1  ))   ((resid  71 and name HB   ))    5.50  3.70  0.83
 assign ((resid  55 and name HA   ))   ((resid  73 and name HB2  ))    5.73  3.93  0.86
 assign ((resid  55 and name HA   ))   ((resid  73 and name HG2  ))    5.60  3.80  0.84
 assign ((resid  55 and name HA   ))   ((resid  73 and name HG1  ))    5.60  3.80  0.84
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HD2  ))    5.09  3.29  0.76
 assign ((resid  72 and name HN   ))   ((resid  73 and name HA   ))    6.00  4.20  0.90
 assign ((resid  72 and name HN   ))   ((resid  73 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  55 and name HN   ))   ((resid  74 and name HB   ))    5.66  3.86  0.85
 assign ((resid  56 and name HB   ))   ((resid  72 and name HN   ))    5.89  4.09  0.88
 assign ((resid  54 and name HB1  ))   ((resid  74 and name HB   ))    4.24  2.44  0.64
 assign ((resid  73 and name HB1  ))   ((resid  74 and name HA   ))    5.73  3.93  0.86
 assign ((resid  74 and name HG2* ))   ((resid  75 and name HA   ))    4.79  2.99  0.72
 assign ((resid  44 and name HB2  ))   ((resid  55 and name HA   ))    6.00  4.20  0.90
 assign ((resid  55 and name HA   ))   ((resid  71 and name HG2* ))    5.34  3.54  0.80
 assign ((resid   4 and name HA   ))   ((resid   5 and name HA   ))    4.78  2.98  0.72
 assign ((resid   5 and name HA   ))   ((resid   8 and name HD1  ))    5.15  3.35  0.77
 assign ((resid  10 and name HB1  ))   ((resid  11 and name HG1* ))    6.00  4.20  0.90
 assign ((resid  10 and name HB1  ))   ((resid  11 and name HG2* ))    5.37  3.57  0.81
 assign ((resid  10 and name HB1  ))   ((resid  66 and name HE1  ))    4.43  2.63  0.66
 assign ((resid  13 and name HN   ))   ((resid  14 and name HB   ))    5.39  3.59  0.81
 assign ((resid  15 and name HA   ))   ((resid  18 and name HG2  ))    5.40  3.60  0.81
 assign ((resid  18 and name HA   ))   ((resid  71 and name HD1* ))    5.41  3.61  0.81
 assign ((resid  18 and name HB1  ))   ((resid  71 and name HD1* ))    4.98  3.18  0.75
 assign ((resid  18 and name HG2  ))   ((resid  71 and name HD1* ))    4.50  2.70  0.68
 assign ((resid  18 and name HG1  ))   ((resid  68 and name HG1* ))    4.10  2.30  0.62
 assign ((resid  18 and name HG1  ))   ((resid  68 and name HG2* ))    4.38  2.58  0.66
 assign ((resid  18 and name HN   ))   ((resid  19 and name HB2  ))    5.21  3.41  0.78
 assign ((resid  16 and name HA   ))   ((resid  19 and name HA   ))    6.00  4.20  0.90
 assign ((resid  16 and name HA   ))   ((resid  20 and name HA   ))    6.00  4.20  0.90
 assign ((resid  20 and name HA   ))   ((resid  24 and name HD2  ))    6.00  4.20  0.90
 assign ((resid  16 and name HA   ))   ((resid  19 and name HG   ))    5.69  3.89  0.85
 assign ((resid  16 and name HA   ))   ((resid  19 and name HD2* ))    5.65  3.85  0.85
 assign ((resid  15 and name HA   ))   ((resid  19 and name HD1* ))    5.32  3.52  0.80
 assign ((resid  15 and name HA   ))   ((resid  19 and name HD2* ))    6.00  4.20  0.90
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HB2  ))    4.48  2.68  0.67
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HB2  ))    4.85  3.05  0.73
 assign ((resid  20 and name HB1  ))   ((resid  24 and name HA   ))    4.87  3.07  0.73
 assign ((resid  20 and name HB2  ))   ((resid  24 and name HA   ))    5.33  3.53  0.80
 assign ((resid  30 and name HA   ))   ((resid  31 and name HB2  ))    5.17  3.37  0.78
 assign ((resid  31 and name HB1  ))   ((resid  44 and name HD1* ))    6.00  4.20  0.90
 assign ((resid  30 and name HA   ))   ((resid  31 and name HB1  ))    5.35  3.55  0.80
 assign ((resid  30 and name HA   ))   ((resid  31 and name HA   ))    5.39  3.59  0.81
 assign ((resid  39 and name HB   ))   ((resid  60 and name HA   ))    5.42  3.62  0.81
 assign ((resid  39 and name HG2* ))   ((resid  60 and name HA   ))    4.25  2.45  0.64
 assign ((resid  39 and name HB   ))   ((resid  40 and name HG11 ))    5.32  3.52  0.80
 assign ((resid  36 and name HB1  ))   ((resid  39 and name HB   ))    4.40  2.60  0.66
 assign ((resid  36 and name HB2  ))   ((resid  39 and name HB   ))    4.40  2.60  0.66
 assign ((resid  39 and name HG2* ))   ((resid  58 and name HB1  ))    3.61  1.81  0.54
 assign ((resid  39 and name HG2* ))   ((resid  60 and name HB2  ))    3.83  2.03  0.57
 assign ((resid  39 and name HG2* ))   ((resid  58 and name HG2  ))    4.00  2.20  0.60
 assign ((resid   7 and name HA   ))   ((resid  40 and name HD1* ))    5.67  3.87  0.85
 assign ((resid  40 and name HD1* ))   ((resid  61 and name HA   ))    6.00  4.20  0.90
 assign ((resid   8 and name HA   ))   ((resid  40 and name HD1* ))    4.56  2.76  0.68
 assign ((resid  35 and name HE2  ))   ((resid  40 and name HD1* ))    4.97  3.17  0.75
 assign ((resid  35 and name HE1  ))   ((resid  40 and name HD1* ))    4.97  3.17  0.75
 assign ((resid  31 and name HB1  ))   ((resid  43 and name HB2  ))    4.56  2.76  0.68
 assign ((resid  43 and name HB2  ))   ((resid  56 and name HG2* ))    5.41  3.61  0.81
 assign ((resid  43 and name HB1  ))   ((resid  56 and name HG2* ))    5.34  3.54  0.80
 assign ((resid  58 and name HG1  ))   ((resid  59 and name HG2* ))    5.83  4.03  0.87
 assign ((resid  48 and name HG2* ))   ((resid  49 and name HB2  ))    4.72  2.92  0.71
 assign ((resid  48 and name HB   ))   ((resid  51 and name HN   ))    5.55  3.75  0.83
 assign ((resid  55 and name HD1  ))   ((resid  57 and name HG2* ))    4.89  3.09  0.73
 assign ((resid  57 and name HG1* ))   ((resid  70 and name HN   ))    4.78  2.98  0.72
 assign ((resid  19 and name HN   ))   ((resid  57 and name HG2* ))    5.27  3.47  0.79
 assign ((resid  15 and name HN   ))   ((resid  57 and name HG1* ))    5.73  3.93  0.86
 assign ((resid  15 and name HN   ))   ((resid  57 and name HG2* ))    6.00  4.20  0.90
 assign ((resid  12 and name HN   ))   ((resid  33 and name HG2* ))    4.39  2.59  0.66
 assign ((resid  59 and name HG1* ))   ((resid  70 and name HN   ))    6.00  4.20  0.90
 assign ((resid  14 and name HN   ))   ((resid  59 and name HG1* ))    5.68  3.88  0.85
 assign ((resid  59 and name HG1* ))   ((resid  61 and name HN   ))    5.54  3.74  0.83
 assign ((resid  68 and name HA   ))   ((resid  69 and name HB1  ))    5.85  4.05  0.88
 assign ((resid  59 and name HA   ))   ((resid  69 and name HB1  ))    5.99  4.19  0.90
 assign ((resid  59 and name HA   ))   ((resid  69 and name HB2  ))    5.25  3.45  0.79
 assign ((resid  59 and name HA   ))   ((resid  69 and name HG2  ))    5.55  3.75  0.83
 assign ((resid  59 and name HA   ))   ((resid  69 and name HG1  ))    5.55  3.75  0.83
 assign ((resid  59 and name HA   ))   ((resid  69 and name HD2  ))    6.00  4.20  0.90
 assign ((resid  59 and name HA   ))   ((resid  69 and name HD1  ))    6.00  4.20  0.90
 assign ((resid  18 and name HG1  ))   ((resid  71 and name HD1* ))    4.15  2.35  0.62
 assign ((resid  19 and name HG   ))   ((resid  71 and name HD1* ))    4.40  2.60  0.66
 assign ((resid  56 and name HN   ))   ((resid  72 and name HB   ))    4.90  3.10  0.74
 assign ((resid  55 and name HB1  ))   ((resid  73 and name HA   ))    5.23  3.43  0.78
 assign ((resid  74 and name HA   ))   ((resid  75 and name HA   ))    4.59  2.79  0.69
 assign ((resid  74 and name HA   ))   ((resid  75 and name HB   ))    4.95  3.15  0.74
 assign ((resid  62 and name HB2  ))   ((resid  62 and name HE22 ))    6.00  4.20  0.90
 assign ((resid  62 and name HB1  ))   ((resid  62 and name HE22 ))    6.00  4.20  0.90
 assign ((resid  20 and name HA   ))   ((resid  23 and name HB1  ))    4.39  2.59  0.66
 assign ((resid  20 and name HA   ))   ((resid  23 and name HB2  ))    5.40  3.60  0.81
 assign ((resid  46 and name HN   ))   ((resid  53 and name HB2  ))    5.84  4.04  0.88
 assign ((resid  10 and name HB2  ))   ((resid  14 and name HG2* ))    5.83  4.03  0.87
 assign ((resid  12 and name HG2  ))   ((resid  42 and name HG2* ))    5.06  3.26  0.76
 assign ((resid  12 and name HG2  ))   ((resid  40 and name HG2* ))    5.65  3.85  0.85
 assign ((resid  17 and name HB2  ))   ((resid  18 and name HG1  ))    5.15  3.35  0.77
 assign ((resid  22 and name HB2  ))   ((resid  46 and name HD2* ))    5.85  4.05  0.88
 assign ((resid  17 and name HB2  ))   ((resid  68 and name HG2* ))    5.89  4.09  0.88
 assign ((resid  14 and name HA   ))   ((resid  17 and name HG2  ))    4.37  2.57  0.66
 assign ((resid  14 and name HA   ))   ((resid  17 and name HG1  ))    4.37  2.57  0.66
 assign ((resid  17 and name HB1  ))   ((resid  18 and name HG2  ))    5.20  3.40  0.78
 assign ((resid  18 and name HG2  ))   ((resid  68 and name HB   ))    5.57  3.77  0.84
 assign ((resid  20 and name HB1  ))   ((resid  21 and name HB2  ))    6.00  4.20  0.90
 assign ((resid  20 and name HB1  ))   ((resid  21 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  19 and name HD1* ))   ((resid  44 and name HG   ))    4.26  2.46  0.64
 assign ((resid  16 and name HB2  ))   ((resid  19 and name HD1* ))    5.43  3.63  0.81
 assign ((resid  16 and name HB1  ))   ((resid  19 and name HD1* ))    5.98  4.18  0.90
 assign ((resid  19 and name HD1* ))   ((resid  42 and name HB   ))    5.53  3.73  0.83
 assign ((resid  18 and name HB2  ))   ((resid  19 and name HA   ))    5.23  3.43  0.78
 assign ((resid  20 and name HA   ))   ((resid  24 and name HB1  ))    5.97  4.17  0.90
 assign ((resid  20 and name HB1  ))   ((resid  24 and name HB1  ))    5.67  3.87  0.85
 assign ((resid  16 and name HG1  ))   ((resid  20 and name HG   ))    4.37  2.57  0.66
 assign ((resid  23 and name HA   ))   ((resid  24 and name HD1  ))    3.80  2.00  0.57
 assign ((resid  23 and name HA   ))   ((resid  24 and name HD2  ))    3.60  1.80  0.54
 assign ((resid  23 and name HA   ))   ((resid  24 and name HG2  ))    5.24  3.44  0.79
 assign ((resid  23 and name HA   ))   ((resid  24 and name HG1  ))    5.24  3.44  0.79
 assign ((resid  35 and name HA   ))   ((resid  40 and name HG12 ))    4.64  2.84  0.70
 assign ((resid  11 and name HG1* ))   ((resid  42 and name HB   ))    5.33  3.53  0.80
 assign ((resid  16 and name HB2  ))   ((resid  44 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  28 and name HB   ))   ((resid  44 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  31 and name HB2  ))   ((resid  44 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  44 and name HB1  ))   ((resid  45 and name HB2  ))    5.95  4.15  0.89
 assign ((resid  44 and name HB1  ))   ((resid  45 and name HB1  ))    6.00  4.20  0.90
 assign ((resid  16 and name HA   ))   ((resid  20 and name HG   ))    5.60  3.80  0.84
 assign ((resid  16 and name HA   ))   ((resid  44 and name HG   ))    6.00  4.20  0.90
 assign ((resid  41 and name HG2  ))   ((resid  58 and name HG2  ))    3.95  2.15  0.59
 assign ((resid  56 and name HG2* ))   ((resid  58 and name HG2  ))    4.43  2.63  0.66
 assign ((resid  68 and name HG1* ))   ((resid  69 and name HB1  ))    5.41  3.61  0.81
 assign ((resid  55 and name HB2  ))   ((resid  57 and name HG2* ))    4.76  2.96  0.71
 assign ((resid  40 and name HB   ))   ((resid  59 and name HB   ))    3.60  1.80  0.54
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HB2  ))    5.40  3.60  0.81
 assign ((resid   7 and name HB2  ))   ((resid   8 and name HD2  ))    4.89  3.09  0.73
 assign ((resid   7 and name HB1  ))   ((resid   8 and name HD2  ))    4.89  3.09  0.73
 assign ((resid  70 and name HA   ))   ((resid  71 and name HB   ))    5.01  3.21  0.75
 assign ((resid  13 and name HG1  ))   ((resid  16 and name HD2  ))    5.92  4.12  0.89
 assign ((resid  13 and name HG1  ))   ((resid  16 and name HD1  ))    5.92  4.12  0.89
 assign ((resid  55 and name HA   ))   ((resid  74 and name HG2* ))    5.10  3.30  0.77
 assign ((resid  22 and name HN   ))   ((resid  23 and name HB2  ))    5.25  3.45  0.79
 assign ((resid  55 and name HN   ))   ((resid  55 and name HE2  ))    5.57  3.77  0.84
 assign ((resid  55 and name HA   ))   ((resid  55 and name HE1  ))    5.61  3.81  0.84
 assign ((resid  55 and name HA   ))   ((resid  55 and name HE2  ))    6.00  4.20  0.90
 assign ((resid  66 and name HA   ))   ((resid  66 and name HE3  ))    3.38  1.58  0.51
 assign ((resid  66 and name HB1  ))   ((resid  66 and name HE3  ))    3.48  1.68  0.52
 assign ((resid  66 and name HE3  ))   ((resid  67 and name HN   ))    4.14  2.34  0.62
 assign ((resid  39 and name HA   ))   ((resid  66 and name HZ3  ))    3.88  2.08  0.58
 assign ((resid  66 and name HB1  ))   ((resid  66 and name HZ3  ))    5.22  3.42  0.78
 assign ((resid  66 and name HA   ))   ((resid  66 and name HD1  ))    4.61  2.81  0.69
 assign ((resid  66 and name HB2  ))   ((resid  66 and name HD1  ))    3.30  1.50  0.50
 assign ((resid  55 and name HN   ))   ((resid  55 and name HD2  ))    3.64  1.84  0.55
 assign ((resid  55 and name HA   ))   ((resid  55 and name HD1  ))    3.89  2.09  0.58
 assign ((resid  55 and name HA   ))   ((resid  55 and name HD2  ))    4.41  2.61  0.66
 assign ((resid  55 and name HB1  ))   ((resid  55 and name HD1  ))    3.22  1.42  0.48
 assign ((resid  55 and name HB2  ))   ((resid  55 and name HD2  ))    3.15  1.35  0.47
 assign ((resid  55 and name HD1  ))   ((resid  56 and name HN   ))    4.24  2.44  0.64
 assign ((resid  46 and name HB2  ))   ((resid  55 and name HD2  ))    3.40  1.60  0.51
 assign ((resid  53 and name HB1  ))   ((resid  55 and name HD2  ))    3.87  2.07  0.58
 assign ((resid  55 and name HD1  ))   ((resid  73 and name HB2  ))    4.12  2.32  0.62
 assign ((resid  19 and name HD1* ))   ((resid  55 and name HD2  ))    3.76  1.96  0.56
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HD1  ))    3.71  1.91  0.56
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HD1  ))    5.09  3.29  0.76
 assign ((resid  46 and name HB2  ))   ((resid  55 and name HE2  ))    3.11  1.31  0.47
 assign ((resid  53 and name HB2  ))   ((resid  55 and name HE2  ))    3.38  1.58  0.51
 assign ((resid  53 and name HB1  ))   ((resid  55 and name HE2  ))    3.19  1.39  0.48
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HB2  ))    3.78  1.98  0.57
 assign ((resid  46 and name HB1  ))   ((resid  55 and name HE2  ))    3.45  1.65  0.52
 assign ((resid  46 and name HD1* ))   ((resid  55 and name HE2  ))    3.92  2.12  0.59
 assign ((resid  19 and name HD2* ))   ((resid  55 and name HE1  ))    3.96  2.16  0.59
 assign ((resid   7 and name HA   ))   ((resid  66 and name HD1  ))    5.35  3.55  0.80
 assign ((resid  10 and name HB2  ))   ((resid  66 and name HD1  ))    3.94  2.14  0.59
 assign ((resid  10 and name HB1  ))   ((resid  66 and name HD1  ))    3.75  1.95  0.56
 assign ((resid  14 and name HG2* ))   ((resid  66 and name HD1  ))    3.77  1.97  0.57
 assign ((resid  14 and name HG1* ))   ((resid  66 and name HD1  ))    5.11  3.31  0.77
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HD1  ))    5.55  3.75  0.83
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HD1  ))    4.29  2.49  0.64
 assign ((resid  61 and name HA   ))   ((resid  66 and name HE3  ))    3.74  1.94  0.56
 assign ((resid  59 and name HB   ))   ((resid  66 and name HE3  ))    4.09  2.29  0.61
 assign ((resid  59 and name HG1* ))   ((resid  66 and name HE3  ))    2.97  1.17  0.45
 assign ((resid  61 and name HB2  ))   ((resid  66 and name HE3  ))    3.90  2.10  0.59
 assign ((resid  40 and name HD1* ))   ((resid  66 and name HE3  ))    4.72  2.92  0.71
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HE3  ))    4.52  2.72  0.68
 assign ((resid  61 and name HD1  ))   ((resid  66 and name HE3  ))    4.50  2.70  0.68
 assign ((resid  65 and name HA   ))   ((resid  66 and name HD1  ))    4.16  2.36  0.62
 assign ((resid  40 and name HN   ))   ((resid  66 and name HZ3  ))    4.21  2.41  0.63
 assign ((resid  61 and name HN   ))   ((resid  66 and name HZ3  ))    3.84  2.04  0.58
 assign ((resid  60 and name HA   ))   ((resid  66 and name HZ3  ))    3.90  2.10  0.59
 assign ((resid  61 and name HA   ))   ((resid  66 and name HZ3  ))    4.26  2.46  0.64
 assign ((resid  61 and name HD1  ))   ((resid  66 and name HZ3  ))    4.30  2.50  0.65
 assign ((resid  59 and name HB   ))   ((resid  66 and name HZ3  ))    4.96  3.16  0.74
 assign ((resid   7 and name HG1  ))   ((resid  66 and name HZ2  ))    4.61  2.81  0.69
 assign ((resid  61 and name HD1  ))   ((resid  66 and name HZ2  ))    3.59  1.79  0.54
 assign ((resid  61 and name HD1  ))   ((resid  66 and name HH2  ))    4.17  2.37  0.63
 assign ((resid  40 and name HG11 ))   ((resid  66 and name HZ3  ))    3.82  2.02  0.57
 assign ((resid  61 and name HB1  ))   ((resid  66 and name HZ3  ))    4.00  2.20  0.60
 assign ((resid  40 and name HG11 ))   ((resid  66 and name HH2  ))    4.25  2.45  0.64
 assign ((resid  61 and name HB2  ))   ((resid  66 and name HZ3  ))    3.48  1.68  0.52
 assign ((resid  40 and name HD1* ))   ((resid  66 and name HZ3  ))    3.45  1.65  0.52
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HZ3  ))    4.17  2.37  0.63
 assign ((resid  40 and name HD1* ))   ((resid  66 and name HZ2  ))    4.10  2.30  0.62
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HZ2  ))    5.31  3.51  0.80
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HZ2  ))    4.09  2.29  0.61
 assign ((resid  61 and name HB2  ))   ((resid  66 and name HH2  ))    4.35  2.55  0.65
 assign ((resid  40 and name HD1* ))   ((resid  66 and name HH2  ))    3.69  1.89  0.55
 assign ((resid  11 and name HG1* ))   ((resid  66 and name HH2  ))    5.40  3.60  0.81
 assign ((resid  11 and name HG2* ))   ((resid  66 and name HH2  ))    5.12  3.32  0.77
 assign ((resid   7 and name HA   ))   ((resid  66 and name HZ2  ))    3.97  2.17  0.60
 assign ((resid  46 and name HN   ))   ((resid  55 and name HE2  ))    4.41  2.61  0.66
 assign ((resid  53 and name HN   ))   ((resid  55 and name HE2  ))    4.59  2.79  0.69
 assign ((resid  45 and name HA   ))   ((resid  55 and name HD2  ))    4.37  2.57  0.66
 assign ((resid  55 and name HD1  ))   ((resid  71 and name HA   ))    5.90  4.10  0.89
 assign ((resid  55 and name HD1  ))   ((resid  73 and name HA   ))    3.77  1.97  0.57
 assign ((resid  53 and name HA   ))   ((resid  55 and name HE2  ))    4.98  3.18  0.75
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HA   ))    4.21  2.41  0.63
 assign ((resid  53 and name HA   ))   ((resid  55 and name HD2  ))    5.61  3.81  0.84
 assign ((resid  55 and name HD1  ))   ((resid  74 and name HG2* ))    5.64  3.84  0.85
 assign ((resid  55 and name HD2  ))   ((resid  74 and name HG2* ))    5.85  4.05  0.88
 assign ((resid  54 and name HA   ))   ((resid  55 and name HD2  ))    4.27  2.47  0.64
 assign ((resid  54 and name HA   ))   ((resid  55 and name HE2  ))    5.06  3.26  0.76
 assign ((resid  55 and name HE1  ))   ((resid  74 and name HN   ))    5.50  3.70  0.83
 assign ((resid  55 and name HE2  ))   ((resid  74 and name HN   ))    6.00  4.20  0.90
 assign ((resid  55 and name HD1  ))   ((resid  74 and name HN   ))    5.09  3.29  0.76
 assign ((resid  55 and name HD2  ))   ((resid  74 and name HN   ))    5.70  3.90  0.86
 assign ((resid  40 and name HN   ))   ((resid  66 and name HE3  ))    5.18  3.38  0.78
 assign ((resid  40 and name HB   ))   ((resid  66 and name HE3  ))    5.27  3.47  0.79
 assign ((resid  40 and name HG11 ))   ((resid  66 and name HE3  ))    5.78  3.98  0.87
 assign ((resid  61 and name HD2  ))   ((resid  66 and name HH2  ))    4.88  3.08  0.73
 assign ((resid  46 and name HB1  ))   ((resid  55 and name HD2  ))    3.64  1.84  0.55
 assign ((resid   4 and name HB*  ))   ((resid   5 and name HN   ))    4.29  2.49  0.64
 assign ((resid   4 and name HG*  ))   ((resid   5 and name HN   ))    3.98  2.18  0.60
 assign ((resid   5 and name HN   ))   ((resid   5 and name HB*  ))    3.04  1.24  0.46
 assign ((resid   5 and name HA   ))   ((resid   7 and name HG*  ))    4.65  2.85  0.70
 assign ((resid   5 and name HB*  ))   ((resid   6 and name HN   ))    3.55  1.75  0.53
 assign ((resid   5 and name HG*  ))   ((resid   6 and name HN   ))    4.56  2.76  0.68
 assign ((resid   5 and name HG*  ))   ((resid   8 and name HD1  ))    4.67  2.87  0.70
 assign ((resid   5 and name HG*  ))   ((resid   8 and name HE*  ))    5.61  3.81  0.84
 assign ((resid   6 and name HN   ))   ((resid   6 and name HB*  ))    3.59  1.79  0.54
 assign ((resid   6 and name HN   ))   ((resid   6 and name HG*  ))    4.53  2.73  0.68
 assign ((resid   6 and name HN   ))   ((resid   7 and name HG*  ))    4.87  3.07  0.73
 assign ((resid   6 and name HA   ))   ((resid   6 and name HG*  ))    3.69  1.89  0.55
 assign ((resid   6 and name HA   ))   ((resid   9 and name HB*  ))    3.38  1.58  0.51
 assign ((resid   6 and name HA   ))   ((resid   9 and name HG*  ))    4.34  2.54  0.65
 assign ((resid   6 and name HA   ))   ((resid   9 and name HD*  ))    4.62  2.82  0.69
 assign ((resid   6 and name HA   ))   ((resid  10 and name HG*  ))    5.52  3.72  0.83
 assign ((resid   6 and name HB*  ))   ((resid   7 and name HN   ))    3.06  1.26  0.46
 assign ((resid   6 and name HB*  ))   ((resid  10 and name HE*  ))    4.25  2.45  0.64
 assign ((resid   6 and name HG*  ))   ((resid   7 and name HN   ))    4.71  2.91  0.71
 assign ((resid   6 and name HG*  ))   ((resid  10 and name HE*  ))    3.66  1.86  0.55
 assign ((resid   7 and name HN   ))   ((resid   7 and name HB*  ))    2.95  1.15  0.44
 assign ((resid   7 and name HN   ))   ((resid   7 and name HG*  ))    3.13  1.33  0.47
 assign ((resid   7 and name HA   ))   ((resid  10 and name HG*  ))    4.14  2.34  0.62
 assign ((resid   7 and name HA   ))   ((resid  10 and name HE*  ))    5.16  3.36  0.77
 assign ((resid   7 and name HB*  ))   ((resid   7 and name HG*  ))    2.25  0.45  0.34
 assign ((resid   7 and name HB*  ))   ((resid   8 and name HN   ))    3.50  1.70  0.53
 assign ((resid   7 and name HB*  ))   ((resid   8 and name HD2  ))    4.17  2.37  0.63
 assign ((resid   7 and name HB*  ))   ((resid  40 and name HD1* ))    4.34  2.54  0.65
 assign ((resid   7 and name HB*  ))   ((resid  66 and name HE1  ))    4.42  2.62  0.66
 assign ((resid   7 and name HB*  ))   ((resid  66 and name HZ2  ))    3.59  1.79  0.54
 assign ((resid   7 and name HB*  ))   ((resid  66 and name HH2  ))    4.42  2.62  0.66
 assign ((resid   7 and name HG*  ))   ((resid   8 and name HN   ))    4.09  2.29  0.61
 assign ((resid   7 and name HG*  ))   ((resid   9 and name HN   ))    5.81  4.01  0.87
 assign ((resid   7 and name HG*  ))   ((resid  40 and name HD1* ))    4.82  3.02  0.72
 assign ((resid   7 and name HG*  ))   ((resid  66 and name HE1  ))    5.18  3.38  0.78
 assign ((resid   7 and name HG*  ))   ((resid  66 and name HZ2  ))    3.80  2.00  0.57
 assign ((resid   7 and name HG*  ))   ((resid  66 and name HH2  ))    5.28  3.48  0.79
 assign ((resid   8 and name HN   ))   ((resid   8 and name HG*  ))    3.86  2.06  0.58
 assign ((resid   8 and name HN   ))   ((resid   8 and name HE*  ))    5.05  3.25  0.76
 assign ((resid   8 and name HA   ))   ((resid   8 and name HG*  ))    3.38  1.58  0.51
 assign ((resid   8 and name HA   ))   ((resid   8 and name HE*  ))    5.81  4.01  0.87
 assign ((resid   8 and name HA   ))   ((resid  12 and name HE*  ))    5.66  3.86  0.85
 assign ((resid   8 and name HB1  ))   ((resid  12 and name HE*  ))    4.73  2.93  0.71
 assign ((resid   8 and name HG*  ))   ((resid  11 and name HG2* ))    5.73  3.93  0.86
 assign ((resid   8 and name HG*  ))   ((resid  40 and name HG2* ))    5.51  3.71  0.83
 assign ((resid   9 and name HN   ))   ((resid   9 and name HB*  ))    2.78  0.98  0.42
 assign ((resid   9 and name HN   ))   ((resid   9 and name HG*  ))    4.01  2.21  0.60
 assign ((resid   9 and name HA   ))   ((resid  12 and name HD*  ))    5.12  3.32  0.77
 assign ((resid   9 and name HA   ))   ((resid  12 and name HE*  ))    3.81  2.01  0.57
 assign ((resid   9 and name HB*  ))   ((resid   9 and name HD*  ))    3.29  1.49  0.49
 assign ((resid   9 and name HB*  ))   ((resid  10 and name HN   ))    3.12  1.32  0.47
 assign ((resid   9 and name HG*  ))   ((resid  10 and name HN   ))    4.16  2.36  0.62
 assign ((resid  10 and name HN   ))   ((resid  10 and name HG*  ))    3.15  1.35  0.47
 assign ((resid  10 and name HN   ))   ((resid  10 and name HE*  ))    4.21  2.41  0.63
 assign ((resid  10 and name HA   ))   ((resid  10 and name HG*  ))    3.42  1.62  0.51
 assign ((resid  10 and name HB1  ))   ((resid  10 and name HE*  ))    4.77  2.97  0.72
 assign ((resid  10 and name HG*  ))   ((resid  10 and name HE*  ))    3.00  1.20  0.45
 assign ((resid  10 and name HG*  ))   ((resid  11 and name HN   ))    4.72  2.92  0.71
 assign ((resid  10 and name HG*  ))   ((resid  14 and name HG2* ))    5.56  3.76  0.83
 assign ((resid  10 and name HG*  ))   ((resid  66 and name HD1  ))    4.74  2.94  0.71
 assign ((resid  10 and name HG*  ))   ((resid  66 and name HE1  ))    5.40  3.60  0.81
 assign ((resid  10 and name HE*  ))   ((resid  66 and name HE1  ))    5.81  4.01  0.87
 assign ((resid  12 and name HN   ))   ((resid  12 and name HD*  ))    4.99  3.19  0.75
 assign ((resid  12 and name HA   ))   ((resid  12 and name HE*  ))    5.19  3.39  0.78
 assign ((resid  12 and name HB1  ))   ((resid  12 and name HD*  ))    3.17  1.37  0.48
 assign ((resid  12 and name HB1  ))   ((resid  12 and name HE*  ))    4.05  2.25  0.61
 assign ((resid  12 and name HB1  ))   ((resid  30 and name HG*  ))    4.91  3.11  0.74
 assign ((resid  12 and name HG1  ))   ((resid  12 and name HE*  ))    3.72  1.92  0.56
 assign ((resid  12 and name HD*  ))   ((resid  30 and name HA   ))    4.52  2.72  0.68
 assign ((resid  12 and name HD*  ))   ((resid  30 and name HB   ))    5.14  3.34  0.77
 assign ((resid  12 and name HD*  ))   ((resid  30 and name HG*  ))    3.17  1.37  0.48
 assign ((resid  12 and name HD*  ))   ((resid  33 and name HG2* ))    3.74  1.94  0.56
 assign ((resid  12 and name HE*  ))   ((resid  30 and name HB   ))    5.23  3.43  0.78
 assign ((resid  12 and name HE*  ))   ((resid  30 and name HG*  ))    4.63  2.83  0.69
 assign ((resid  12 and name HE*  ))   ((resid  33 and name HG2* ))    4.56  2.76  0.68
 assign ((resid  13 and name HN   ))   ((resid  16 and name HD*  ))    4.73  2.93  0.71
 assign ((resid  13 and name HA   ))   ((resid  16 and name HD*  ))    4.22  2.42  0.63
 assign ((resid  13 and name HG1  ))   ((resid  16 and name HD*  ))    5.05  3.25  0.76
 assign ((resid  14 and name HN   ))   ((resid  17 and name HG*  ))    5.28  3.48  0.79
 assign ((resid  14 and name HA   ))   ((resid  17 and name HG*  ))    3.70  1.90  0.56
 assign ((resid  14 and name HA   ))   ((resid  18 and name HD*  ))    5.81  4.01  0.87
 assign ((resid  14 and name HG2* ))   ((resid  17 and name HG*  ))    5.57  3.77  0.84
 assign ((resid  16 and name HN   ))   ((resid  16 and name HD*  ))    3.94  2.14  0.59
 assign ((resid  16 and name HN   ))   ((resid  17 and name HG*  ))    4.98  3.18  0.75
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HD*  ))    3.45  1.65  0.52
 assign ((resid  16 and name HB2  ))   ((resid  16 and name HE*  ))    4.67  2.87  0.70
 assign ((resid  16 and name HB1  ))   ((resid  16 and name HD*  ))    2.69  0.89  0.40
 assign ((resid  16 and name HB1  ))   ((resid  17 and name HG*  ))    5.81  4.01  0.87
 assign ((resid  16 and name HG2  ))   ((resid  17 and name HG*  ))    5.33  3.53  0.80
 assign ((resid  16 and name HG1  ))   ((resid  16 and name HE*  ))    3.57  1.77  0.54
 assign ((resid  16 and name HD*  ))   ((resid  17 and name HN   ))    4.87  3.07  0.73
 assign ((resid  16 and name HD*  ))   ((resid  17 and name HG*  ))    5.16  3.36  0.77
 assign ((resid  16 and name HE*  ))   ((resid  17 and name HG*  ))    5.61  3.81  0.84
 assign ((resid  16 and name HE*  ))   ((resid  28 and name HB   ))    5.18  3.38  0.78
 assign ((resid  17 and name HN   ))   ((resid  17 and name HG*  ))    3.00  1.20  0.45
 assign ((resid  17 and name HA   ))   ((resid  17 and name HG*  ))    3.25  1.45  0.49
 assign ((resid  17 and name HG*  ))   ((resid  18 and name HN   ))    4.00  2.20  0.60
 assign ((resid  17 and name HG*  ))   ((resid  20 and name HD1* ))    4.25  2.45  0.64
 assign ((resid  18 and name HN   ))   ((resid  18 and name HD*  ))    3.74  1.94  0.56
 assign ((resid  18 and name HN   ))   ((resid  18 and name HE*  ))    5.14  3.34  0.77
 assign ((resid  18 and name HA   ))   ((resid  18 and name HD*  ))    3.15  1.35  0.47
 assign ((resid  18 and name HA   ))   ((resid  18 and name HE*  ))    4.62  2.82  0.69
 assign ((resid  18 and name HA   ))   ((resid  21 and name HG*  ))    3.55  1.75  0.53
 assign ((resid  18 and name HB2  ))   ((resid  18 and name HD*  ))    3.57  1.77  0.54
 assign ((resid  18 and name HB2  ))   ((resid  18 and name HE*  ))    5.29  3.49  0.79
 assign ((resid  18 and name HB1  ))   ((resid  18 and name HD*  ))    3.71  1.91  0.56
 assign ((resid  18 and name HB1  ))   ((resid  18 and name HE*  ))    4.70  2.90  0.70
 assign ((resid  18 and name HG2  ))   ((resid  18 and name HE*  ))    3.68  1.88  0.55
 assign ((resid  18 and name HD*  ))   ((resid  19 and name HN   ))    5.14  3.34  0.77
 assign ((resid  18 and name HD*  ))   ((resid  68 and name HG2* ))    4.41  2.61  0.66
 assign ((resid  18 and name HD*  ))   ((resid  71 and name HD1* ))    4.85  3.05  0.73
 assign ((resid  18 and name HE*  ))   ((resid  68 and name HG1* ))    4.01  2.21  0.60
 assign ((resid  18 and name HE*  ))   ((resid  68 and name HG2* ))    3.72  1.92  0.56
 assign ((resid  18 and name HE*  ))   ((resid  71 and name HD1* ))    5.29  3.49  0.79
 assign ((resid  19 and name HA   ))   ((resid  22 and name HG*  ))    4.30  2.50  0.65
 assign ((resid  19 and name HA   ))   ((resid  22 and name HE*  ))    5.26  3.46  0.79
 assign ((resid  19 and name HD1* ))   ((resid  22 and name HE*  ))    5.04  3.24  0.76
 assign ((resid  19 and name HD2* ))   ((resid  22 and name HE*  ))    4.50  2.70  0.68
 assign ((resid  20 and name HB2  ))   ((resid  21 and name HG*  ))    5.81  4.01  0.87
 assign ((resid  20 and name HB1  ))   ((resid  21 and name HG*  ))    5.50  3.70  0.83
 assign ((resid  21 and name HN   ))   ((resid  21 and name HG*  ))    2.88  1.08  0.43
 assign ((resid  21 and name HA   ))   ((resid  21 and name HG*  ))    3.24  1.44  0.49
 assign ((resid  21 and name HB2  ))   ((resid  21 and name HG*  ))    2.30  0.50  0.34
 assign ((resid  21 and name HB2  ))   ((resid  22 and name HG*  ))    3.61  1.81  0.54
 assign ((resid  21 and name HG*  ))   ((resid  22 and name HN   ))    4.30  2.50  0.65
 assign ((resid  22 and name HN   ))   ((resid  22 and name HE*  ))    5.02  3.22  0.75
 assign ((resid  22 and name HA   ))   ((resid  22 and name HG*  ))    3.42  1.62  0.51
 assign ((resid  22 and name HB2  ))   ((resid  22 and name HE*  ))    4.22  2.42  0.63
 assign ((resid  22 and name HB1  ))   ((resid  22 and name HE*  ))    4.16  2.36  0.62
 assign ((resid  22 and name HG*  ))   ((resid  22 and name HE*  ))    3.19  1.39  0.48
 assign ((resid  22 and name HG*  ))   ((resid  23 and name HN   ))    4.16  2.36  0.62
 assign ((resid  22 and name HG*  ))   ((resid  23 and name HB2  ))    5.81  4.01  0.87
 assign ((resid  22 and name HG*  ))   ((resid  71 and name HG2* ))    5.02  3.22  0.75
 assign ((resid  22 and name HG*  ))   ((resid  71 and name HD1* ))    5.08  3.28  0.76
 assign ((resid  22 and name HE*  ))   ((resid  71 and name HB   ))    5.17  3.37  0.78
 assign ((resid  22 and name HE*  ))   ((resid  71 and name HG2* ))    4.02  2.22  0.60
 assign ((resid  22 and name HE*  ))   ((resid  71 and name HD1* ))    4.28  2.48  0.64
 assign ((resid  23 and name HN   ))   ((resid  24 and name HG*  ))    5.74  3.94  0.86
 assign ((resid  24 and name HB2  ))   ((resid  25 and name HD2* ))    4.95  3.15  0.74
 assign ((resid  24 and name HG*  ))   ((resid  25 and name HN   ))    5.09  3.29  0.76
 assign ((resid  24 and name HG*  ))   ((resid  25 and name HD2* ))    4.98  3.18  0.75
 assign ((resid  24 and name HG*  ))   ((resid  26 and name HN   ))    5.81  4.01  0.87
 assign ((resid  25 and name HA   ))   ((resid  25 and name HD2* ))    3.17  1.37  0.48
 assign ((resid  25 and name HB*  ))   ((resid  25 and name HD2* ))    3.22  1.42  0.48
 assign ((resid  26 and name HN   ))   ((resid  26 and name HB*  ))    3.15  1.35  0.47
 assign ((resid  26 and name HB*  ))   ((resid  46 and name HG   ))    4.24  2.44  0.64
 assign ((resid  26 and name HB*  ))   ((resid  46 and name HD1* ))    4.26  2.46  0.64
 assign ((resid  26 and name HB*  ))   ((resid  46 and name HD2* ))    3.61  1.81  0.54
 assign ((resid  26 and name HB*  ))   ((resid  47 and name HN   ))    4.36  2.56  0.65
 assign ((resid  27 and name HN   ))   ((resid  27 and name HB*  ))    3.19  1.39  0.48
 assign ((resid  27 and name HN   ))   ((resid  27 and name HG*  ))    4.46  2.66  0.67
 assign ((resid  27 and name HN   ))   ((resid  47 and name HB*  ))    3.61  1.81  0.54
 assign ((resid  27 and name HN   ))   ((resid  47 and name HG*  ))    5.29  3.49  0.79
 assign ((resid  27 and name HA   ))   ((resid  27 and name HD*  ))    4.61  2.81  0.69
 assign ((resid  27 and name HA   ))   ((resid  27 and name HE*  ))    4.81  3.01  0.72
 assign ((resid  27 and name HB*  ))   ((resid  27 and name HD*  ))    2.36  0.56  0.35
 assign ((resid  27 and name HB*  ))   ((resid  27 and name HE*  ))    3.13  1.33  0.47
 assign ((resid  27 and name HB*  ))   ((resid  28 and name HN   ))    3.63  1.83  0.54
 assign ((resid  27 and name HG*  ))   ((resid  27 and name HE*  ))    3.33  1.53  0.50
 assign ((resid  27 and name HG*  ))   ((resid  28 and name HN   ))    4.08  2.28  0.61
 assign ((resid  27 and name HD*  ))   ((resid  28 and name HN   ))    5.28  3.48  0.79
 assign ((resid  28 and name HG1* ))   ((resid  29 and name HG*  ))    5.26  3.46  0.79
 assign ((resid  29 and name HN   ))   ((resid  29 and name HB*  ))    3.46  1.66  0.52
 assign ((resid  29 and name HN   ))   ((resid  29 and name HG*  ))    4.49  2.69  0.67
 assign ((resid  29 and name HN   ))   ((resid  29 and name HE*  ))    5.81  4.01  0.87
 assign ((resid  29 and name HN   ))   ((resid  45 and name HG*  ))    5.81  4.01  0.87
 assign ((resid  29 and name HB*  ))   ((resid  45 and name HN   ))    3.61  1.81  0.54
 assign ((resid  29 and name HB*  ))   ((resid  45 and name HB1  ))    3.13  1.33  0.47
 assign ((resid  30 and name HG*  ))   ((resid  31 and name HN   ))    3.14  1.34  0.47
 assign ((resid  30 and name HG*  ))   ((resid  31 and name HB1  ))    5.41  3.61  0.81
 assign ((resid  30 and name HG*  ))   ((resid  32 and name HN   ))    3.46  1.66  0.52
 assign ((resid  30 and name HG*  ))   ((resid  32 and name HA   ))    4.31  2.51  0.65
 assign ((resid  30 and name HG*  ))   ((resid  43 and name HB2  ))    4.93  3.13  0.74
 assign ((resid  30 and name HG*  ))   ((resid  44 and name HA   ))    4.56  2.76  0.68
 assign ((resid  31 and name HN   ))   ((resid  31 and name HG*  ))    4.75  2.95  0.71
 assign ((resid  31 and name HN   ))   ((resid  31 and name HD*  ))    4.71  2.91  0.71
 assign ((resid  31 and name HA   ))   ((resid  31 and name HG*  ))    3.45  1.65  0.52
 assign ((resid  31 and name HB2  ))   ((resid  31 and name HD*  ))    3.47  1.67  0.52
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HG*  ))    2.26  0.46  0.34
 assign ((resid  31 and name HB1  ))   ((resid  31 and name HD*  ))    3.30  1.50  0.50
 assign ((resid  31 and name HB1  ))   ((resid  43 and name HG*  ))    5.74  3.94  0.86
 assign ((resid  31 and name HG*  ))   ((resid  32 and name HN   ))    3.66  1.86  0.55
 assign ((resid  31 and name HG*  ))   ((resid  43 and name HA   ))    5.81  4.01  0.87
 assign ((resid  31 and name HG*  ))   ((resid  43 and name HB2  ))    4.54  2.74  0.68
 assign ((resid  31 and name HG*  ))   ((resid  43 and name HB1  ))    3.67  1.87  0.55
 assign ((resid  31 and name HG*  ))   ((resid  44 and name HA   ))    5.81  4.01  0.87
 assign ((resid  31 and name HD*  ))   ((resid  32 and name HN   ))    5.10  3.30  0.77
 assign ((resid  31 and name HD*  ))   ((resid  45 and name HB2  ))    3.93  2.13  0.59
 assign ((resid  32 and name HN   ))   ((resid  32 and name HB*  ))    3.24  1.44  0.49
 assign ((resid  32 and name HN   ))   ((resid  32 and name HG*  ))    4.73  2.93  0.71
 assign ((resid  32 and name HA   ))   ((resid  32 and name HD*  ))    4.48  2.68  0.67
 assign ((resid  32 and name HB*  ))   ((resid  32 and name HD*  ))    3.13  1.33  0.47
 assign ((resid  32 and name HB*  ))   ((resid  33 and name HN   ))    4.04  2.24  0.61
 assign ((resid  32 and name HB*  ))   ((resid  33 and name HA   ))    4.53  2.73  0.68
 assign ((resid  32 and name HB*  ))   ((resid  43 and name HN   ))    4.57  2.77  0.69
 assign ((resid  32 and name HB*  ))   ((resid  43 and name HB2  ))    3.64  1.84  0.55
 assign ((resid  32 and name HG*  ))   ((resid  33 and name HN   ))    3.94  2.14  0.59
 assign ((resid  32 and name HD*  ))   ((resid  33 and name HN   ))    5.16  3.36  0.77
 assign ((resid  32 and name HD*  ))   ((resid  34 and name HE*  ))    5.17  3.37  0.78
 assign ((resid  34 and name HN   ))   ((resid  34 and name HB*  ))    3.38  1.58  0.51
 assign ((resid  34 and name HN   ))   ((resid  34 and name HG*  ))    4.17  2.37  0.63
 assign ((resid  34 and name HB*  ))   ((resid  40 and name HG2* ))    4.69  2.89  0.70
 assign ((resid  35 and name HA   ))   ((resid  35 and name HG*  ))    3.64  1.84  0.55
 assign ((resid  35 and name HA   ))   ((resid  35 and name HD*  ))    3.83  2.03  0.57
 assign ((resid  35 and name HA   ))   ((resid  35 and name HE*  ))    5.18  3.38  0.78
 assign ((resid  35 and name HB*  ))   ((resid  35 and name HD*  ))    2.83  1.03  0.42
 assign ((resid  35 and name HB*  ))   ((resid  35 and name HE*  ))    4.23  2.43  0.63
 assign ((resid  35 and name HB*  ))   ((resid  36 and name HN   ))    3.72  1.92  0.56
 assign ((resid  35 and name HB*  ))   ((resid  36 and name HA   ))    5.81  4.01  0.87
 assign ((resid  35 and name HB*  ))   ((resid  40 and name HA   ))    5.81  4.01  0.87
 assign ((resid  35 and name HB*  ))   ((resid  40 and name HG2* ))    4.61  2.81  0.69
 assign ((resid  35 and name HB*  ))   ((resid  40 and name HD1* ))    5.07  3.27  0.76
 assign ((resid  35 and name HG*  ))   ((resid  35 and name HE*  ))    3.29  1.49  0.49
 assign ((resid  35 and name HG*  ))   ((resid  36 and name HN   ))    3.38  1.58  0.51
 assign ((resid  35 and name HG*  ))   ((resid  36 and name HA   ))    5.32  3.52  0.80
 assign ((resid  35 and name HG*  ))   ((resid  40 and name HA   ))    5.48  3.68  0.82
 assign ((resid  35 and name HG*  ))   ((resid  40 and name HG2* ))    5.12  3.32  0.77
 assign ((resid  35 and name HG*  ))   ((resid  40 and name HG12 ))    3.81  2.01  0.57
 assign ((resid  35 and name HG*  ))   ((resid  40 and name HD1* ))    5.27  3.47  0.79
 assign ((resid  35 and name HG*  ))   ((resid  66 and name HH2  ))    5.45  3.65  0.82
 assign ((resid  35 and name HD*  ))   ((resid  36 and name HA   ))    4.55  2.75  0.68
 assign ((resid  35 and name HD*  ))   ((resid  40 and name HD1* ))    4.86  3.06  0.73
 assign ((resid  35 and name HE*  ))   ((resid  36 and name HN   ))    4.91  3.11  0.74
 assign ((resid  35 and name HE*  ))   ((resid  40 and name HD1* ))    4.35  2.55  0.65
 assign ((resid  35 and name HE*  ))   ((resid  66 and name HH2  ))    4.81  3.01  0.72
 assign ((resid  36 and name HN   ))   ((resid  36 and name HB*  ))    3.26  1.46  0.49
 assign ((resid  36 and name HN   ))   ((resid  36 and name HG*  ))    4.89  3.09  0.73
 assign ((resid  36 and name HA   ))   ((resid  36 and name HG*  ))    3.55  1.75  0.53
 assign ((resid  36 and name HA   ))   ((resid  36 and name HE*  ))    4.84  3.04  0.73
 assign ((resid  36 and name HB*  ))   ((resid  39 and name HN   ))    4.37  2.57  0.66
 assign ((resid  36 and name HB*  ))   ((resid  39 and name HB   ))    3.75  1.95  0.56
 assign ((resid  37 and name HA*  ))   ((resid  39 and name HN   ))    4.33  2.53  0.65
 assign ((resid  38 and name HN   ))   ((resid  38 and name HD2* ))    5.81  4.01  0.87
 assign ((resid  38 and name HA   ))   ((resid  38 and name HD2* ))    3.26  1.46  0.49
 assign ((resid  38 and name HB*  ))   ((resid  38 and name HD2* ))    3.23  1.43  0.48
 assign ((resid  38 and name HB*  ))   ((resid  60 and name HA   ))    5.33  3.53  0.80
 assign ((resid  38 and name HB*  ))   ((resid  60 and name HG2  ))    4.89  3.09  0.73
 assign ((resid  38 and name HB*  ))   ((resid  61 and name HN   ))    4.25  2.45  0.64
 assign ((resid  38 and name HB*  ))   ((resid  61 and name HB2  ))    5.14  3.34  0.77
 assign ((resid  38 and name HB*  ))   ((resid  61 and name HB1  ))    4.42  2.62  0.66
 assign ((resid  38 and name HB*  ))   ((resid  61 and name HG2  ))    5.80  4.00  0.87
 assign ((resid  39 and name HG2* ))   ((resid  41 and name HD*  ))    5.12  3.32  0.77
 assign ((resid  41 and name HN   ))   ((resid  41 and name HD*  ))    4.63  2.83  0.69
 assign ((resid  41 and name HA   ))   ((resid  41 and name HD*  ))    4.62  2.82  0.69
 assign ((resid  41 and name HB1  ))   ((resid  41 and name HD*  ))    3.17  1.37  0.48
 assign ((resid  41 and name HD*  ))   ((resid  58 and name HA   ))    5.23  3.43  0.78
 assign ((resid  41 and name HD*  ))   ((resid  58 and name HG2  ))    3.77  1.97  0.57
 assign ((resid  41 and name HD*  ))   ((resid  58 and name HG1  ))    4.73  2.93  0.71
 assign ((resid  43 and name HN   ))   ((resid  43 and name HG*  ))    3.69  1.89  0.55
 assign ((resid  43 and name HA   ))   ((resid  43 and name HG*  ))    3.55  1.75  0.53
 assign ((resid  43 and name HG*  ))   ((resid  44 and name HN   ))    4.33  2.53  0.65
 assign ((resid  43 and name HG*  ))   ((resid  44 and name HD1* ))    5.29  3.49  0.79
 assign ((resid  43 and name HG*  ))   ((resid  55 and name HN   ))    5.81  4.01  0.87
 assign ((resid  43 and name HG*  ))   ((resid  57 and name HN   ))    4.90  3.10  0.74
 assign ((resid  45 and name HN   ))   ((resid  45 and name HG*  ))    4.78  2.98  0.72
 assign ((resid  45 and name HA   ))   ((resid  45 and name HG*  ))    3.64  1.84  0.55
 assign ((resid  45 and name HA   ))   ((resid  54 and name HD2* ))    4.98  3.18  0.75
 assign ((resid  45 and name HB2  ))   ((resid  54 and name HD2* ))    4.80  3.00  0.72
 assign ((resid  45 and name HG*  ))   ((resid  46 and name HN   ))    3.40  1.60  0.51
 assign ((resid  45 and name HG*  ))   ((resid  52 and name HB*  ))    4.75  2.95  0.71
 assign ((resid  45 and name HG*  ))   ((resid  52 and name HG*  ))    3.58  1.78  0.54
 assign ((resid  45 and name HG*  ))   ((resid  53 and name HN   ))    3.90  2.10  0.59
 assign ((resid  45 and name HG*  ))   ((resid  54 and name HN   ))    5.81  4.01  0.87
 assign ((resid  45 and name HG*  ))   ((resid  54 and name HA   ))    5.15  3.35  0.77
 assign ((resid  45 and name HG*  ))   ((resid  54 and name HD2* ))    4.05  2.25  0.61
 assign ((resid  45 and name HG*  ))   ((resid  55 and name HN   ))    5.81  4.01  0.87
 assign ((resid  46 and name HD2* ))   ((resid  47 and name HB*  ))    4.74  2.94  0.71
 assign ((resid  47 and name HN   ))   ((resid  47 and name HB*  ))    3.25  1.45  0.49
 assign ((resid  47 and name HN   ))   ((resid  47 and name HG*  ))    3.61  1.81  0.54
 assign ((resid  47 and name HA   ))   ((resid  47 and name HG*  ))    3.72  1.92  0.56
 assign ((resid  47 and name HB*  ))   ((resid  47 and name HD*  ))    2.71  0.91  0.41
 assign ((resid  47 and name HB*  ))   ((resid  48 and name HN   ))    3.74  1.94  0.56
 assign ((resid  47 and name HB*  ))   ((resid  52 and name HA   ))    5.81  4.01  0.87
 assign ((resid  47 and name HG*  ))   ((resid  48 and name HN   ))    4.28  2.48  0.64
 assign ((resid  47 and name HG*  ))   ((resid  52 and name HA   ))    3.79  1.99  0.57
 assign ((resid  48 and name HN   ))   ((resid  51 and name HB*  ))    3.83  2.03  0.57
 assign ((resid  48 and name HN   ))   ((resid  51 and name HG*  ))    5.16  3.36  0.77
 assign ((resid  48 and name HB   ))   ((resid  51 and name HB*  ))    4.36  2.56  0.65
 assign ((resid  48 and name HG2* ))   ((resid  49 and name HB*  ))    4.05  2.25  0.61
 assign ((resid  48 and name HG2* ))   ((resid  51 and name HB*  ))    4.76  2.96  0.71
 assign ((resid  49 and name HB*  ))   ((resid  51 and name HN   ))    5.39  3.59  0.81
 assign ((resid  49 and name HB*  ))   ((resid  51 and name HB*  ))    5.31  3.51  0.80
 assign ((resid  51 and name HN   ))   ((resid  51 and name HB*  ))    2.94  1.14  0.44
 assign ((resid  51 and name HN   ))   ((resid  51 and name HG*  ))    3.51  1.71  0.53
 assign ((resid  51 and name HN   ))   ((resid  51 and name HD*  ))    5.10  3.30  0.77
 assign ((resid  51 and name HA   ))   ((resid  51 and name HG*  ))    3.69  1.89  0.55
 assign ((resid  51 and name HB*  ))   ((resid  51 and name HD*  ))    3.23  1.43  0.48
 assign ((resid  51 and name HB*  ))   ((resid  51 and name HE*  ))    5.02  3.22  0.75
 assign ((resid  51 and name HB*  ))   ((resid  52 and name HN   ))    3.79  1.99  0.57
 assign ((resid  51 and name HG*  ))   ((resid  51 and name HE*  ))    3.33  1.53  0.50
 assign ((resid  51 and name HG*  ))   ((resid  52 and name HN   ))    4.98  3.18  0.75
 assign ((resid  52 and name HN   ))   ((resid  52 and name HG*  ))    4.43  2.63  0.66
 assign ((resid  52 and name HN   ))   ((resid  52 and name HD*  ))    5.81  4.01  0.87
 assign ((resid  52 and name HA   ))   ((resid  52 and name HD*  ))    5.11  3.31  0.77
 assign ((resid  52 and name HB*  ))   ((resid  52 and name HD*  ))    2.44  0.64  0.37
 assign ((resid  52 and name HB*  ))   ((resid  52 and name HE*  ))    3.92  2.12  0.59
 assign ((resid  52 and name HB*  ))   ((resid  53 and name HN   ))    3.80  2.00  0.57
 assign ((resid  52 and name HG*  ))   ((resid  52 and name HE*  ))    3.31  1.51  0.50
 assign ((resid  52 and name HG*  ))   ((resid  53 and name HA   ))    5.43  3.63  0.81
 assign ((resid  52 and name HD*  ))   ((resid  54 and name HD2* ))    5.07  3.27  0.76
 assign ((resid  53 and name HN   ))   ((resid  53 and name HG*  ))    4.56  2.76  0.68
 assign ((resid  53 and name HA   ))   ((resid  53 and name HG*  ))    3.35  1.55  0.50
 assign ((resid  53 and name HG*  ))   ((resid  54 and name HN   ))    4.61  2.81  0.69
 assign ((resid  53 and name HG*  ))   ((resid  55 and name HE2  ))    4.95  3.15  0.74
 assign ((resid  54 and name HN   ))   ((resid  54 and name HD2* ))    4.63  2.83  0.69
 assign ((resid  54 and name HA   ))   ((resid  54 and name HD2* ))    4.58  2.78  0.69
 assign ((resid  55 and name HA   ))   ((resid  73 and name HG*  ))    4.93  3.13  0.74
 assign ((resid  55 and name HD1  ))   ((resid  73 and name HG*  ))    4.30  2.50  0.65
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HG*  ))    3.80  2.00  0.57
 assign ((resid  55 and name HE1  ))   ((resid  73 and name HD*  ))    4.26  2.46  0.64
 assign ((resid  59 and name HA   ))   ((resid  69 and name HG*  ))    4.70  2.90  0.70
 assign ((resid  59 and name HA   ))   ((resid  69 and name HD*  ))    5.28  3.48  0.79
 assign ((resid  60 and name HN   ))   ((resid  69 and name HG*  ))    4.06  2.26  0.61
 assign ((resid  60 and name HN   ))   ((resid  69 and name HD*  ))    4.52  2.72  0.68
 assign ((resid  60 and name HN   ))   ((resid  69 and name HE*  ))    5.28  3.48  0.79
 assign ((resid  60 and name HB2  ))   ((resid  69 and name HE*  ))    5.26  3.46  0.79
 assign ((resid  60 and name HG1  ))   ((resid  69 and name HD*  ))    5.81  4.01  0.87
 assign ((resid  62 and name HN   ))   ((resid  62 and name HG*  ))    4.66  2.86  0.70
 assign ((resid  62 and name HA   ))   ((resid  62 and name HG*  ))    3.50  1.70  0.53
 assign ((resid  62 and name HB*  ))   ((resid  62 and name HE*  ))    4.54  2.74  0.68
 assign ((resid  62 and name HB*  ))   ((resid  65 and name HB   ))    5.38  3.58  0.81
 assign ((resid  62 and name HB*  ))   ((resid  67 and name HN   ))    4.78  2.98  0.72
 assign ((resid  62 and name HG*  ))   ((resid  67 and name HB   ))    4.46  2.66  0.67
 assign ((resid  62 and name HG*  ))   ((resid  67 and name HG2* ))    4.88  3.08  0.73
 assign ((resid  62 and name HE*  ))   ((resid  67 and name HG2* ))    4.35  2.55  0.65
 assign ((resid  63 and name HA*  ))   ((resid  65 and name HN   ))    4.22  2.42  0.63
 assign ((resid  64 and name HA   ))   ((resid  64 and name HD2* ))    4.58  2.78  0.69
 assign ((resid  64 and name HB*  ))   ((resid  65 and name HN   ))    4.11  2.31  0.62
 assign ((resid  67 and name HB   ))   ((resid  69 and name HD*  ))    5.81  4.01  0.87
 assign ((resid  67 and name HG2* ))   ((resid  69 and name HD*  ))    3.76  1.96  0.56
 assign ((resid  67 and name HG2* ))   ((resid  69 and name HE*  ))    5.81  4.01  0.87
 assign ((resid  68 and name HA   ))   ((resid  69 and name HG*  ))    5.13  3.33  0.77
 assign ((resid  69 and name HN   ))   ((resid  69 and name HG*  ))    3.59  1.79  0.54
 assign ((resid  69 and name HN   ))   ((resid  69 and name HD*  ))    4.46  2.66  0.67
 assign ((resid  69 and name HA   ))   ((resid  69 and name HD*  ))    3.18  1.38  0.48
 assign ((resid  69 and name HA   ))   ((resid  69 and name HE*  ))    4.54  2.74  0.68
 assign ((resid  69 and name HB2  ))   ((resid  69 and name HD*  ))    3.41  1.61  0.51
 assign ((resid  69 and name HB2  ))   ((resid  69 and name HE*  ))    4.25  2.45  0.64
 assign ((resid  69 and name HB1  ))   ((resid  69 and name HD*  ))    2.58  0.78  0.39
 assign ((resid  69 and name HB1  ))   ((resid  69 and name HE*  ))    3.69  1.89  0.55
 assign ((resid  69 and name HG*  ))   ((resid  69 and name HE*  ))    3.16  1.36  0.47
 assign ((resid  69 and name HG*  ))   ((resid  70 and name HN   ))    4.08  2.28  0.61
 assign ((resid  69 and name HD*  ))   ((resid  70 and name HN   ))    5.25  3.45  0.79
 assign ((resid  70 and name HN   ))   ((resid  70 and name HG*  ))    4.42  2.62  0.66
 assign ((resid  70 and name HA   ))   ((resid  70 and name HD*  ))    4.51  2.71  0.68
 assign ((resid  70 and name HB*  ))   ((resid  70 and name HD*  ))    3.05  1.25  0.46
 assign ((resid  70 and name HG*  ))   ((resid  71 and name HN   ))    3.66  1.86  0.55
 assign ((resid  70 and name HD*  ))   ((resid  71 and name HN   ))    4.89  3.09  0.73
 assign ((resid  71 and name HN   ))   ((resid  71 and name HG1* ))    3.46  1.66  0.52
 assign ((resid  71 and name HG2* ))   ((resid  71 and name HG1* ))    2.72  0.92  0.41
 assign ((resid  71 and name HG1* ))   ((resid  72 and name HN   ))    4.61  2.81  0.69
 assign ((resid  73 and name HA   ))   ((resid  73 and name HG*  ))    3.62  1.82  0.54
 assign ((resid  73 and name HA   ))   ((resid  73 and name HD*  ))    4.28  2.48  0.64
 assign ((resid  73 and name HB2  ))   ((resid  73 and name HD*  ))    3.63  1.83  0.54
 assign ((resid  73 and name HG*  ))   ((resid  74 and name HN   ))    3.51  1.71  0.53
 assign ((resid  73 and name HG*  ))   ((resid  74 and name HA   ))    4.70  2.90  0.70
 assign ((resid  75 and name HN   ))   ((resid  75 and name HG*  ))    3.79  1.99  0.57
 assign ((resid  75 and name HA   ))   ((resid  75 and name HG*  ))    3.10  1.30  0.47
 assign ((resid  78 and name HA   ))   ((resid  78 and name HD*  ))    3.37  1.57  0.51
 assign ((resid  78 and name HB*  ))   ((resid  78 and name HG   ))    2.42  0.62  0.36
 assign ((resid  78 and name HB*  ))   ((resid  78 and name HD*  ))    2.64  0.84  0.40
 assign ((resid  78 and name HB*  ))   ((resid  79 and name HN   ))    4.10  2.30  0.62
 assign ((resid  78 and name HD*  ))   ((resid  79 and name HN   ))    4.76  2.96  0.71
 assign ((resid  78 and name HD*  ))   ((resid  79 and name HA   ))    5.60  3.80  0.84
 assign ((resid  78 and name HD*  ))   ((resid  79 and name HB*  ))    4.91  3.11  0.74
 assign ((resid  79 and name HN   ))   ((resid  79 and name HB*  ))    3.41  1.61  0.51
 assign ((resid  79 and name HA   ))   ((resid  79 and name HG*  ))    3.42  1.62  0.51
 assign ((resid  80 and name HB*  ))   ((resid  81 and name HN   ))    4.22  2.42  0.63
 assign ((resid   6 and name O    ))   ((resid  10 and name HN   ))    2.00  0.20  0.30
 assign ((resid   6 and name O    ))   ((resid  10 and name N    ))    3.00  1.20  0.45
 assign ((resid   7 and name O    ))   ((resid  11 and name HN   ))    2.00  0.20  0.30
 assign ((resid   7 and name O    ))   ((resid  11 and name N    ))    3.00  1.20  0.45
 assign ((resid   8 and name O    ))   ((resid  12 and name HN   ))    2.00  0.20  0.30
 assign ((resid   8 and name O    ))   ((resid  12 and name N    ))    3.00  1.20  0.45
 assign ((resid  10 and name O    ))   ((resid  14 and name HN   ))    2.00  0.20  0.30
 assign ((resid  10 and name O    ))   ((resid  14 and name N    ))    3.00  1.20  0.45
 assign ((resid  11 and name O    ))   ((resid  15 and name HN   ))    2.00  0.20  0.30
 assign ((resid  11 and name O    ))   ((resid  15 and name N    ))    3.00  1.20  0.45
 assign ((resid  12 and name O    ))   ((resid  16 and name HN   ))    2.00  0.20  0.30
 assign ((resid  12 and name O    ))   ((resid  16 and name N    ))    3.00  1.20  0.45
 assign ((resid  13 and name O    ))   ((resid  17 and name HN   ))    2.00  0.20  0.30
 assign ((resid  13 and name O    ))   ((resid  17 and name N    ))    3.00  1.20  0.45
 assign ((resid  15 and name O    ))   ((resid  19 and name HN   ))    2.00  0.20  0.30
 assign ((resid  15 and name O    ))   ((resid  19 and name N    ))    3.00  1.20  0.45
 assign ((resid  16 and name O    ))   ((resid  20 and name HN   ))    2.00  0.20  0.30
 assign ((resid  16 and name O    ))   ((resid  20 and name N    ))    3.00  1.20  0.45
 assign ((resid  17 and name O    ))   ((resid  21 and name HN   ))    2.00  0.20  0.30
 assign ((resid  17 and name O    ))   ((resid  21 and name N    ))    3.00  1.20  0.45
 assign ((resid  19 and name O    ))   ((resid  23 and name HN   ))    2.00  0.20  0.30
 assign ((resid  19 and name O    ))   ((resid  23 and name N    ))    3.00  1.20  0.45
 assign ((resid  31 and name HN   ))   ((resid  43 and name O    ))    2.00  0.20  0.30
 assign ((resid  31 and name N    ))   ((resid  43 and name O    ))    3.00  1.20  0.45
 assign ((resid  32 and name HN   ))   ((resid  43 and name O    ))    2.00  0.20  0.30
 assign ((resid  32 and name N    ))   ((resid  43 and name O    ))    3.00  1.20  0.45
 assign ((resid  34 and name HN   ))   ((resid  41 and name O    ))    2.00  0.20  0.30
 assign ((resid  34 and name N    ))   ((resid  41 and name O    ))    3.00  1.20  0.45
 assign ((resid  36 and name HN   ))   ((resid  39 and name O    ))    2.00  0.20  0.30
 assign ((resid  36 and name N    ))   ((resid  39 and name O    ))    3.00  1.20  0.45
 assign ((resid  36 and name O    ))   ((resid  39 and name HN   ))    2.00  0.20  0.30
 assign ((resid  36 and name O    ))   ((resid  39 and name N    ))    3.00  1.20  0.45
 assign ((resid  40 and name HN   ))   ((resid  59 and name O    ))    2.00  0.20  0.30
 assign ((resid  40 and name N    ))   ((resid  59 and name O    ))    3.00  1.20  0.45
 assign ((resid  34 and name O    ))   ((resid  41 and name HN   ))    2.00  0.20  0.30
 assign ((resid  34 and name O    ))   ((resid  41 and name N    ))    3.00  1.20  0.45
 assign ((resid  42 and name HN   ))   ((resid  57 and name O    ))    2.00  0.20  0.30
 assign ((resid  42 and name N    ))   ((resid  57 and name O    ))    3.00  1.20  0.45
 assign ((resid  32 and name O    ))   ((resid  43 and name HN   ))    2.00  0.20  0.30
 assign ((resid  32 and name O    ))   ((resid  43 and name N    ))    3.00  1.20  0.45
 assign ((resid  44 and name HN   ))   ((resid  55 and name O    ))    2.00  0.20  0.30
 assign ((resid  44 and name N    ))   ((resid  55 and name O    ))    3.00  1.20  0.45
 assign ((resid  29 and name O    ))   ((resid  45 and name HN   ))    2.00  0.20  0.30
 assign ((resid  29 and name O    ))   ((resid  45 and name N    ))    3.00  1.20  0.45
 assign ((resid  46 and name HN   ))   ((resid  53 and name O    ))    2.00  0.20  0.30
 assign ((resid  46 and name N    ))   ((resid  53 and name O    ))    3.00  1.20  0.45
 assign ((resid  48 and name HN   ))   ((resid  51 and name O    ))    2.00  0.20  0.30
 assign ((resid  48 and name N    ))   ((resid  51 and name O    ))    3.00  1.20  0.45
 assign ((resid  48 and name O    ))   ((resid  51 and name HN   ))    2.00  0.20  0.30
 assign ((resid  48 and name O    ))   ((resid  51 and name N    ))    3.00  1.20  0.45
 assign ((resid  46 and name O    ))   ((resid  53 and name HN   ))    2.00  0.20  0.30
 assign ((resid  46 and name O    ))   ((resid  53 and name N    ))    3.00  1.20  0.45
 assign ((resid  44 and name O    ))   ((resid  55 and name HN   ))    2.00  0.20  0.30
 assign ((resid  44 and name O    ))   ((resid  55 and name N    ))    3.00  1.20  0.45
 assign ((resid  56 and name HN   ))   ((resid  72 and name O    ))    2.00  0.20  0.30
 assign ((resid  56 and name N    ))   ((resid  72 and name O    ))    3.00  1.20  0.45
 assign ((resid  42 and name O    ))   ((resid  57 and name HN   ))    2.00  0.20  0.30
 assign ((resid  42 and name O    ))   ((resid  57 and name N    ))    3.00  1.20  0.45
 assign ((resid  40 and name O    ))   ((resid  59 and name HN   ))    2.00  0.20  0.30
 assign ((resid  40 and name O    ))   ((resid  59 and name N    ))    3.00  1.20  0.45
 assign ((resid  60 and name HN   ))   ((resid  67 and name O    ))    2.00  0.20  0.30
 assign ((resid  60 and name N    ))   ((resid  67 and name O    ))    3.00  1.20  0.45
 assign ((resid  38 and name O    ))   ((resid  61 and name HN   ))    2.00  0.20  0.30
 assign ((resid  38 and name O    ))   ((resid  61 and name N    ))    3.00  1.20  0.45
 assign ((resid  62 and name HN   ))   ((resid  65 and name O    ))    2.00  0.20  0.30
 assign ((resid  62 and name N    ))   ((resid  65 and name O    ))    3.00  1.20  0.45
 assign ((resid  62 and name O    ))   ((resid  65 and name HN   ))    2.00  0.20  0.30
 assign ((resid  62 and name O    ))   ((resid  65 and name N    ))    3.00  1.20  0.45
 assign ((resid  60 and name O    ))   ((resid  67 and name HN   ))    2.00  0.20  0.30
 assign ((resid  60 and name O    ))   ((resid  67 and name N    ))    3.00  1.20  0.45
 assign ((resid  58 and name O    ))   ((resid  69 and name HN   ))    2.00  0.20  0.30
 assign ((resid  58 and name O    ))   ((resid  69 and name N    ))    3.00  1.20  0.45
 assign ((resid  56 and name O    ))   ((resid  72 and name HN   ))    2.00  0.20  0.30
 assign ((resid  56 and name O    ))   ((resid  72 and name N    ))    3.00  1.20  0.45
 assign ((resid  54 and name O    ))   ((resid  74 and name HN   ))    2.00  0.20  0.30
 assign ((resid  54 and name O    ))   ((resid  74 and name N    ))    3.00  1.20  0.45
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1          1H        MET   1 -23.150  -4.095   0.379
    2    H2   MET   1          2H        MET   1 -24.532  -4.071   1.353
    3    H3   MET   1          3H        MET   1 -23.181  -4.978   1.819
    4    HA   MET   1           HA       MET   1 -23.299  -2.038   1.567
    5    HB2  MET   1          2HB       MET   1 -24.562  -2.826   3.514
    6    HB3  MET   1          3HB       MET   1 -23.225  -3.845   4.022
    7    HG2  MET   1          2HG       MET   1 -21.873  -1.847   4.494
    8    HG3  MET   1          3HG       MET   1 -23.193  -0.813   3.941
    9    HE1  MET   1          1HE       MET   1 -25.497  -0.495   5.253
   10    HE2  MET   1          2HE       MET   1 -25.934  -1.413   6.693
   11    HE3  MET   1          3HE       MET   1 -25.808  -2.228   5.134
   12    HA   PRO   2           HA       PRO   2 -18.761  -2.822   1.017
   13    HB2  PRO   2          2HB       PRO   2 -18.173  -0.057   0.870
   14    HB3  PRO   2          3HB       PRO   2 -18.512  -1.113  -0.513
   15    HG2  PRO   2          2HG       PRO   2 -20.347   0.769   0.907
   16    HG3  PRO   2          3HG       PRO   2 -20.256   0.383  -0.827
   17    HD2  PRO   2          2HD       PRO   2 -22.201  -0.629   0.745
   18    HD3  PRO   2          3HD       PRO   2 -21.518  -1.574  -0.593
   19    H    SER   3           H        SER   3 -18.476  -3.627   3.061
   20    HA   SER   3           HA       SER   3 -18.753  -2.134   5.489
   21    HB2  SER   3          2HB       SER   3 -17.410  -4.826   4.965
   22    HB3  SER   3          3HB       SER   3 -17.834  -4.188   6.559
   23    HG   SER   3           HG       SER   3 -19.794  -4.448   4.546
   24    H    GLU   4           H        GLU   4 -17.310  -0.783   6.312
   25    HA   GLU   4           HA       GLU   4 -15.002   0.081   5.089
   26    HB2  GLU   4          2HB       GLU   4 -16.225   1.414   6.762
   27    HB3  GLU   4          3HB       GLU   4 -15.709   0.321   8.042
   28    HG2  GLU   4          2HG       GLU   4 -14.423   2.458   7.991
   29    HG3  GLU   4          3HG       GLU   4 -13.390   1.040   7.790
   30    H    GLU   5           H        GLU   5 -15.362  -2.328   7.584
   31    HA   GLU   5           HA       GLU   5 -12.692  -2.738   8.332
   32    HB2  GLU   5          2HB       GLU   5 -14.910  -4.851   8.291
   33    HB3  GLU   5          3HB       GLU   5 -13.433  -4.906   9.244
   34    HG2  GLU   5          2HG       GLU   5 -15.169  -4.326  10.759
   35    HG3  GLU   5          3HG       GLU   5 -14.256  -2.849  10.478
   36    H    GLU   6           H        GLU   6 -14.670  -4.151   5.791
   37    HA   GLU   6           HA       GLU   6 -12.736  -6.009   4.796
   38    HB2  GLU   6          2HB       GLU   6 -15.242  -6.269   4.588
   39    HB3  GLU   6          3HB       GLU   6 -15.239  -4.954   3.419
   40    HG2  GLU   6          2HG       GLU   6 -13.820  -6.288   1.902
   41    HG3  GLU   6          3HG       GLU   6 -13.776  -7.596   3.085
   42    H    GLU   7           H        GLU   7 -13.494  -2.643   4.190
   43    HA   GLU   7           HA       GLU   7 -12.243  -2.377   1.669
   44    HB2  GLU   7          2HB       GLU   7 -12.548  -0.212   3.781
   45    HB3  GLU   7          3HB       GLU   7 -12.243   0.036   2.064
   46    HG2  GLU   7          2HG       GLU   7 -14.765  -0.949   3.402
   47    HG3  GLU   7          3HG       GLU   7 -14.554   0.494   2.417
   48    H    LYS   8           H        LYS   8 -10.930  -2.104   5.012
   49    HA   LYS   8           HA       LYS   8  -8.298  -1.345   4.322
   50    HB2  LYS   8          2HB       LYS   8  -9.118  -3.151   6.643
   51    HB3  LYS   8          3HB       LYS   8  -7.504  -2.502   6.416
   52    HG2  LYS   8          2HG       LYS   8  -8.385  -1.092   8.041
   53    HG3  LYS   8          3HG       LYS   8  -8.652  -0.159   6.565
   54    HD2  LYS   8          2HD       LYS   8 -10.968  -0.722   6.521
   55    HD3  LYS   8          3HD       LYS   8 -10.773  -1.976   7.744
   56    HE2  LYS   8          2HE       LYS   8 -11.865  -0.097   8.760
   57    HE3  LYS   8          3HE       LYS   8 -10.226  -0.165   9.405
   58    HZ1  LYS   8          1HZ       LYS   8  -9.601   1.604   7.877
   59    HZ2  LYS   8          2HZ       LYS   8 -10.884   2.093   8.863
   60    HZ3  LYS   8          3HZ       LYS   8 -11.173   1.660   7.253
   61    H    ARG   9           H        ARG   9  -9.806  -4.560   4.588
   62    HA   ARG   9           HA       ARG   9  -7.632  -6.251   4.162
   63    HB2  ARG   9          2HB       ARG   9 -10.540  -6.624   3.320
   64    HB3  ARG   9          3HB       ARG   9  -9.339  -7.913   3.302
   65    HG2  ARG   9          2HG       ARG   9  -9.117  -7.853   5.695
   66    HG3  ARG   9          3HG       ARG   9 -10.106  -6.395   5.815
   67    HD2  ARG   9          2HD       ARG   9 -11.349  -8.426   6.480
   68    HD3  ARG   9          3HD       ARG   9 -12.076  -7.631   5.084
   69    HE   ARG   9           HE       ARG   9 -10.243  -9.807   4.478
   70   HH11  ARG   9          1HH1      ARG   9 -13.620  -8.918   5.002
   71   HH12  ARG   9          2HH1      ARG   9 -14.239 -10.316   4.185
   72   HH21  ARG   9          1HH2      ARG   9 -11.081 -11.646   3.418
   73   HH22  ARG   9          2HH2      ARG   9 -12.799 -11.859   3.287
   74    H    GLN  10           H        GLN  10  -9.733  -4.654   1.801
   75    HA   GLN  10           HA       GLN  10  -8.628  -5.838  -0.548
   76    HB2  GLN  10          2HB       GLN  10 -10.274  -3.290  -0.227
   77    HB3  GLN  10          3HB       GLN  10  -9.939  -4.095  -1.762
   78    HG2  GLN  10          2HG       GLN  10 -11.169  -6.081  -1.001
   79    HG3  GLN  10          3HG       GLN  10 -11.500  -5.297   0.546
   80   HE21  GLN  10          1HE2      GLN  10 -12.999  -3.582   0.596
   81   HE22  GLN  10          2HE2      GLN  10 -14.106  -3.288  -0.690
   82    H    VAL  11           H        VAL  11  -8.214  -2.632   0.974
   83    HA   VAL  11           HA       VAL  11  -6.615  -1.486  -1.067
   84    HB   VAL  11           HB       VAL  11  -6.985  -0.661   1.853
   85   HG11  VAL  11          1HG1      VAL  11  -5.800   0.966  -0.425
   86   HG12  VAL  11          2HG1      VAL  11  -4.922   0.366   0.981
   87   HG13  VAL  11          3HG1      VAL  11  -6.180   1.587   1.185
   88   HG21  VAL  11          1HG2      VAL  11  -8.290   0.406  -0.670
   89   HG22  VAL  11          2HG2      VAL  11  -8.615   0.934   0.980
   90   HG23  VAL  11          3HG2      VAL  11  -9.050  -0.694   0.478
   91    H    LYS  12           H        LYS  12  -5.733  -2.953   2.064
   92    HA   LYS  12           HA       LYS  12  -2.938  -2.419   1.903
   93    HB2  LYS  12          2HB       LYS  12  -4.396  -4.543   3.528
   94    HB3  LYS  12          3HB       LYS  12  -2.725  -4.035   3.775
   95    HG2  LYS  12          2HG       LYS  12  -3.490  -1.775   4.398
   96    HG3  LYS  12          3HG       LYS  12  -5.168  -2.261   4.128
   97    HD2  LYS  12          2HD       LYS  12  -3.279  -3.404   6.228
   98    HD3  LYS  12          3HD       LYS  12  -4.629  -2.311   6.530
   99    HE2  LYS  12          2HE       LYS  12  -6.206  -4.058   5.749
  100    HE3  LYS  12          3HE       LYS  12  -4.849  -5.146   5.452
  101    HZ1  LYS  12          1HZ       LYS  12  -4.318  -5.021   7.820
  102    HZ2  LYS  12          2HZ       LYS  12  -5.862  -5.646   7.555
  103    HZ3  LYS  12          3HZ       LYS  12  -5.674  -4.053   8.088
  104    H    GLN  13           H        GLN  13  -4.998  -5.070   0.813
  105    HA   GLN  13           HA       GLN  13  -2.919  -6.889   0.081
  106    HB2  GLN  13          2HB       GLN  13  -5.234  -7.670   0.392
  107    HB3  GLN  13          3HB       GLN  13  -5.792  -6.653  -0.930
  108    HG2  GLN  13          2HG       GLN  13  -4.424  -8.002  -2.512
  109    HG3  GLN  13          3HG       GLN  13  -3.924  -9.033  -1.175
  110   HE21  GLN  13          1HE2      GLN  13  -7.211  -7.763  -1.572
  111   HE22  GLN  13          2HE2      GLN  13  -7.938  -9.289  -1.913
  112    H    VAL  14           H        VAL  14  -4.809  -4.472  -1.780
  113    HA   VAL  14           HA       VAL  14  -3.565  -4.769  -4.285
  114    HB   VAL  14           HB       VAL  14  -4.823  -2.284  -3.009
  115   HG11  VAL  14          1HG1      VAL  14  -5.023  -1.348  -5.299
  116   HG12  VAL  14          2HG1      VAL  14  -4.087  -2.704  -5.931
  117   HG13  VAL  14          3HG1      VAL  14  -3.332  -1.554  -4.825
  118   HG21  VAL  14          1HG2      VAL  14  -6.805  -2.850  -4.395
  119   HG22  VAL  14          2HG2      VAL  14  -6.395  -4.162  -3.288
  120   HG23  VAL  14          3HG2      VAL  14  -5.968  -4.288  -4.994
  121    H    ALA  15           H        ALA  15  -2.767  -2.784  -1.492
  122    HA   ALA  15           HA       ALA  15  -0.681  -1.225  -2.522
  123    HB1  ALA  15          1HB       ALA  15  -0.188  -0.707  -0.171
  124    HB2  ALA  15          2HB       ALA  15  -1.173  -2.077   0.355
  125    HB3  ALA  15          3HB       ALA  15  -1.931  -0.702  -0.450
  126    H    LYS  16           H        LYS  16  -0.580  -4.296  -0.668
  127    HA   LYS  16           HA       LYS  16   2.255  -4.467  -0.604
  128    HB2  LYS  16          2HB       LYS  16   1.986  -6.704   0.294
  129    HB3  LYS  16          3HB       LYS  16   0.821  -5.633   1.051
  130    HG2  LYS  16          2HG       LYS  16  -0.992  -6.582  -0.180
  131    HG3  LYS  16          3HG       LYS  16   0.091  -7.453  -1.256
  132    HD2  LYS  16          2HD       LYS  16  -0.198  -8.021   1.723
  133    HD3  LYS  16          3HD       LYS  16  -1.017  -8.916   0.438
  134    HE2  LYS  16          2HE       LYS  16   1.263  -9.473  -0.517
  135    HE3  LYS  16          3HE       LYS  16   1.978  -8.756   0.930
  136    HZ1  LYS  16          1HZ       LYS  16   0.825 -10.378   2.266
  137    HZ2  LYS  16          2HZ       LYS  16   1.769 -11.155   1.109
  138    HZ3  LYS  16          3HZ       LYS  16   0.095 -11.058   0.903
  139    H    GLU  17           H        GLU  17  -0.225  -5.851  -2.773
  140    HA   GLU  17           HA       GLU  17   1.503  -7.554  -4.211
  141    HB2  GLU  17          2HB       GLU  17  -1.140  -6.314  -5.080
  142    HB3  GLU  17          3HB       GLU  17  -0.274  -7.536  -6.006
  143    HG2  GLU  17          2HG       GLU  17  -1.555  -7.852  -3.287
  144    HG3  GLU  17          3HG       GLU  17  -2.035  -8.621  -4.795
  145    H    LYS  18           H        LYS  18   0.657  -4.141  -4.625
  146    HA   LYS  18           HA       LYS  18   1.883  -3.713  -7.136
  147    HB2  LYS  18          2HB       LYS  18   1.352  -1.788  -4.831
  148    HB3  LYS  18          3HB       LYS  18   1.968  -1.270  -6.396
  149    HG2  LYS  18          2HG       LYS  18  -0.708  -2.578  -5.862
  150    HG3  LYS  18          3HG       LYS  18  -0.433  -0.885  -6.271
  151    HD2  LYS  18          2HD       LYS  18   0.223  -1.443  -8.516
  152    HD3  LYS  18          3HD       LYS  18   0.376  -3.155  -8.125
  153    HE2  LYS  18          2HE       LYS  18  -2.129  -3.170  -7.703
  154    HE3  LYS  18          3HE       LYS  18  -2.176  -1.546  -8.402
  155    HZ1  LYS  18          1HZ       LYS  18  -1.302  -2.397 -10.445
  156    HZ2  LYS  18          2HZ       LYS  18  -2.639  -3.332 -10.016
  157    HZ3  LYS  18          3HZ       LYS  18  -1.076  -3.935  -9.782
  158    H    LEU  19           H        LEU  19   3.134  -3.502  -3.815
  159    HA   LEU  19           HA       LEU  19   5.783  -2.685  -4.523
  160    HB2  LEU  19          2HB       LEU  19   4.814  -4.099  -2.012
  161    HB3  LEU  19          3HB       LEU  19   6.361  -3.280  -2.193
  162    HG   LEU  19           HG       LEU  19   3.606  -1.998  -2.164
  163   HD11  LEU  19          1HD1      LEU  19   4.423  -2.589   0.039
  164   HD12  LEU  19          2HD1      LEU  19   4.414  -0.841  -0.166
  165   HD13  LEU  19          3HD1      LEU  19   5.938  -1.731  -0.255
  166   HD21  LEU  19          1HD2      LEU  19   4.745   0.167  -2.398
  167   HD22  LEU  19          2HD2      LEU  19   4.937  -0.843  -3.826
  168   HD23  LEU  19          3HD2      LEU  19   6.276  -0.667  -2.686
  169    H    LEU  20           H        LEU  20   4.195  -5.791  -4.250
  170    HA   LEU  20           HA       LEU  20   6.565  -7.419  -4.491
  171    HB2  LEU  20          2HB       LEU  20   3.612  -8.066  -4.841
  172    HB3  LEU  20          3HB       LEU  20   4.892  -9.271  -4.847
  173    HG   LEU  20           HG       LEU  20   4.227  -7.486  -2.471
  174   HD11  LEU  20          1HD1      LEU  20   2.375  -8.999  -2.896
  175   HD12  LEU  20          2HD1      LEU  20   3.232  -9.465  -1.430
  176   HD13  LEU  20          3HD1      LEU  20   3.473 -10.384  -2.920
  177   HD21  LEU  20          1HD2      LEU  20   6.070  -9.885  -2.650
  178   HD22  LEU  20          2HD2      LEU  20   5.660  -8.994  -1.181
  179   HD23  LEU  20          3HD2      LEU  20   6.560  -8.198  -2.467
  180    H    GLU  21           H        GLU  21   4.349  -5.833  -6.704
  181    HA   GLU  21           HA       GLU  21   5.194  -7.170  -9.106
  182    HB2  GLU  21          2HB       GLU  21   3.742  -4.534  -8.638
  183    HB3  GLU  21          3HB       GLU  21   4.164  -5.097 -10.253
  184    HG2  GLU  21          2HG       GLU  21   2.761  -7.084  -9.954
  185    HG3  GLU  21          3HG       GLU  21   2.383  -6.589  -8.305
  186    H    GLN  22           H        GLN  22   6.129  -4.238  -7.357
  187    HA   GLN  22           HA       GLN  22   8.096  -3.343  -9.236
  188    HB2  GLN  22          2HB       GLN  22   7.656  -2.631  -6.304
  189    HB3  GLN  22          3HB       GLN  22   8.819  -1.824  -7.355
  190    HG2  GLN  22          2HG       GLN  22   6.965  -1.095  -8.824
  191    HG3  GLN  22          3HG       GLN  22   5.810  -1.858  -7.735
  192   HE21  GLN  22          1HE2      GLN  22   7.225  -1.028  -5.292
  193   HE22  GLN  22          2HE2      GLN  22   6.954   0.667  -5.138
  194    H    SER  23           H        SER  23   8.136  -5.531  -6.479
  195    HA   SER  23           HA       SER  23  10.869  -6.329  -7.067
  196    HB2  SER  23          2HB       SER  23  11.079  -4.346  -5.506
  197    HB3  SER  23          3HB       SER  23  10.206  -5.269  -4.285
  198    HG   SER  23           HG       SER  23  11.880  -6.639  -4.102
  199    HA   PRO  24           HA       PRO  24   8.135  -9.919  -5.822
  200    HB2  PRO  24          2HB       PRO  24   9.317 -11.731  -7.552
  201    HB3  PRO  24          3HB       PRO  24   8.037 -10.599  -8.045
  202    HG2  PRO  24          2HG       PRO  24  11.017 -10.312  -8.377
  203    HG3  PRO  24          3HG       PRO  24   9.720 -10.034  -9.565
  204    HD2  PRO  24          2HD       PRO  24  10.841  -7.971  -8.254
  205    HD3  PRO  24          3HD       PRO  24   9.102  -7.980  -8.626
  206    H    ASN  25           H        ASN  25  11.598  -9.483  -5.716
  207    HA   ASN  25           HA       ASN  25  12.183 -11.961  -4.307
  208    HB2  ASN  25          2HB       ASN  25  13.875 -10.812  -5.762
  209    HB3  ASN  25          3HB       ASN  25  13.919  -9.467  -4.631
  210   HD21  ASN  25          1HD2      ASN  25  13.807 -12.934  -3.807
  211   HD22  ASN  25          2HD2      ASN  25  15.359 -12.971  -3.053
  212    H    SER  26           H        SER  26  10.951  -8.902  -3.439
  213    HA   SER  26           HA       SER  26  11.895  -8.918  -0.669
  214    HB2  SER  26          2HB       SER  26  10.088  -6.971  -2.156
  215    HB3  SER  26          3HB       SER  26  10.801  -6.724  -0.559
  216    HG   SER  26           HG       SER  26  12.741  -6.488  -1.431
  217    H    LYS  27           H        LYS  27  10.552  -9.136   1.109
  218    HA   LYS  27           HA       LYS  27   7.756 -10.019   0.663
  219    HB2  LYS  27          2HB       LYS  27   9.088 -11.729   1.789
  220    HB3  LYS  27          3HB       LYS  27   9.643 -10.570   2.993
  221    HG2  LYS  27          2HG       LYS  27   7.442 -10.406   3.981
  222    HG3  LYS  27          3HG       LYS  27   6.709 -11.316   2.660
  223    HD2  LYS  27          2HD       LYS  27   8.734 -12.447   4.626
  224    HD3  LYS  27          3HD       LYS  27   6.985 -12.635   4.772
  225    HE2  LYS  27          2HE       LYS  27   8.737 -13.711   2.529
  226    HE3  LYS  27          3HE       LYS  27   7.941 -14.648   3.795
  227    HZ1  LYS  27          1HZ       LYS  27   5.789 -13.920   2.901
  228    HZ2  LYS  27          2HZ       LYS  27   6.690 -14.772   1.753
  229    HZ3  LYS  27          3HZ       LYS  27   6.581 -13.090   1.657
  230    H    VAL  28           H        VAL  28   6.273  -8.576   1.163
  231    HA   VAL  28           HA       VAL  28   6.965  -6.143   2.674
  232    HB   VAL  28           HB       VAL  28   4.561  -6.638   0.853
  233   HG11  VAL  28          1HG1      VAL  28   5.705  -4.049   1.961
  234   HG12  VAL  28          2HG1      VAL  28   4.206  -4.824   2.479
  235   HG13  VAL  28          3HG1      VAL  28   4.343  -4.177   0.843
  236   HG21  VAL  28          1HG2      VAL  28   6.649  -6.833  -0.442
  237   HG22  VAL  28          2HG2      VAL  28   7.185  -5.265   0.164
  238   HG23  VAL  28          3HG2      VAL  28   5.769  -5.368  -0.885
  239    H    GLN  29           H        GLN  29   5.786  -5.517   4.451
  240    HA   GLN  29           HA       GLN  29   3.374  -7.014   5.270
  241    HB2  GLN  29          2HB       GLN  29   5.316  -7.776   6.635
  242    HB3  GLN  29          3HB       GLN  29   5.661  -6.114   7.091
  243    HG2  GLN  29          2HG       GLN  29   4.538  -7.315   8.915
  244    HG3  GLN  29          3HG       GLN  29   3.540  -5.989   8.325
  245   HE21  GLN  29          1HE2      GLN  29   3.913  -9.474   8.396
  246   HE22  GLN  29          2HE2      GLN  29   2.285  -9.850   7.960
  247    H    VAL  30           H        VAL  30   1.791  -5.692   6.281
  248    HA   VAL  30           HA       VAL  30   1.711  -2.934   5.575
  249    HB   VAL  30           HB       VAL  30  -0.057  -4.451   7.556
  250   HG11  VAL  30          1HG1      VAL  30  -1.738  -2.693   7.166
  251   HG12  VAL  30          2HG1      VAL  30  -0.617  -1.833   6.109
  252   HG13  VAL  30          3HG1      VAL  30  -0.255  -2.001   7.829
  253   HG21  VAL  30          1HG2      VAL  30  -0.474  -3.970   4.580
  254   HG22  VAL  30          2HG2      VAL  30  -1.627  -4.748   5.669
  255   HG23  VAL  30          3HG2      VAL  30  -0.072  -5.514   5.336
  256    H    ARG  31           H        ARG  31   2.084  -1.098   6.821
  257    HA   ARG  31           HA       ARG  31   3.478  -1.542   9.411
  258    HB2  ARG  31          2HB       ARG  31   4.883  -0.836   7.381
  259    HB3  ARG  31          3HB       ARG  31   4.055   0.712   7.444
  260    HG2  ARG  31          2HG       ARG  31   6.252   0.849   8.510
  261    HG3  ARG  31          3HG       ARG  31   4.978   1.117   9.704
  262    HD2  ARG  31          2HD       ARG  31   5.242  -1.126  10.586
  263    HD3  ARG  31          3HD       ARG  31   6.348  -1.563   9.279
  264    HE   ARG  31           HE       ARG  31   7.990  -0.087  10.227
  265   HH11  ARG  31          1HH1      ARG  31   5.292  -0.853  12.379
  266   HH12  ARG  31          2HH1      ARG  31   6.174  -0.444  13.814
  267   HH21  ARG  31          1HH2      ARG  31   9.121   0.423  12.115
  268   HH22  ARG  31          2HH2      ARG  31   8.342   0.276  13.657
  269    H    ARG  32           H        ARG  32   1.289   0.589   7.584
  270    HA   ARG  32           HA       ARG  32  -0.045   1.592   9.910
  271    HB2  ARG  32          2HB       ARG  32   2.234   2.810   9.875
  272    HB3  ARG  32          3HB       ARG  32   1.697   3.616   8.418
  273    HG2  ARG  32          2HG       ARG  32   0.148   3.838  11.009
  274    HG3  ARG  32          3HG       ARG  32   1.546   4.855  10.684
  275    HD2  ARG  32          2HD       ARG  32   0.191   5.406   8.449
  276    HD3  ARG  32          3HD       ARG  32  -1.187   4.911   9.436
  277    HE   ARG  32           HE       ARG  32  -0.482   6.639  11.058
  278   HH11  ARG  32          1HH1      ARG  32   0.559   6.963   7.705
  279   HH12  ARG  32          2HH1      ARG  32   0.759   8.681   7.823
  280   HH21  ARG  32          1HH2      ARG  32  -0.264   8.863  11.161
  281   HH22  ARG  32          2HH2      ARG  32   0.290   9.754   9.783
  282    H    VAL  33           H        VAL  33  -1.996   2.649   9.279
  283    HA   VAL  33           HA       VAL  33  -2.532   3.040   6.387
  284    HB   VAL  33           HB       VAL  33  -4.384   1.517   8.300
  285   HG11  VAL  33          1HG1      VAL  33  -5.688   2.852   6.688
  286   HG12  VAL  33          2HG1      VAL  33  -5.853   1.127   6.352
  287   HG13  VAL  33          3HG1      VAL  33  -4.794   2.124   5.351
  288   HG21  VAL  33          1HG2      VAL  33  -2.850   0.467   5.903
  289   HG22  VAL  33          2HG2      VAL  33  -3.993  -0.460   6.879
  290   HG23  VAL  33          3HG2      VAL  33  -2.487   0.122   7.595
  291    H    GLN  34           H        GLN  34  -3.818   4.843   5.973
  292    HA   GLN  34           HA       GLN  34  -5.228   6.194   8.200
  293    HB2  GLN  34          2HB       GLN  34  -3.146   7.390   6.344
  294    HB3  GLN  34          3HB       GLN  34  -4.441   8.412   6.954
  295    HG2  GLN  34          2HG       GLN  34  -2.493   6.863   8.676
  296    HG3  GLN  34          3HG       GLN  34  -2.375   8.577   8.288
  297   HE21  GLN  34          1HE2      GLN  34  -3.905  10.022   9.197
  298   HE22  GLN  34          2HE2      GLN  34  -4.823   9.590  10.596
  299    H    LYS  35           H        LYS  35  -7.295   6.141   7.640
  300    HA   LYS  35           HA       LYS  35  -8.268   6.321   4.913
  301    HB2  LYS  35          2HB       LYS  35  -9.403   4.924   6.642
  302    HB3  LYS  35          3HB       LYS  35  -9.721   6.364   7.601
  303    HG2  LYS  35          2HG       LYS  35 -11.751   5.756   6.459
  304    HG3  LYS  35          3HG       LYS  35 -11.140   7.242   5.721
  305    HD2  LYS  35          2HD       LYS  35 -10.161   5.886   3.871
  306    HD3  LYS  35          3HD       LYS  35 -10.810   4.426   4.618
  307    HE2  LYS  35          2HE       LYS  35 -12.432   6.730   3.512
  308    HE3  LYS  35          3HE       LYS  35 -12.213   5.154   2.754
  309    HZ1  LYS  35          1HZ       LYS  35 -13.272   4.183   4.730
  310    HZ2  LYS  35          2HZ       LYS  35 -14.295   5.199   3.852
  311    HZ3  LYS  35          3HZ       LYS  35 -13.604   5.739   5.294
  312    H    GLN  36           H        GLN  36  -8.060   8.316   3.973
  313    HA   GLN  36           HA       GLN  36  -8.875  10.766   5.464
  314    HB2  GLN  36          2HB       GLN  36  -6.871  10.712   3.169
  315    HB3  GLN  36          3HB       GLN  36  -7.221  12.045   4.261
  316    HG2  GLN  36          2HG       GLN  36  -6.133  10.818   6.096
  317    HG3  GLN  36          3HG       GLN  36  -5.802   9.472   5.005
  318   HE21  GLN  36          1HE2      GLN  36  -5.150  11.260   2.717
  319   HE22  GLN  36          2HE2      GLN  36  -3.604  11.931   3.083
  320    H    GLY  37           H        GLY  37 -11.020  10.405   4.703
  321    HA2  GLY  37          2HA       GLY  37 -12.815  10.609   3.298
  322    HA3  GLY  37          3HA       GLY  37 -11.774  11.527   2.215
  323    H    ASN  38           H        ASN  38 -11.878  10.622   0.208
  324    HA   ASN  38           HA       ASN  38 -12.365   7.843  -0.308
  325    HB2  ASN  38          2HB       ASN  38 -11.419  10.098  -2.137
  326    HB3  ASN  38          3HB       ASN  38 -11.685   8.452  -2.710
  327   HD21  ASN  38          1HD2      ASN  38 -13.312   9.073  -4.111
  328   HD22  ASN  38          2HD2      ASN  38 -14.877   9.571  -3.575
  329    H    THR  39           H        THR  39  -9.475   9.696   0.262
  330    HA   THR  39           HA       THR  39  -7.730   7.770  -1.104
  331    HB   THR  39           HB       THR  39  -7.016  10.454   0.137
  332    HG1  THR  39           HG1      THR  39  -8.470   9.969  -2.001
  333   HG21  THR  39          1HG2      THR  39  -5.002  10.330  -1.300
  334   HG22  THR  39          2HG2      THR  39  -5.491   8.733  -1.868
  335   HG23  THR  39          3HG2      THR  39  -5.042   8.966  -0.177
  336    H    ILE  40           H        ILE  40  -7.172   6.082   0.121
  337    HA   ILE  40           HA       ILE  40  -6.483   6.362   2.960
  338    HB   ILE  40           HB       ILE  40  -6.617   3.845   1.234
  339   HG12  ILE  40          2HG1      ILE  40  -8.650   5.030   3.166
  340   HG13  ILE  40          3HG1      ILE  40  -8.827   4.894   1.422
  341   HG21  ILE  40          1HG2      ILE  40  -6.414   4.130   4.259
  342   HG22  ILE  40          2HG2      ILE  40  -5.128   3.574   3.185
  343   HG23  ILE  40          3HG2      ILE  40  -6.593   2.612   3.376
  344   HD11  ILE  40          1HD1      ILE  40 -10.132   3.243   2.665
  345   HD12  ILE  40          2HD1      ILE  40  -8.647   2.548   3.315
  346   HD13  ILE  40          3HD1      ILE  40  -8.966   2.505   1.579
  347    H    ARG  41           H        ARG  41  -4.412   6.982   3.350
  348    HA   ARG  41           HA       ARG  41  -2.178   6.195   1.626
  349    HB2  ARG  41          2HB       ARG  41  -2.185   7.820   4.210
  350    HB3  ARG  41          3HB       ARG  41  -0.796   7.571   3.151
  351    HG2  ARG  41          2HG       ARG  41  -2.040   8.744   1.326
  352    HG3  ARG  41          3HG       ARG  41  -3.333   9.097   2.480
  353    HD2  ARG  41          2HD       ARG  41  -1.988  11.062   2.387
  354    HD3  ARG  41          3HD       ARG  41  -1.554  10.276   3.904
  355    HE   ARG  41           HE       ARG  41   0.085  10.490   1.475
  356   HH11  ARG  41          1HH1      ARG  41  -0.109   9.438   4.826
  357   HH12  ARG  41          2HH1      ARG  41   1.602   9.212   4.980
  358   HH21  ARG  41          1HH2      ARG  41   2.294  10.108   1.652
  359   HH22  ARG  41          2HH2      ARG  41   2.965   9.599   3.170
  360    H    VAL  42           H        VAL  42  -1.785   4.047   1.883
  361    HA   VAL  42           HA       VAL  42  -1.470   2.889   4.584
  362    HB   VAL  42           HB       VAL  42  -1.338   1.453   1.880
  363   HG11  VAL  42          1HG1      VAL  42  -1.531   0.307   4.695
  364   HG12  VAL  42          2HG1      VAL  42  -0.105   0.257   3.660
  365   HG13  VAL  42          3HG1      VAL  42  -1.556  -0.635   3.200
  366   HG21  VAL  42          1HG2      VAL  42  -3.594   2.343   2.248
  367   HG22  VAL  42          2HG2      VAL  42  -3.643   1.600   3.849
  368   HG23  VAL  42          3HG2      VAL  42  -3.595   0.583   2.406
  369    H    GLU  43           H        GLU  43   0.520   3.510   5.340
  370    HA   GLU  43           HA       GLU  43   2.953   3.251   3.839
  371    HB2  GLU  43          2HB       GLU  43   2.395   3.417   6.822
  372    HB3  GLU  43          3HB       GLU  43   4.016   3.212   6.189
  373    HG2  GLU  43          2HG       GLU  43   3.840   5.501   6.650
  374    HG3  GLU  43          3HG       GLU  43   3.661   5.373   4.906
  375    H    LEU  44           H        LEU  44   4.003   1.386   3.392
  376    HA   LEU  44           HA       LEU  44   3.557  -0.986   5.114
  377    HB2  LEU  44          2HB       LEU  44   4.261  -1.127   2.155
  378    HB3  LEU  44          3HB       LEU  44   3.882  -2.457   3.234
  379    HG   LEU  44           HG       LEU  44   1.522  -1.170   3.427
  380   HD11  LEU  44          1HD1      LEU  44   2.160   0.736   2.048
  381   HD12  LEU  44          2HD1      LEU  44   0.826  -0.154   1.319
  382   HD13  LEU  44          3HD1      LEU  44   2.461  -0.331   0.673
  383   HD21  LEU  44          1HD2      LEU  44   2.224  -2.955   1.079
  384   HD22  LEU  44          2HD2      LEU  44   0.597  -2.634   1.690
  385   HD23  LEU  44          3HD2      LEU  44   1.763  -3.490   2.697
  386    H    GLU  45           H        GLU  45   5.446  -2.517   4.926
  387    HA   GLU  45           HA       GLU  45   8.017  -1.080   4.748
  388    HB2  GLU  45          2HB       GLU  45   7.243  -1.384   7.116
  389    HB3  GLU  45          3HB       GLU  45   7.233  -3.128   6.866
  390    HG2  GLU  45          2HG       GLU  45   9.655  -3.106   6.450
  391    HG3  GLU  45          3HG       GLU  45   9.682  -1.350   6.623
  392    H    LEU  46           H        LEU  46   8.972  -1.936   3.063
  393    HA   LEU  46           HA       LEU  46   8.566  -4.718   2.219
  394    HB2  LEU  46          2HB       LEU  46   8.134  -3.011   0.561
  395    HB3  LEU  46          3HB       LEU  46   9.664  -2.217   0.866
  396    HG   LEU  46           HG       LEU  46   9.723  -5.042  -0.210
  397   HD11  LEU  46          1HD1      LEU  46   8.060  -3.933  -1.641
  398   HD12  LEU  46          2HD1      LEU  46   9.550  -4.270  -2.520
  399   HD13  LEU  46          3HD1      LEU  46   9.204  -2.627  -1.969
  400   HD21  LEU  46          1HD2      LEU  46  11.483  -2.613  -0.710
  401   HD22  LEU  46          2HD2      LEU  46  11.751  -4.235  -1.359
  402   HD23  LEU  46          3HD2      LEU  46  11.850  -3.955   0.377
  403    H    ARG  47           H        ARG  47  10.076  -6.173   2.767
  404    HA   ARG  47           HA       ARG  47  12.729  -5.280   3.763
  405    HB2  ARG  47          2HB       ARG  47  11.071  -7.746   4.453
  406    HB3  ARG  47          3HB       ARG  47  12.676  -7.411   5.103
  407    HG2  ARG  47          2HG       ARG  47  11.867  -5.488   6.322
  408    HG3  ARG  47          3HG       ARG  47  10.305  -5.551   5.499
  409    HD2  ARG  47          2HD       ARG  47  11.377  -7.663   7.409
  410    HD3  ARG  47          3HD       ARG  47  10.162  -6.437   7.802
  411    HE   ARG  47           HE       ARG  47   9.145  -7.722   5.610
  412   HH11  ARG  47          1HH1      ARG  47  10.163  -8.832   8.804
  413   HH12  ARG  47          2HH1      ARG  47   9.046 -10.156   8.817
  414   HH21  ARG  47          1HH2      ARG  47   7.694  -9.447   5.663
  415   HH22  ARG  47          2HH2      ARG  47   7.643 -10.505   7.034
  416    H    THR  48           H        THR  48  14.545  -6.167   2.916
  417    HA   THR  48           HA       THR  48  14.494  -8.346   0.954
  418    HB   THR  48           HB       THR  48  16.000  -5.838   0.135
  419    HG1  THR  48           HG1      THR  48  14.196  -4.913  -0.755
  420   HG21  THR  48          1HG2      THR  48  15.460  -6.598  -2.147
  421   HG22  THR  48          2HG2      THR  48  14.471  -7.907  -1.499
  422   HG23  THR  48          3HG2      THR  48  16.214  -7.908  -1.226
  423    H    ASN  49           H        ASN  49  16.917  -8.676   0.207
  424    HA   ASN  49           HA       ASN  49  18.582  -9.256   2.401
  425    HB2  ASN  49          2HB       ASN  49  19.310  -8.982  -0.551
  426    HB3  ASN  49          3HB       ASN  49  20.309  -9.768   0.671
  427   HD21  ASN  49          1HD2      ASN  49  17.327  -9.984  -1.174
  428   HD22  ASN  49          2HD2      ASN  49  17.076 -11.673  -0.915
  429    H    GLY  50           H        GLY  50  19.106  -7.541   3.689
  430    HA2  GLY  50          2HA       GLY  50  20.506  -5.870   4.450
  431    HA3  GLY  50          3HA       GLY  50  21.205  -5.748   2.845
  432    H    LYS  51           H        LYS  51  17.894  -5.500   2.525
  433    HA   LYS  51           HA       LYS  51  17.902  -2.542   2.755
  434    HB2  LYS  51          2HB       LYS  51  16.329  -4.205   0.747
  435    HB3  LYS  51          3HB       LYS  51  16.342  -2.450   0.876
  436    HG2  LYS  51          2HG       LYS  51  18.756  -2.453   0.251
  437    HG3  LYS  51          3HG       LYS  51  18.674  -4.207   0.037
  438    HD2  LYS  51          2HD       LYS  51  18.460  -3.087  -2.136
  439    HD3  LYS  51          3HD       LYS  51  16.945  -3.896  -1.727
  440    HE2  LYS  51          2HE       LYS  51  16.098  -1.650  -0.881
  441    HE3  LYS  51          3HE       LYS  51  17.555  -0.926  -1.561
  442    HZ1  LYS  51          1HZ       LYS  51  16.888  -1.622  -3.736
  443    HZ2  LYS  51          2HZ       LYS  51  15.596  -0.790  -3.023
  444    HZ3  LYS  51          3HZ       LYS  51  15.566  -2.479  -3.124
  445    H    LYS  52           H        LYS  52  16.092  -1.589   3.609
  446    HA   LYS  52           HA       LYS  52  13.604  -3.062   3.907
  447    HB2  LYS  52          2HB       LYS  52  14.771  -3.423   6.098
  448    HB3  LYS  52          3HB       LYS  52  14.896  -1.678   6.305
  449    HG2  LYS  52          2HG       LYS  52  12.338  -1.605   6.195
  450    HG3  LYS  52          3HG       LYS  52  12.373  -3.369   6.277
  451    HD2  LYS  52          2HD       LYS  52  12.006  -2.508   8.510
  452    HD3  LYS  52          3HD       LYS  52  13.629  -3.197   8.440
  453    HE2  LYS  52          2HE       LYS  52  14.572  -0.916   8.168
  454    HE3  LYS  52          3HE       LYS  52  12.941  -0.242   8.251
  455    HZ1  LYS  52          1HZ       LYS  52  12.731  -1.107  10.487
  456    HZ2  LYS  52          2HZ       LYS  52  14.084  -0.107  10.377
  457    HZ3  LYS  52          3HZ       LYS  52  14.275  -1.786  10.413
  458    H    GLU  53           H        GLU  53  12.541  -1.723   2.552
  459    HA   GLU  53           HA       GLU  53  12.901   1.205   2.737
  460    HB2  GLU  53          2HB       GLU  53  11.617  -0.400   0.483
  461    HB3  GLU  53          3HB       GLU  53  12.081   1.300   0.449
  462    HG2  GLU  53          2HG       GLU  53  14.455   0.660   0.586
  463    HG3  GLU  53          3HG       GLU  53  13.998  -1.043   0.646
  464    H    ASN  54           H        ASN  54  11.354   2.122   3.999
  465    HA   ASN  54           HA       ASN  54   8.674   1.108   4.274
  466    HB2  ASN  54          2HB       ASN  54   9.936   3.760   5.107
  467    HB3  ASN  54          3HB       ASN  54   8.247   3.360   5.418
  468   HD21  ASN  54          1HD2      ASN  54   8.412   3.380   7.622
  469   HD22  ASN  54          2HD2      ASN  54   9.323   2.226   8.527
  470    H    TYR  55           H        TYR  55   7.201   1.284   2.731
  471    HA   TYR  55           HA       TYR  55   7.283   3.487   0.753
  472    HB2  TYR  55          2HB       TYR  55   6.069   0.695   0.670
  473    HB3  TYR  55          3HB       TYR  55   5.595   1.933  -0.481
  474    HD1  TYR  55           HD1      TYR  55   6.973   2.428  -2.391
  475    HD2  TYR  55           HD2      TYR  55   8.460  -0.143   0.666
  476    HE1  TYR  55           HE1      TYR  55   8.825   1.760  -3.856
  477    HE2  TYR  55           HE2      TYR  55  10.313  -0.804  -0.798
  478    HH   TYR  55           HH       TYR  55  11.088  -0.773  -2.940
  479    H    THR  56           H        THR  56   5.075   4.173   0.007
  480    HA   THR  56           HA       THR  56   2.869   3.845   1.888
  481    HB   THR  56           HB       THR  56   3.738   6.615   0.931
  482    HG1  THR  56           HG1      THR  56   4.349   5.177   3.239
  483   HG21  THR  56          1HG2      THR  56   2.027   7.441   2.497
  484   HG22  THR  56          2HG2      THR  56   1.600   5.786   2.930
  485   HG23  THR  56          3HG2      THR  56   1.294   6.377   1.294
  486    H    VAL  57           H        VAL  57   1.596   2.808   0.467
  487    HA   VAL  57           HA       VAL  57   1.290   3.758  -2.291
  488    HB   VAL  57           HB       VAL  57   0.097   1.283  -0.942
  489   HG11  VAL  57          1HG1      VAL  57   0.149   2.054  -3.889
  490   HG12  VAL  57          2HG1      VAL  57  -1.274   2.061  -2.846
  491   HG13  VAL  57          3HG1      VAL  57  -0.475   0.537  -3.232
  492   HG21  VAL  57          1HG2      VAL  57   1.788  -0.009  -2.205
  493   HG22  VAL  57          2HG2      VAL  57   2.555   1.134  -1.099
  494   HG23  VAL  57          3HG2      VAL  57   2.479   1.494  -2.826
  495    H    GLU  58           H        GLU  58   0.044   5.454  -2.313
  496    HA   GLU  58           HA       GLU  58  -2.195   5.844  -0.488
  497    HB2  GLU  58          2HB       GLU  58  -0.983   7.683  -2.598
  498    HB3  GLU  58          3HB       GLU  58  -2.217   8.141  -1.420
  499    HG2  GLU  58          2HG       GLU  58  -0.613   7.632   0.416
  500    HG3  GLU  58          3HG       GLU  58   0.607   7.233  -0.792
  501    H    VAL  59           H        VAL  59  -3.905   4.797  -1.079
  502    HA   VAL  59           HA       VAL  59  -4.704   4.403  -3.884
  503    HB   VAL  59           HB       VAL  59  -5.729   3.067  -1.331
  504   HG11  VAL  59          1HG1      VAL  59  -6.122   2.245  -4.220
  505   HG12  VAL  59          2HG1      VAL  59  -7.354   2.948  -3.169
  506   HG13  VAL  59          3HG1      VAL  59  -6.688   1.353  -2.805
  507   HG21  VAL  59          1HG2      VAL  59  -3.665   2.010  -3.306
  508   HG22  VAL  59          2HG2      VAL  59  -4.325   1.117  -1.931
  509   HG23  VAL  59          3HG2      VAL  59  -3.336   2.554  -1.656
  510    H    GLU  60           H        GLU  60  -6.946   4.871  -4.492
  511    HA   GLU  60           HA       GLU  60  -8.423   6.770  -2.783
  512    HB2  GLU  60          2HB       GLU  60  -7.183   8.025  -4.503
  513    HB3  GLU  60          3HB       GLU  60  -7.869   7.015  -5.773
  514    HG2  GLU  60          2HG       GLU  60 -10.132   7.876  -5.205
  515    HG3  GLU  60          3HG       GLU  60  -9.415   8.920  -3.976
  516    H    ARG  61           H        ARG  61 -10.639   6.609  -2.889
  517    HA   ARG  61           HA       ARG  61 -11.859   4.243  -4.017
  518    HB2  ARG  61          2HB       ARG  61 -12.479   5.191  -1.770
  519    HB3  ARG  61          3HB       ARG  61 -13.125   6.618  -2.570
  520    HG2  ARG  61          2HG       ARG  61 -14.935   5.114  -1.962
  521    HG3  ARG  61          3HG       ARG  61 -14.805   5.196  -3.721
  522    HD2  ARG  61          2HD       ARG  61 -13.806   3.034  -3.845
  523    HD3  ARG  61          3HD       ARG  61 -13.500   2.988  -2.104
  524    HE   ARG  61           HE       ARG  61 -16.298   3.180  -2.825
  525   HH11  ARG  61          1HH1      ARG  61 -13.632   0.975  -2.240
  526   HH12  ARG  61          2HH1      ARG  61 -14.660  -0.358  -1.843
  527   HH21  ARG  61          1HH2      ARG  61 -17.642   1.399  -2.283
  528   HH22  ARG  61          2HH2      ARG  61 -16.917  -0.122  -1.870
  529    H    GLN  62           H        GLN  62 -12.257   4.275  -6.153
  530    HA   GLN  62           HA       GLN  62 -13.787   6.537  -7.316
  531    HB2  GLN  62          2HB       GLN  62 -11.870   4.625  -8.744
  532    HB3  GLN  62          3HB       GLN  62 -12.925   5.773  -9.566
  533    HG2  GLN  62          2HG       GLN  62 -11.771   7.619  -8.263
  534    HG3  GLN  62          3HG       GLN  62 -10.606   6.414  -7.715
  535   HE21  GLN  62          1HE2      GLN  62 -10.050   8.769  -9.231
  536   HE22  GLN  62          2HE2      GLN  62  -9.370   8.263 -10.737
  537    H    GLY  63           H        GLY  63 -15.825   5.879  -7.028
  538    HA2  GLY  63          2HA       GLY  63 -17.773   4.715  -7.273
  539    HA3  GLY  63          3HA       GLY  63 -16.936   3.602  -8.348
  540    H    ASN  64           H        ASN  64 -16.719   1.589  -7.613
  541    HA   ASN  64           HA       ASN  64 -16.793   1.012  -4.706
  542    HB2  ASN  64          2HB       ASN  64 -17.461  -1.254  -5.310
  543    HB3  ASN  64          3HB       ASN  64 -18.519  -0.114  -6.129
  544   HD21  ASN  64          1HD2      ASN  64 -16.026  -2.511  -6.553
  545   HD22  ASN  64          2HD2      ASN  64 -16.157  -2.628  -8.270
  546    H    THR  65           H        THR  65 -14.665   1.238  -7.361
  547    HA   THR  65           HA       THR  65 -12.889  -0.951  -6.511
  548    HB   THR  65           HB       THR  65 -11.613  -0.380  -8.627
  549    HG1  THR  65           HG1      THR  65 -12.904   1.849  -8.534
  550   HG21  THR  65          1HG2      THR  65 -14.571  -0.974  -9.033
  551   HG22  THR  65          2HG2      THR  65 -13.321  -2.166  -8.667
  552   HG23  THR  65          3HG2      THR  65 -13.288  -1.295 -10.202
  553    H    TRP  66           H        TRP  66 -10.724  -0.638  -6.014
  554    HA   TRP  66           HA       TRP  66  -9.968   2.016  -4.958
  555    HB2  TRP  66          2HB       TRP  66  -9.021  -0.810  -4.295
  556    HB3  TRP  66          3HB       TRP  66  -8.286   0.641  -3.632
  557    HD1  TRP  66           HD1      TRP  66 -11.074  -1.759  -2.954
  558    HE1  TRP  66           HE1      TRP  66 -12.482  -0.929  -0.955
  559    HE3  TRP  66           HE3      TRP  66  -9.246   3.022  -2.565
  560    HZ2  TRP  66           HZ2      TRP  66 -12.787   1.420   0.561
  561    HZ3  TRP  66           HZ3      TRP  66 -10.165   4.497  -0.819
  562    HH2  TRP  66           HH2      TRP  66 -11.901   3.708   0.713
  563    H    THR  67           H        THR  67  -8.618   3.156  -6.223
  564    HA   THR  67           HA       THR  67  -6.767   1.791  -8.105
  565    HB   THR  67           HB       THR  67  -8.474   3.313  -9.154
  566    HG1  THR  67           HG1      THR  67  -6.731   4.656 -10.234
  567   HG21  THR  67          1HG2      THR  67  -8.244   5.765  -8.913
  568   HG22  THR  67          2HG2      THR  67  -7.008   5.536  -7.678
  569   HG23  THR  67          3HG2      THR  67  -8.666   5.021  -7.364
  570    H    VAL  68           H        VAL  68  -4.556   2.426  -8.138
  571    HA   VAL  68           HA       VAL  68  -3.582   3.651  -5.672
  572    HB   VAL  68           HB       VAL  68  -2.024   2.396  -7.974
  573   HG11  VAL  68          1HG1      VAL  68  -0.072   2.426  -6.450
  574   HG12  VAL  68          2HG1      VAL  68  -1.021   3.308  -5.250
  575   HG13  VAL  68          3HG1      VAL  68  -0.640   4.062  -6.799
  576   HG21  VAL  68          1HG2      VAL  68  -3.406   0.754  -6.747
  577   HG22  VAL  68          2HG2      VAL  68  -2.686   1.275  -5.221
  578   HG23  VAL  68          3HG2      VAL  68  -1.687   0.486  -6.445
  579    H    LYS  69           H        LYS  69  -3.526   5.784  -5.590
  580    HA   LYS  69           HA       LYS  69  -3.250   7.613  -7.742
  581    HB2  LYS  69          2HB       LYS  69  -2.826   7.931  -4.737
  582    HB3  LYS  69          3HB       LYS  69  -2.715   9.280  -5.863
  583    HG2  LYS  69          2HG       LYS  69  -5.180   7.558  -5.497
  584    HG3  LYS  69          3HG       LYS  69  -4.914   9.101  -4.687
  585    HD2  LYS  69          2HD       LYS  69  -4.854   8.884  -7.716
  586    HD3  LYS  69          3HD       LYS  69  -6.371   9.067  -6.838
  587    HE2  LYS  69          2HE       LYS  69  -5.546  11.229  -7.653
  588    HE3  LYS  69          3HE       LYS  69  -5.600  11.197  -5.898
  589    HZ1  LYS  69          1HZ       LYS  69  -3.144  10.807  -7.526
  590    HZ2  LYS  69          2HZ       LYS  69  -3.215  10.908  -5.842
  591    HZ3  LYS  69          3HZ       LYS  69  -3.591  12.256  -6.788
  592    H    ARG  70           H        ARG  70  -0.948   6.352  -5.348
  593    HA   ARG  70           HA       ARG  70   1.293   6.623  -7.125
  594    HB2  ARG  70          2HB       ARG  70   2.616   8.188  -5.766
  595    HB3  ARG  70          3HB       ARG  70   1.138   8.962  -6.320
  596    HG2  ARG  70          2HG       ARG  70   0.124   8.699  -4.101
  597    HG3  ARG  70          3HG       ARG  70   1.552   7.835  -3.525
  598    HD2  ARG  70          2HD       ARG  70   1.560  10.169  -2.773
  599    HD3  ARG  70          3HD       ARG  70   2.919   9.851  -3.855
  600    HE   ARG  70           HE       ARG  70   0.832  10.829  -5.416
  601   HH11  ARG  70          1HH1      ARG  70   2.865  12.045  -2.803
  602   HH12  ARG  70          2HH1      ARG  70   2.751  13.690  -3.332
  603   HH21  ARG  70          1HH2      ARG  70   0.717  12.988  -6.095
  604   HH22  ARG  70          2HH2      ARG  70   1.538  14.225  -5.197
  605    H    ILE  71           H        ILE  71   3.106   5.537  -6.400
  606    HA   ILE  71           HA       ILE  71   3.010   4.213  -3.748
  607    HB   ILE  71           HB       ILE  71   4.592   3.411  -6.245
  608   HG12  ILE  71          2HG1      ILE  71   2.267   1.969  -4.885
  609   HG13  ILE  71          3HG1      ILE  71   2.144   2.883  -6.384
  610   HG21  ILE  71          1HG2      ILE  71   5.289   1.428  -4.924
  611   HG22  ILE  71          2HG2      ILE  71   4.478   2.097  -3.507
  612   HG23  ILE  71          3HG2      ILE  71   5.865   2.934  -4.208
  613   HD11  ILE  71          1HD1      ILE  71   3.747   0.363  -5.958
  614   HD12  ILE  71          2HD1      ILE  71   3.698   1.307  -7.451
  615   HD13  ILE  71          3HD1      ILE  71   2.233   0.538  -6.847
  616    H    THR  72           H        THR  72   4.076   5.570  -2.430
  617    HA   THR  72           HA       THR  72   6.419   7.105  -3.264
  618    HB   THR  72           HB       THR  72   4.976   7.038  -0.557
  619    HG1  THR  72           HG1      THR  72   3.611   8.479  -1.355
  620   HG21  THR  72          1HG2      THR  72   6.059   9.222  -0.160
  621   HG22  THR  72          2HG2      THR  72   6.865   9.128  -1.726
  622   HG23  THR  72          3HG2      THR  72   7.286   7.982  -0.451
  623    H    ARG  73           H        ARG  73   8.479   6.660  -2.469
  624    HA   ARG  73           HA       ARG  73   8.877   4.430  -0.550
  625    HB2  ARG  73          2HB       ARG  73   9.883   3.925  -2.750
  626    HB3  ARG  73          3HB       ARG  73  10.708   5.481  -2.771
  627    HG2  ARG  73          2HG       ARG  73  12.002   4.711  -0.718
  628    HG3  ARG  73          3HG       ARG  73  11.276   3.118  -0.944
  629    HD2  ARG  73          2HD       ARG  73  12.949   4.537  -3.043
  630    HD3  ARG  73          3HD       ARG  73  13.599   3.367  -1.890
  631    HE   ARG  73           HE       ARG  73  11.552   2.028  -3.074
  632   HH11  ARG  73          1HH1      ARG  73  14.376   3.665  -4.382
  633   HH12  ARG  73          2HH1      ARG  73  14.489   2.606  -5.746
  634   HH21  ARG  73          1HH2      ARG  73  11.772   0.612  -4.795
  635   HH22  ARG  73          2HH2      ARG  73  13.013   0.875  -5.981
  636    H    THR  74           H        THR  74  10.306   4.890   1.182
  637    HA   THR  74           HA       THR  74  10.518   7.500   2.206
  638    HB   THR  74           HB       THR  74  10.645   5.593   3.715
  639    HG1  THR  74           HG1      THR  74  12.802   6.125   4.724
  640   HG21  THR  74          1HG2      THR  74  11.738   3.928   2.259
  641   HG22  THR  74          2HG2      THR  74  12.580   4.058   3.804
  642   HG23  THR  74          3HG2      THR  74  13.259   4.822   2.367
  643    H    VAL  75           H        VAL  75  12.098   9.053   2.038
  644    HA   VAL  75           HA       VAL  75  13.937   8.866  -0.201
  645    HB   VAL  75           HB       VAL  75  12.548  10.907   0.151
  646   HG11  VAL  75          1HG1      VAL  75  14.229  11.412   2.629
  647   HG12  VAL  75          2HG1      VAL  75  12.508  11.026   2.592
  648   HG13  VAL  75          3HG1      VAL  75  13.081  12.551   1.917
  649   HG21  VAL  75          1HG2      VAL  75  15.541  11.437   0.264
  650   HG22  VAL  75          2HG2      VAL  75  14.320  12.590  -0.284
  651   HG23  VAL  75          3HG2      VAL  75  14.589  11.096  -1.184
  652    H    GLY  76           H        GLY  76  16.150   8.749  -0.073
  653    HA2  GLY  76          2HA       GLY  76  17.344   8.119   2.567
  654    HA3  GLY  76          3HA       GLY  76  17.942   7.605   0.996
  655    H    SER  77           H        SER  77  19.262   9.019   3.223
  656    HA   SER  77           HA       SER  77  20.661  11.004   1.578
  657    HB2  SER  77          2HB       SER  77  19.036  12.331   2.939
  658    HB3  SER  77          3HB       SER  77  19.664  11.602   4.415
  659    HG   SER  77           HG       SER  77  21.209  13.027   4.389
  660    H    LEU  78           H        LEU  78  22.806  11.496   2.500
  661    HA   LEU  78           HA       LEU  78  24.163   9.273   3.619
  662    HB2  LEU  78          2HB       LEU  78  26.155  10.598   3.646
  663    HB3  LEU  78          3HB       LEU  78  25.298  10.983   2.171
  664    HG   LEU  78           HG       LEU  78  25.307  12.782   4.639
  665   HD11  LEU  78          1HD1      LEU  78  27.010  12.994   2.136
  666   HD12  LEU  78          2HD1      LEU  78  27.575  12.585   3.759
  667   HD13  LEU  78          3HD1      LEU  78  26.923  14.189   3.436
  668   HD21  LEU  78          1HD2      LEU  78  24.478  14.535   3.137
  669   HD22  LEU  78          2HD2      LEU  78  23.367  13.166   3.164
  670   HD23  LEU  78          3HD2      LEU  78  24.451  13.392   1.789
  671    H    GLU  79           H        GLU  79  24.745   8.837   5.714
  672    HA   GLU  79           HA       GLU  79  23.293  10.354   7.818
  673    HB2  GLU  79          2HB       GLU  79  23.459   8.077   9.059
  674    HB3  GLU  79          3HB       GLU  79  22.341   8.190   7.712
  675    HG2  GLU  79          2HG       GLU  79  23.423   6.057   7.587
  676    HG3  GLU  79          3HG       GLU  79  24.027   7.039   6.259
  677    H    HIS  80           H        HIS  80  24.464   9.459  10.074
  678    HA   HIS  80           HA       HIS  80  27.401   9.844   9.823
  679    HB2  HIS  80          2HB       HIS  80  26.261  11.753  11.050
  680    HB3  HIS  80          3HB       HIS  80  25.680  10.601  12.252
  681    HD1  HIS  80           HD1      HIS  80  28.962  11.898  10.823
  682    HD2  HIS  80           HD2      HIS  80  27.502  10.166  14.316
  683    HE1  HIS  80           HE1      HIS  80  30.862  11.954  12.455
  684    HE2  HIS  80           HE2      HIS  80  29.902  11.074  14.601
  685    H    HIS  81           H        HIS  81  28.386   7.964  10.173
  686    HA   HIS  81           HA       HIS  81  27.189   5.641  11.235
  687    HB2  HIS  81          2HB       HIS  81  30.117   6.371  10.790
  688    HB3  HIS  81          3HB       HIS  81  29.603   4.776  11.335
  689    HD1  HIS  81           HD1      HIS  81  30.171   6.719   8.303
  690    HD2  HIS  81           HD2      HIS  81  27.883   3.426   9.379
  691    HE1  HIS  81           HE1      HIS  81  29.558   5.589   6.150
  692    HE2  HIS  81           HE2      HIS  81  27.985   3.762   6.830
  693    H    HIS  82           H        HIS  82  26.679   5.222  13.278
  694    HA   HIS  82           HA       HIS  82  27.641   6.707  15.537
  695    HB2  HIS  82          2HB       HIS  82  25.365   5.622  15.433
  696    HB3  HIS  82          3HB       HIS  82  26.135   4.041  15.511
  697    HD1  HIS  82           HD1      HIS  82  24.835   6.746  17.614
  698    HD2  HIS  82           HD2      HIS  82  27.464   3.565  18.094
  699    HE1  HIS  82           HE1      HIS  82  25.090   6.446  20.092
  700    HE2  HIS  82           HE2      HIS  82  26.815   4.629  20.340
  701    H    HIS  83           H        HIS  83  28.203   3.472  14.221
  702    HA   HIS  83           HA       HIS  83  30.435   2.897  16.017
  703    HB2  HIS  83          2HB       HIS  83  29.134   1.293  13.761
  704    HB3  HIS  83          3HB       HIS  83  30.543   0.735  14.661
  705    HD1  HIS  83           HD1      HIS  83  29.785  -1.028  16.203
  706    HD2  HIS  83           HD2      HIS  83  27.055   2.100  16.030
  707    HE1  HIS  83           HE1      HIS  83  27.975  -1.618  17.834
  708    HE2  HIS  83           HE2      HIS  83  26.426   0.364  17.829
  709    H    HIS  84           H        HIS  84  32.468   3.372  15.521
  710    HA   HIS  84           HA       HIS  84  33.299   3.861  12.705
  711    HB2  HIS  84          2HB       HIS  84  34.315   5.250  15.237
  712    HB3  HIS  84          3HB       HIS  84  35.006   5.453  13.630
  713    HD1  HIS  84           HD1      HIS  84  32.471   6.780  15.859
  714    HD2  HIS  84           HD2      HIS  84  33.167   6.764  11.764
  715    HE1  HIS  84           HE1      HIS  84  31.072   8.636  14.931
  716    HE2  HIS  84           HE2      HIS  84  31.500   8.597  12.446
  717    H    HIS  85           H        HIS  85  35.102   2.816  12.051
  718    HA   HIS  85           HA       HIS  85  36.456   0.985  13.946
  719    HB2  HIS  85          2HB       HIS  85  35.109  -0.139  12.155
  720    HB3  HIS  85          3HB       HIS  85  36.112   0.640  10.934
  721    HD1  HIS  85           HD1      HIS  85  38.124  -0.661  10.220
  722    HD2  HIS  85           HD2      HIS  85  36.708  -1.901  13.923
  723    HE1  HIS  85           HE1      HIS  85  39.504  -2.657  10.840
  724    HE2  HIS  85           HE2      HIS  85  38.746  -3.270  13.155
  Start of MODEL    2
    1    H1   MET   1          1H        MET   1 -19.702  -9.242   1.037
    2    H2   MET   1          2H        MET   1 -20.458  -8.192  -0.049
    3    H3   MET   1          3H        MET   1 -21.372  -9.337   0.787
    4    HA   MET   1           HA       MET   1 -21.657  -7.121   1.690
    5    HB2  MET   1          2HB       MET   1 -20.216  -9.092   3.526
    6    HB3  MET   1          3HB       MET   1 -21.141  -7.705   4.093
    7    HG2  MET   1          2HG       MET   1 -22.245 -10.070   2.563
    8    HG3  MET   1          3HG       MET   1 -22.439  -9.756   4.291
    9    HE1  MET   1          1HE       MET   1 -26.053  -9.098   2.822
   10    HE2  MET   1          2HE       MET   1 -25.131  -9.992   4.033
   11    HE3  MET   1          3HE       MET   1 -24.903 -10.333   2.316
   12    HA   PRO   2           HA       PRO   2 -17.455  -5.122   1.439
   13    HB2  PRO   2          2HB       PRO   2 -18.285  -2.781   0.258
   14    HB3  PRO   2          3HB       PRO   2 -17.895  -4.236  -0.680
   15    HG2  PRO   2          2HG       PRO   2 -20.588  -3.188   0.122
   16    HG3  PRO   2          3HG       PRO   2 -20.070  -3.884  -1.431
   17    HD2  PRO   2          2HD       PRO   2 -21.458  -5.322   0.444
   18    HD3  PRO   2          3HD       PRO   2 -20.315  -6.069  -0.691
   19    H    SER   3           H        SER   3 -17.059  -4.600   3.531
   20    HA   SER   3           HA       SER   3 -18.676  -2.501   4.884
   21    HB2  SER   3          2HB       SER   3 -17.010  -4.750   6.103
   22    HB3  SER   3          3HB       SER   3 -17.850  -3.496   7.027
   23    HG   SER   3           HG       SER   3 -19.803  -4.278   5.891
   24    H    GLU   4           H        GLU   4 -17.515  -0.868   6.038
   25    HA   GLU   4           HA       GLU   4 -15.345   0.216   4.634
   26    HB2  GLU   4          2HB       GLU   4 -15.264   1.940   6.403
   27    HB3  GLU   4          3HB       GLU   4 -16.909   1.633   5.861
   28    HG2  GLU   4          2HG       GLU   4 -17.360   0.307   7.878
   29    HG3  GLU   4          3HG       GLU   4 -15.691   0.519   8.414
   30    H    GLU   5           H        GLU   5 -15.423  -1.807   7.489
   31    HA   GLU   5           HA       GLU   5 -12.669  -1.505   8.231
   32    HB2  GLU   5          2HB       GLU   5 -14.692  -3.643   9.015
   33    HB3  GLU   5          3HB       GLU   5 -13.121  -3.393   9.781
   34    HG2  GLU   5          2HG       GLU   5 -13.835  -1.122  10.485
   35    HG3  GLU   5          3HG       GLU   5 -15.414  -1.402   9.745
   36    H    GLU   6           H        GLU   6 -14.524  -3.788   6.289
   37    HA   GLU   6           HA       GLU   6 -12.410  -5.575   5.619
   38    HB2  GLU   6          2HB       GLU   6 -14.727  -6.303   5.400
   39    HB3  GLU   6          3HB       GLU   6 -15.076  -5.008   4.255
   40    HG2  GLU   6          2HG       GLU   6 -13.619  -6.035   2.583
   41    HG3  GLU   6          3HG       GLU   6 -13.108  -7.266   3.734
   42    H    GLU   7           H        GLU   7 -13.452  -2.446   4.423
   43    HA   GLU   7           HA       GLU   7 -12.424  -2.517   1.823
   44    HB2  GLU   7          2HB       GLU   7 -12.798  -0.131   3.666
   45    HB3  GLU   7          3HB       GLU   7 -12.323   0.015   1.979
   46    HG2  GLU   7          2HG       GLU   7 -14.940  -1.034   3.071
   47    HG3  GLU   7          3HG       GLU   7 -14.684   0.447   2.156
   48    H    LYS   8           H        LYS   8 -10.854  -1.417   4.880
   49    HA   LYS   8           HA       LYS   8  -8.379  -0.714   3.757
   50    HB2  LYS   8          2HB       LYS   8  -8.919  -1.762   6.559
   51    HB3  LYS   8          3HB       LYS   8  -7.345  -1.198   6.020
   52    HG2  LYS   8          2HG       LYS   8  -8.068   0.731   7.015
   53    HG3  LYS   8          3HG       LYS   8  -8.704   1.010   5.393
   54    HD2  LYS   8          2HD       LYS   8 -10.386   1.561   7.058
   55    HD3  LYS   8          3HD       LYS   8 -10.915   0.164   6.129
   56    HE2  LYS   8          2HE       LYS   8 -11.361  -0.085   8.570
   57    HE3  LYS   8          3HE       LYS   8 -10.291  -1.342   7.952
   58    HZ1  LYS   8          1HZ       LYS   8  -9.476  -0.555  10.036
   59    HZ2  LYS   8          2HZ       LYS   8  -9.518   1.051   9.524
   60    HZ3  LYS   8          3HZ       LYS   8  -8.409  -0.019   8.837
   61    H    ARG   9           H        ARG   9  -9.646  -3.891   4.718
   62    HA   ARG   9           HA       ARG   9  -7.205  -5.341   4.520
   63    HB2  ARG   9          2HB       ARG   9 -10.045  -6.390   4.174
   64    HB3  ARG   9          3HB       ARG   9  -8.605  -7.377   4.444
   65    HG2  ARG   9          2HG       ARG   9  -8.313  -6.126   6.648
   66    HG3  ARG   9          3HG       ARG   9  -9.921  -5.446   6.380
   67    HD2  ARG   9          2HD       ARG   9  -9.225  -8.389   6.646
   68    HD3  ARG   9          3HD       ARG   9 -10.016  -7.393   7.869
   69    HE   ARG   9           HE       ARG   9 -11.250  -7.968   5.234
   70   HH11  ARG   9          1HH1      ARG   9 -11.522  -7.860   8.743
   71   HH12  ARG   9          2HH1      ARG   9 -13.200  -8.299   8.744
   72   HH21  ARG   9          1HH2      ARG   9 -13.430  -8.601   5.258
   73   HH22  ARG   9          2HH2      ARG   9 -14.279  -8.719   6.766
   74    H    GLN  10           H        GLN  10  -9.652  -4.412   2.152
   75    HA   GLN  10           HA       GLN  10  -8.536  -5.888  -0.051
   76    HB2  GLN  10          2HB       GLN  10 -10.421  -3.488  -0.092
   77    HB3  GLN  10          3HB       GLN  10 -10.032  -4.502  -1.480
   78    HG2  GLN  10          2HG       GLN  10 -11.015  -6.455  -0.209
   79    HG3  GLN  10          3HG       GLN  10 -11.568  -5.310   1.009
   80   HE21  GLN  10          1HE2      GLN  10 -13.227  -3.803   0.425
   81   HE22  GLN  10          2HE2      GLN  10 -14.228  -4.058  -0.953
   82    H    VAL  11           H        VAL  11  -8.134  -2.617   1.255
   83    HA   VAL  11           HA       VAL  11  -6.686  -1.510  -0.946
   84    HB   VAL  11           HB       VAL  11  -6.784  -0.554   1.958
   85   HG11  VAL  11          1HG1      VAL  11  -5.979   0.971  -0.541
   86   HG12  VAL  11          2HG1      VAL  11  -4.879   0.438   0.728
   87   HG13  VAL  11          3HG1      VAL  11  -6.110   1.654   1.081
   88   HG21  VAL  11          1HG2      VAL  11  -9.013  -0.665   0.918
   89   HG22  VAL  11          2HG2      VAL  11  -8.447   0.317  -0.426
   90   HG23  VAL  11          3HG2      VAL  11  -8.528   1.001   1.194
   91    H    LYS  12           H        LYS  12  -5.677  -2.876   2.185
   92    HA   LYS  12           HA       LYS  12  -2.894  -2.490   1.986
   93    HB2  LYS  12          2HB       LYS  12  -4.458  -4.624   3.494
   94    HB3  LYS  12          3HB       LYS  12  -2.733  -4.328   3.700
   95    HG2  LYS  12          2HG       LYS  12  -3.217  -2.068   4.554
   96    HG3  LYS  12          3HG       LYS  12  -4.950  -2.354   4.350
   97    HD2  LYS  12          2HD       LYS  12  -3.093  -3.948   6.166
   98    HD3  LYS  12          3HD       LYS  12  -4.220  -2.704   6.704
   99    HE2  LYS  12          2HE       LYS  12  -6.122  -4.056   6.126
  100    HE3  LYS  12          3HE       LYS  12  -5.117  -5.215   5.254
  101    HZ1  LYS  12          1HZ       LYS  12  -4.052  -5.779   7.366
  102    HZ2  LYS  12          2HZ       LYS  12  -5.711  -6.095   7.382
  103    HZ3  LYS  12          3HZ       LYS  12  -5.104  -4.735   8.180
  104    H    GLN  13           H        GLN  13  -5.078  -5.060   0.953
  105    HA   GLN  13           HA       GLN  13  -3.177  -6.960   0.085
  106    HB2  GLN  13          2HB       GLN  13  -5.539  -7.559   0.431
  107    HB3  GLN  13          3HB       GLN  13  -6.050  -6.457  -0.840
  108    HG2  GLN  13          2HG       GLN  13  -4.880  -7.863  -2.515
  109    HG3  GLN  13          3HG       GLN  13  -4.382  -8.957  -1.228
  110   HE21  GLN  13          1HE2      GLN  13  -7.603  -7.468  -1.449
  111   HE22  GLN  13          2HE2      GLN  13  -8.443  -8.946  -1.755
  112    H    VAL  14           H        VAL  14  -5.059  -4.536  -1.834
  113    HA   VAL  14           HA       VAL  14  -3.809  -4.936  -4.311
  114    HB   VAL  14           HB       VAL  14  -5.009  -2.348  -3.189
  115   HG11  VAL  14          1HG1      VAL  14  -5.238  -1.591  -5.544
  116   HG12  VAL  14          2HG1      VAL  14  -4.369  -3.027  -6.090
  117   HG13  VAL  14          3HG1      VAL  14  -3.541  -1.821  -5.104
  118   HG21  VAL  14          1HG2      VAL  14  -7.042  -2.966  -4.461
  119   HG22  VAL  14          2HG2      VAL  14  -6.628  -4.222  -3.293
  120   HG23  VAL  14          3HG2      VAL  14  -6.258  -4.458  -4.999
  121    H    ALA  15           H        ALA  15  -2.950  -2.822  -1.619
  122    HA   ALA  15           HA       ALA  15  -0.860  -1.341  -2.745
  123    HB1  ALA  15          1HB       ALA  15  -2.026  -0.710  -0.666
  124    HB2  ALA  15          2HB       ALA  15  -0.279  -0.772  -0.420
  125    HB3  ALA  15          3HB       ALA  15  -1.304  -2.086   0.167
  126    H    LYS  16           H        LYS  16  -0.787  -4.389  -0.883
  127    HA   LYS  16           HA       LYS  16   2.078  -4.553  -0.871
  128    HB2  LYS  16          2HB       LYS  16   1.826  -6.635   0.302
  129    HB3  LYS  16          3HB       LYS  16   0.663  -5.501   0.949
  130    HG2  LYS  16          2HG       LYS  16  -1.099  -6.642  -0.404
  131    HG3  LYS  16          3HG       LYS  16   0.099  -7.837  -0.902
  132    HD2  LYS  16          2HD       LYS  16  -0.866  -7.293   1.938
  133    HD3  LYS  16          3HD       LYS  16  -1.235  -8.711   0.955
  134    HE2  LYS  16          2HE       LYS  16   1.214  -9.286   0.960
  135    HE3  LYS  16          3HE       LYS  16   1.490  -7.933   2.060
  136    HZ1  LYS  16          1HZ       LYS  16   1.295 -10.009   3.257
  137    HZ2  LYS  16          2HZ       LYS  16  -0.238 -10.286   2.609
  138    HZ3  LYS  16          3HZ       LYS  16   0.013  -8.988   3.655
  139    H    GLU  17           H        GLU  17  -0.502  -5.830  -2.897
  140    HA   GLU  17           HA       GLU  17   1.031  -7.682  -4.394
  141    HB2  GLU  17          2HB       GLU  17  -1.476  -6.123  -5.160
  142    HB3  GLU  17          3HB       GLU  17  -0.779  -7.398  -6.153
  143    HG2  GLU  17          2HG       GLU  17  -1.862  -7.763  -3.344
  144    HG3  GLU  17          3HG       GLU  17  -2.729  -8.151  -4.826
  145    H    LYS  18           H        LYS  18   0.416  -4.183  -4.744
  146    HA   LYS  18           HA       LYS  18   1.660  -3.711  -7.212
  147    HB2  LYS  18          2HB       LYS  18   1.577  -1.856  -4.792
  148    HB3  LYS  18          3HB       LYS  18   2.006  -1.359  -6.425
  149    HG2  LYS  18          2HG       LYS  18  -0.688  -2.331  -5.463
  150    HG3  LYS  18          3HG       LYS  18  -0.263  -0.691  -5.941
  151    HD2  LYS  18          2HD       LYS  18  -0.316  -3.112  -7.792
  152    HD3  LYS  18          3HD       LYS  18  -1.577  -1.885  -7.676
  153    HE2  LYS  18          2HE       LYS  18  -0.146  -0.191  -8.580
  154    HE3  LYS  18          3HE       LYS  18   1.285  -1.213  -8.419
  155    HZ1  LYS  18          1HZ       LYS  18   0.553  -1.172 -10.680
  156    HZ2  LYS  18          2HZ       LYS  18  -0.997  -1.670 -10.243
  157    HZ3  LYS  18          3HZ       LYS  18   0.308  -2.722 -10.049
  158    H    LEU  19           H        LEU  19   2.988  -3.588  -3.921
  159    HA   LEU  19           HA       LEU  19   5.652  -2.949  -4.639
  160    HB2  LEU  19          2HB       LEU  19   4.562  -4.233  -2.110
  161    HB3  LEU  19          3HB       LEU  19   6.193  -3.603  -2.288
  162    HG   LEU  19           HG       LEU  19   3.602  -2.013  -2.271
  163   HD11  LEU  19          1HD1      LEU  19   4.584  -0.899  -0.320
  164   HD12  LEU  19          2HD1      LEU  19   6.003  -1.945  -0.426
  165   HD13  LEU  19          3HD1      LEU  19   4.420  -2.635  -0.065
  166   HD21  LEU  19          1HD2      LEU  19   5.016  -1.046  -4.001
  167   HD22  LEU  19          2HD2      LEU  19   6.391  -0.986  -2.895
  168   HD23  LEU  19          3HD2      LEU  19   4.971   0.020  -2.598
  169    H    LEU  20           H        LEU  20   3.967  -6.004  -4.355
  170    HA   LEU  20           HA       LEU  20   6.337  -7.657  -4.528
  171    HB2  LEU  20          2HB       LEU  20   3.377  -8.308  -4.771
  172    HB3  LEU  20          3HB       LEU  20   4.637  -9.525  -4.900
  173    HG   LEU  20           HG       LEU  20   4.179  -7.805  -2.429
  174   HD11  LEU  20          1HD1      LEU  20   3.209  -9.784  -1.367
  175   HD12  LEU  20          2HD1      LEU  20   3.348 -10.685  -2.880
  176   HD13  LEU  20          3HD1      LEU  20   2.266  -9.291  -2.775
  177   HD21  LEU  20          1HD2      LEU  20   5.697  -9.386  -1.305
  178   HD22  LEU  20          2HD2      LEU  20   6.500  -8.551  -2.630
  179   HD23  LEU  20          3HD2      LEU  20   5.972 -10.225  -2.834
  180    H    GLU  21           H        GLU  21   4.083  -6.215  -6.842
  181    HA   GLU  21           HA       GLU  21   4.943  -7.692  -9.156
  182    HB2  GLU  21          2HB       GLU  21   3.617  -4.957  -8.917
  183    HB3  GLU  21          3HB       GLU  21   3.945  -5.748 -10.455
  184    HG2  GLU  21          2HG       GLU  21   2.430  -7.589  -9.853
  185    HG3  GLU  21          3HG       GLU  21   2.121  -6.836  -8.291
  186    H    GLN  22           H        GLN  22   5.853  -4.607  -7.677
  187    HA   GLN  22           HA       GLN  22   7.847  -3.815  -9.551
  188    HB2  GLN  22          2HB       GLN  22   7.394  -3.015  -6.640
  189    HB3  GLN  22          3HB       GLN  22   8.536  -2.211  -7.717
  190    HG2  GLN  22          2HG       GLN  22   6.750  -1.434  -9.143
  191    HG3  GLN  22          3HG       GLN  22   5.556  -2.379  -8.252
  192   HE21  GLN  22          1HE2      GLN  22   4.944  -1.683  -6.174
  193   HE22  GLN  22          2HE2      GLN  22   5.238  -0.075  -5.625
  194    H    SER  23           H        SER  23   7.936  -5.594  -6.493
  195    HA   SER  23           HA       SER  23  10.603  -6.636  -7.082
  196    HB2  SER  23          2HB       SER  23  10.995  -4.561  -5.739
  197    HB3  SER  23          3HB       SER  23   9.978  -5.211  -4.453
  198    HG   SER  23           HG       SER  23  11.622  -6.302  -3.790
  199    HA   PRO  24           HA       PRO  24   7.981 -10.017  -5.267
  200    HB2  PRO  24          2HB       PRO  24   8.636 -11.955  -7.054
  201    HB3  PRO  24          3HB       PRO  24   7.461 -10.687  -7.470
  202    HG2  PRO  24          2HG       PRO  24  10.371 -10.863  -8.214
  203    HG3  PRO  24          3HG       PRO  24   8.976 -10.425  -9.228
  204    HD2  PRO  24          2HD       PRO  24  10.644  -8.558  -8.067
  205    HD3  PRO  24          3HD       PRO  24   8.946  -8.233  -8.478
  206    H    ASN  25           H        ASN  25  11.217  -9.284  -5.540
  207    HA   ASN  25           HA       ASN  25  12.322 -11.728  -4.340
  208    HB2  ASN  25          2HB       ASN  25  13.673  -9.174  -5.342
  209    HB3  ASN  25          3HB       ASN  25  14.514 -10.621  -4.788
  210   HD21  ASN  25          1HD2      ASN  25  14.600 -12.428  -6.159
  211   HD22  ASN  25          2HD2      ASN  25  14.106 -12.368  -7.810
  212    H    SER  26           H        SER  26  10.567  -9.482  -3.008
  213    HA   SER  26           HA       SER  26  12.274  -9.074  -0.620
  214    HB2  SER  26          2HB       SER  26  11.358  -6.739  -0.461
  215    HB3  SER  26          3HB       SER  26  12.365  -6.989  -1.888
  216    HG   SER  26           HG       SER  26   9.600  -7.393  -2.126
  217    H    LYS  27           H        LYS  27  11.169  -9.005   1.347
  218    HA   LYS  27           HA       LYS  27   8.432 -10.034   1.349
  219    HB2  LYS  27          2HB       LYS  27  10.382  -9.592   3.635
  220    HB3  LYS  27          3HB       LYS  27   8.774 -10.282   3.811
  221    HG2  LYS  27          2HG       LYS  27  11.038 -11.507   2.199
  222    HG3  LYS  27          3HG       LYS  27  10.565 -11.974   3.822
  223    HD2  LYS  27          2HD       LYS  27   9.474 -13.625   2.614
  224    HD3  LYS  27          3HD       LYS  27   8.194 -12.419   2.684
  225    HE2  LYS  27          2HE       LYS  27   8.813 -11.660   0.402
  226    HE3  LYS  27          3HE       LYS  27  10.093 -12.871   0.353
  227    HZ1  LYS  27          1HZ       LYS  27   7.193 -13.426   0.576
  228    HZ2  LYS  27          2HZ       LYS  27   8.413 -14.590   0.546
  229    HZ3  LYS  27          3HZ       LYS  27   8.139 -13.620  -0.809
  230    H    VAL  28           H        VAL  28   6.858  -8.722   1.339
  231    HA   VAL  28           HA       VAL  28   7.053  -5.927   2.241
  232    HB   VAL  28           HB       VAL  28   4.955  -7.293   0.481
  233   HG11  VAL  28          1HG1      VAL  28   5.282  -4.343   1.160
  234   HG12  VAL  28          2HG1      VAL  28   3.978  -5.393   1.717
  235   HG13  VAL  28          3HG1      VAL  28   4.127  -5.004   0.001
  236   HG21  VAL  28          1HG2      VAL  28   5.974  -6.042  -1.390
  237   HG22  VAL  28          2HG2      VAL  28   7.150  -7.127  -0.640
  238   HG23  VAL  28          3HG2      VAL  28   7.200  -5.394  -0.296
  239    H    GLN  29           H        GLN  29   6.151  -5.422   4.099
  240    HA   GLN  29           HA       GLN  29   3.951  -6.990   5.322
  241    HB2  GLN  29          2HB       GLN  29   6.030  -5.163   6.638
  242    HB3  GLN  29          3HB       GLN  29   4.728  -5.986   7.490
  243    HG2  GLN  29          2HG       GLN  29   7.026  -7.349   6.050
  244    HG3  GLN  29          3HG       GLN  29   6.914  -7.096   7.789
  245   HE21  GLN  29          1HE2      GLN  29   5.814  -8.993   5.100
  246   HE22  GLN  29          2HE2      GLN  29   4.964 -10.183   6.020
  247    H    VAL  30           H        VAL  30   2.385  -5.558   6.542
  248    HA   VAL  30           HA       VAL  30   2.131  -2.837   5.394
  249    HB   VAL  30           HB       VAL  30   0.045  -4.518   6.859
  250   HG11  VAL  30          1HG1      VAL  30  -0.213  -1.768   5.581
  251   HG12  VAL  30          2HG1      VAL  30  -0.293  -2.130   7.306
  252   HG13  VAL  30          3HG1      VAL  30  -1.553  -2.718   6.223
  253   HG21  VAL  30          1HG2      VAL  30   0.508  -5.388   4.588
  254   HG22  VAL  30          2HG2      VAL  30   0.226  -3.785   3.902
  255   HG23  VAL  30          3HG2      VAL  30  -1.103  -4.666   4.662
  256    H    ARG  31           H        ARG  31   3.007  -1.310   6.656
  257    HA   ARG  31           HA       ARG  31   3.822  -1.942   9.369
  258    HB2  ARG  31          2HB       ARG  31   5.350  -0.820   7.706
  259    HB3  ARG  31          3HB       ARG  31   4.319   0.608   7.767
  260    HG2  ARG  31          2HG       ARG  31   6.253   0.945   9.200
  261    HG3  ARG  31          3HG       ARG  31   4.803   0.828  10.200
  262    HD2  ARG  31          2HD       ARG  31   5.433  -1.689  10.466
  263    HD3  ARG  31          3HD       ARG  31   7.013  -1.216   9.829
  264    HE   ARG  31           HE       ARG  31   6.049   0.340  12.078
  265   HH11  ARG  31          1HH1      ARG  31   7.980  -2.469  11.143
  266   HH12  ARG  31          2HH1      ARG  31   8.847  -2.494  12.646
  267   HH21  ARG  31          1HH2      ARG  31   7.200   0.290  13.993
  268   HH22  ARG  31          2HH2      ARG  31   8.405  -0.929  14.259
  269    H    ARG  32           H        ARG  32   1.685   0.408   7.780
  270    HA   ARG  32           HA       ARG  32   0.027   0.808  10.090
  271    HB2  ARG  32          2HB       ARG  32   2.032   2.256  10.609
  272    HB3  ARG  32          3HB       ARG  32   1.762   3.150   9.124
  273    HG2  ARG  32          2HG       ARG  32  -0.476   3.060  11.140
  274    HG3  ARG  32          3HG       ARG  32   0.937   4.038  11.525
  275    HD2  ARG  32          2HD       ARG  32   0.595   5.227   9.307
  276    HD3  ARG  32          3HD       ARG  32  -0.938   4.366   9.155
  277    HE   ARG  32           HE       ARG  32  -1.535   5.447  11.353
  278   HH11  ARG  32          1HH1      ARG  32   0.686   7.041   9.136
  279   HH12  ARG  32          2HH1      ARG  32   0.330   8.629   9.739
  280   HH21  ARG  32          1HH2      ARG  32  -1.917   7.522  12.182
  281   HH22  ARG  32          2HH2      ARG  32  -1.138   8.896  11.459
  282    H    VAL  33           H        VAL  33  -1.965   1.747   9.441
  283    HA   VAL  33           HA       VAL  33  -2.290   2.412   6.560
  284    HB   VAL  33           HB       VAL  33  -4.427   1.241   8.407
  285   HG11  VAL  33          1HG1      VAL  33  -5.729   0.866   6.330
  286   HG12  VAL  33          2HG1      VAL  33  -4.445   1.635   5.393
  287   HG13  VAL  33          3HG1      VAL  33  -5.364   2.581   6.564
  288   HG21  VAL  33          1HG2      VAL  33  -4.145  -0.898   7.215
  289   HG22  VAL  33          2HG2      VAL  33  -2.651  -0.427   8.033
  290   HG23  VAL  33          3HG2      VAL  33  -2.809  -0.209   6.288
  291    H    GLN  34           H        GLN  34  -3.402   4.325   6.087
  292    HA   GLN  34           HA       GLN  34  -4.662   5.817   8.297
  293    HB2  GLN  34          2HB       GLN  34  -2.364   6.731   7.986
  294    HB3  GLN  34          3HB       GLN  34  -2.719   7.046   6.287
  295    HG2  GLN  34          2HG       GLN  34  -2.895   9.093   7.670
  296    HG3  GLN  34          3HG       GLN  34  -4.427   8.680   6.903
  297   HE21  GLN  34          1HE2      GLN  34  -2.709   8.828   9.940
  298   HE22  GLN  34          2HE2      GLN  34  -4.097   8.674  10.954
  299    H    LYS  35           H        LYS  35  -6.708   6.042   7.736
  300    HA   LYS  35           HA       LYS  35  -7.631   6.047   4.967
  301    HB2  LYS  35          2HB       LYS  35  -8.693   4.851   7.126
  302    HB3  LYS  35          3HB       LYS  35  -9.444   6.415   7.383
  303    HG2  LYS  35          2HG       LYS  35  -9.771   4.646   4.946
  304    HG3  LYS  35          3HG       LYS  35 -10.954   4.860   6.234
  305    HD2  LYS  35          2HD       LYS  35 -11.274   7.210   5.574
  306    HD3  LYS  35          3HD       LYS  35 -10.010   7.065   4.349
  307    HE2  LYS  35          2HE       LYS  35 -12.212   6.937   3.309
  308    HE3  LYS  35          3HE       LYS  35 -11.388   5.386   3.152
  309    HZ1  LYS  35          1HZ       LYS  35 -12.700   4.536   4.967
  310    HZ2  LYS  35          2HZ       LYS  35 -13.716   5.163   3.776
  311    HZ3  LYS  35          3HZ       LYS  35 -13.442   6.040   5.191
  312    H    GLN  36           H        GLN  36  -7.696   7.994   3.899
  313    HA   GLN  36           HA       GLN  36  -8.529  10.441   5.347
  314    HB2  GLN  36          2HB       GLN  36  -6.326  10.220   3.244
  315    HB3  GLN  36          3HB       GLN  36  -6.957  11.746   3.859
  316    HG2  GLN  36          2HG       GLN  36  -6.112  11.259   6.085
  317    HG3  GLN  36          3HG       GLN  36  -5.611   9.644   5.583
  318   HE21  GLN  36          1HE2      GLN  36  -4.912  13.065   5.328
  319   HE22  GLN  36          2HE2      GLN  36  -3.298  12.889   4.734
  320    H    GLY  37           H        GLY  37 -10.625   9.631   4.543
  321    HA2  GLY  37          2HA       GLY  37 -12.490  10.159   3.327
  322    HA3  GLY  37          3HA       GLY  37 -11.519  11.316   2.434
  323    H    ASN  38           H        ASN  38 -10.800  10.798   0.402
  324    HA   ASN  38           HA       ASN  38 -11.856   8.452  -0.954
  325    HB2  ASN  38          2HB       ASN  38 -10.086  10.758  -1.895
  326    HB3  ASN  38          3HB       ASN  38 -10.534   9.417  -2.943
  327   HD21  ASN  38          1HD2      ASN  38 -12.676   9.245  -3.655
  328   HD22  ASN  38          2HD2      ASN  38 -13.777  10.574  -3.557
  329    H    THR  39           H        THR  39  -8.673   9.750  -0.067
  330    HA   THR  39           HA       THR  39  -7.309   7.431  -1.240
  331    HB   THR  39           HB       THR  39  -6.107  10.021  -0.176
  332    HG1  THR  39           HG1      THR  39  -7.659   9.731  -2.276
  333   HG21  THR  39          1HG2      THR  39  -4.172   9.431  -1.608
  334   HG22  THR  39          2HG2      THR  39  -4.976   7.934  -2.087
  335   HG23  THR  39          3HG2      THR  39  -4.468   8.163  -0.413
  336    H    ILE  40           H        ILE  40  -7.179   5.786   0.191
  337    HA   ILE  40           HA       ILE  40  -6.367   6.198   2.961
  338    HB   ILE  40           HB       ILE  40  -6.733   3.599   1.400
  339   HG12  ILE  40          2HG1      ILE  40  -8.624   5.077   3.286
  340   HG13  ILE  40          3HG1      ILE  40  -8.859   4.818   1.561
  341   HG21  ILE  40          1HG2      ILE  40  -6.735   2.489   3.612
  342   HG22  ILE  40          2HG2      ILE  40  -6.431   4.038   4.398
  343   HG23  ILE  40          3HG2      ILE  40  -5.210   3.338   3.335
  344   HD11  ILE  40          1HD1      ILE  40  -8.852   2.669   3.681
  345   HD12  ILE  40          2HD1      ILE  40  -9.122   2.432   1.954
  346   HD13  ILE  40          3HD1      ILE  40 -10.266   3.372   2.899
  347    H    ARG  41           H        ARG  41  -4.303   6.836   3.158
  348    HA   ARG  41           HA       ARG  41  -2.131   5.843   1.505
  349    HB2  ARG  41          2HB       ARG  41  -2.224   7.735   3.892
  350    HB3  ARG  41          3HB       ARG  41  -0.718   7.235   3.126
  351    HG2  ARG  41          2HG       ARG  41  -1.608   8.184   0.958
  352    HG3  ARG  41          3HG       ARG  41  -2.962   8.846   1.875
  353    HD2  ARG  41          2HD       ARG  41  -1.546  10.313   3.106
  354    HD3  ARG  41          3HD       ARG  41  -0.082   9.451   2.615
  355    HE   ARG  41           HE       ARG  41  -1.158  10.347   0.266
  356   HH11  ARG  41          1HH1      ARG  41  -0.142  11.971   3.230
  357   HH12  ARG  41          2HH1      ARG  41   0.288  13.437   2.407
  358   HH21  ARG  41          1HH2      ARG  41  -0.521  12.222  -0.790
  359   HH22  ARG  41          2HH2      ARG  41   0.073  13.580   0.117
  360    H    VAL  42           H        VAL  42  -1.976   3.683   1.883
  361    HA   VAL  42           HA       VAL  42  -1.610   2.626   4.585
  362    HB   VAL  42           HB       VAL  42  -1.350   1.154   1.916
  363   HG11  VAL  42          1HG1      VAL  42  -0.238  -0.006   3.801
  364   HG12  VAL  42          2HG1      VAL  42  -1.656  -0.903   3.254
  365   HG13  VAL  42          3HG1      VAL  42  -1.737   0.060   4.733
  366   HG21  VAL  42          1HG2      VAL  42  -3.641   0.313   2.324
  367   HG22  VAL  42          2HG2      VAL  42  -3.611   2.067   2.122
  368   HG23  VAL  42          3HG2      VAL  42  -3.771   1.366   3.736
  369    H    GLU  43           H        GLU  43   0.334   2.976   5.450
  370    HA   GLU  43           HA       GLU  43   2.799   3.184   3.915
  371    HB2  GLU  43          2HB       GLU  43   2.193   3.331   6.895
  372    HB3  GLU  43          3HB       GLU  43   3.806   3.548   6.213
  373    HG2  GLU  43          2HG       GLU  43   3.000   5.497   4.931
  374    HG3  GLU  43          3HG       GLU  43   1.379   5.269   5.588
  375    H    LEU  44           H        LEU  44   3.541   1.278   3.183
  376    HA   LEU  44           HA       LEU  44   3.451  -1.147   4.843
  377    HB2  LEU  44          2HB       LEU  44   4.144  -0.850   1.904
  378    HB3  LEU  44          3HB       LEU  44   4.078  -2.365   2.789
  379    HG   LEU  44           HG       LEU  44   1.551  -1.591   3.270
  380   HD11  LEU  44          1HD1      LEU  44   2.139  -0.190   0.661
  381   HD12  LEU  44          2HD1      LEU  44   1.736   0.584   2.194
  382   HD13  LEU  44          3HD1      LEU  44   0.542  -0.424   1.380
  383   HD21  LEU  44          1HD2      LEU  44   2.391  -2.797   0.627
  384   HD22  LEU  44          2HD2      LEU  44   0.789  -2.910   1.364
  385   HD23  LEU  44          3HD2      LEU  44   2.174  -3.671   2.145
  386    H    GLU  45           H        GLU  45   5.406  -2.607   4.491
  387    HA   GLU  45           HA       GLU  45   7.934  -1.106   4.770
  388    HB2  GLU  45          2HB       GLU  45   7.019  -1.601   6.989
  389    HB3  GLU  45          3HB       GLU  45   6.783  -3.291   6.553
  390    HG2  GLU  45          2HG       GLU  45   9.250  -3.560   6.361
  391    HG3  GLU  45          3HG       GLU  45   9.451  -1.880   6.865
  392    H    LEU  46           H        LEU  46   8.991  -1.777   2.969
  393    HA   LEU  46           HA       LEU  46   8.881  -4.604   2.102
  394    HB2  LEU  46          2HB       LEU  46   8.086  -2.865   0.509
  395    HB3  LEU  46          3HB       LEU  46   9.642  -2.074   0.582
  396    HG   LEU  46           HG       LEU  46   9.446  -4.928  -0.453
  397   HD11  LEU  46          1HD1      LEU  46   7.787  -3.669  -1.746
  398   HD12  LEU  46          2HD1      LEU  46   9.181  -4.076  -2.746
  399   HD13  LEU  46          3HD1      LEU  46   8.992  -2.433  -2.120
  400   HD21  LEU  46          1HD2      LEU  46  11.355  -2.655  -1.091
  401   HD22  LEU  46          2HD2      LEU  46  11.423  -4.284  -1.772
  402   HD23  LEU  46          3HD2      LEU  46  11.702  -4.036  -0.050
  403    H    ARG  47           H        ARG  47  10.834  -5.729   1.768
  404    HA   ARG  47           HA       ARG  47  13.220  -4.550   3.094
  405    HB2  ARG  47          2HB       ARG  47  12.257  -7.435   2.901
  406    HB3  ARG  47          3HB       ARG  47  13.820  -6.972   3.571
  407    HG2  ARG  47          2HG       ARG  47  12.859  -5.926   5.446
  408    HG3  ARG  47          3HG       ARG  47  11.274  -5.790   4.691
  409    HD2  ARG  47          2HD       ARG  47  10.893  -8.177   4.943
  410    HD3  ARG  47          3HD       ARG  47  12.541  -8.424   5.518
  411    HE   ARG  47           HE       ARG  47  11.792  -7.959   7.597
  412   HH11  ARG  47          1HH1      ARG  47   9.600  -6.204   5.431
  413   HH12  ARG  47          2HH1      ARG  47   8.641  -5.596   6.742
  414   HH21  ARG  47          1HH2      ARG  47  10.510  -7.142   9.258
  415   HH22  ARG  47          2HH2      ARG  47   9.149  -6.121   8.892
  416    H    THR  48           H        THR  48  14.306  -3.707   1.397
  417    HA   THR  48           HA       THR  48  14.861  -5.196  -1.056
  418    HB   THR  48           HB       THR  48  15.747  -2.400  -0.195
  419    HG1  THR  48           HG1      THR  48  13.889  -1.739  -0.920
  420   HG21  THR  48          1HG2      THR  48  16.241  -2.022  -2.579
  421   HG22  THR  48          2HG2      THR  48  15.754  -3.671  -2.968
  422   HG23  THR  48          3HG2      THR  48  17.192  -3.392  -1.984
  423    H    ASN  49           H        ASN  49  16.370  -6.764  -0.679
  424    HA   ASN  49           HA       ASN  49  18.386  -7.751  -0.472
  425    HB2  ASN  49          2HB       ASN  49  19.078  -5.641  -1.769
  426    HB3  ASN  49          3HB       ASN  49  19.591  -4.948  -0.237
  427   HD21  ASN  49          1HD2      ASN  49  20.153  -7.563  -2.515
  428   HD22  ASN  49          2HD2      ASN  49  21.787  -7.858  -2.044
  429    H    GLY  50           H        GLY  50  16.731  -7.172   1.859
  430    HA2  GLY  50          2HA       GLY  50  16.943  -7.886   4.084
  431    HA3  GLY  50          3HA       GLY  50  18.677  -7.621   4.012
  432    H    LYS  51           H        LYS  51  17.738  -4.867   2.718
  433    HA   LYS  51           HA       LYS  51  17.702  -3.385   5.259
  434    HB2  LYS  51          2HB       LYS  51  18.094  -2.428   2.375
  435    HB3  LYS  51          3HB       LYS  51  18.046  -1.359   3.773
  436    HG2  LYS  51          2HG       LYS  51  20.340  -1.651   3.279
  437    HG3  LYS  51          3HG       LYS  51  20.022  -2.645   4.704
  438    HD2  LYS  51          2HD       LYS  51  19.840  -4.656   3.173
  439    HD3  LYS  51          3HD       LYS  51  20.324  -3.617   1.830
  440    HE2  LYS  51          2HE       LYS  51  22.462  -3.150   3.003
  441    HE3  LYS  51          3HE       LYS  51  21.974  -4.241   4.300
  442    HZ1  LYS  51          1HZ       LYS  51  21.933  -6.057   2.734
  443    HZ2  LYS  51          2HZ       LYS  51  23.447  -5.303   2.697
  444    HZ3  LYS  51          3HZ       LYS  51  22.334  -5.022   1.458
  445    H    LYS  52           H        LYS  52  16.154  -1.697   5.590
  446    HA   LYS  52           HA       LYS  52  13.478  -2.506   4.680
  447    HB2  LYS  52          2HB       LYS  52  14.004  -2.536   7.110
  448    HB3  LYS  52          3HB       LYS  52  14.343  -0.810   7.044
  449    HG2  LYS  52          2HG       LYS  52  11.907  -0.522   6.239
  450    HG3  LYS  52          3HG       LYS  52  11.675  -2.205   6.722
  451    HD2  LYS  52          2HD       LYS  52  10.957  -0.774   8.542
  452    HD3  LYS  52          3HD       LYS  52  12.437  -1.605   9.030
  453    HE2  LYS  52          2HE       LYS  52  13.746   0.443   8.475
  454    HE3  LYS  52          3HE       LYS  52  12.246   1.261   8.027
  455    HZ1  LYS  52          1HZ       LYS  52  11.467   1.012  10.283
  456    HZ2  LYS  52          2HZ       LYS  52  12.956   1.811  10.271
  457    HZ3  LYS  52          3HZ       LYS  52  12.874   0.183  10.719
  458    H    GLU  53           H        GLU  53  12.693  -1.310   3.040
  459    HA   GLU  53           HA       GLU  53  12.781   1.656   3.190
  460    HB2  GLU  53          2HB       GLU  53  12.479  -0.089   0.692
  461    HB3  GLU  53          3HB       GLU  53  12.318   1.666   0.722
  462    HG2  GLU  53          2HG       GLU  53  14.697   1.818   1.496
  463    HG3  GLU  53          3HG       GLU  53  14.835   0.071   1.294
  464    H    ASN  54           H        ASN  54  10.873   2.282   4.040
  465    HA   ASN  54           HA       ASN  54   8.428   0.741   3.813
  466    HB2  ASN  54          2HB       ASN  54   8.998   3.464   5.079
  467    HB3  ASN  54          3HB       ASN  54   7.439   2.646   5.159
  468   HD21  ASN  54          1HD2      ASN  54   7.214   0.832   6.506
  469   HD22  ASN  54          2HD2      ASN  54   8.389   0.426   7.710
  470    H    TYR  55           H        TYR  55   6.912   0.984   2.232
  471    HA   TYR  55           HA       TYR  55   6.990   3.382   0.469
  472    HB2  TYR  55          2HB       TYR  55   6.074   0.540  -0.147
  473    HB3  TYR  55          3HB       TYR  55   5.840   1.898  -1.235
  474    HD1  TYR  55           HD1      TYR  55   7.517   2.425  -2.831
  475    HD2  TYR  55           HD2      TYR  55   8.527  -0.082   0.471
  476    HE1  TYR  55           HE1      TYR  55   9.696   1.943  -3.861
  477    HE2  TYR  55           HE2      TYR  55  10.701  -0.557  -0.548
  478    HH   TYR  55           HH       TYR  55  11.977   1.221  -3.086
  479    H    THR  56           H        THR  56   5.349   4.708   0.893
  480    HA   THR  56           HA       THR  56   2.827   3.857   2.047
  481    HB   THR  56           HB       THR  56   3.717   6.615   1.094
  482    HG1  THR  56           HG1      THR  56   4.464   5.150   3.247
  483   HG21  THR  56          1HG2      THR  56   1.454   5.808   2.965
  484   HG22  THR  56          2HG2      THR  56   1.261   6.463   1.334
  485   HG23  THR  56          3HG2      THR  56   1.946   7.464   2.619
  486    H    VAL  57           H        VAL  57   1.609   2.752   0.571
  487    HA   VAL  57           HA       VAL  57   1.361   3.657  -2.201
  488    HB   VAL  57           HB       VAL  57   0.119   1.219  -0.850
  489   HG11  VAL  57          1HG1      VAL  57  -1.139   1.927  -2.848
  490   HG12  VAL  57          2HG1      VAL  57  -0.296   0.409  -3.158
  491   HG13  VAL  57          3HG1      VAL  57   0.345   1.921  -3.801
  492   HG21  VAL  57          1HG2      VAL  57   1.877  -0.107  -1.978
  493   HG22  VAL  57          2HG2      VAL  57   2.584   1.063  -0.859
  494   HG23  VAL  57          3HG2      VAL  57   2.605   1.379  -2.595
  495    H    GLU  58           H        GLU  58   0.061   5.277  -2.423
  496    HA   GLU  58           HA       GLU  58  -2.226   5.888  -0.737
  497    HB2  GLU  58          2HB       GLU  58  -1.196   7.322  -3.233
  498    HB3  GLU  58          3HB       GLU  58  -2.262   7.991  -1.997
  499    HG2  GLU  58          2HG       GLU  58  -0.474   8.029  -0.372
  500    HG3  GLU  58          3HG       GLU  58   0.586   7.108  -1.435
  501    H    VAL  59           H        VAL  59  -3.948   4.568  -1.185
  502    HA   VAL  59           HA       VAL  59  -4.739   4.070  -4.002
  503    HB   VAL  59           HB       VAL  59  -5.621   2.458  -1.570
  504   HG11  VAL  59          1HG1      VAL  59  -6.242   0.741  -3.246
  505   HG12  VAL  59          2HG1      VAL  59  -5.732   1.831  -4.537
  506   HG13  VAL  59          3HG1      VAL  59  -7.103   2.262  -3.514
  507   HG21  VAL  59          1HG2      VAL  59  -3.309   1.821  -3.438
  508   HG22  VAL  59          2HG2      VAL  59  -3.950   0.735  -2.201
  509   HG23  VAL  59          3HG2      VAL  59  -3.177   2.253  -1.729
  510    H    GLU  60           H        GLU  60  -6.581   5.038  -4.657
  511    HA   GLU  60           HA       GLU  60  -8.280   6.468  -2.724
  512    HB2  GLU  60          2HB       GLU  60  -7.224   7.917  -4.336
  513    HB3  GLU  60          3HB       GLU  60  -7.704   6.882  -5.676
  514    HG2  GLU  60          2HG       GLU  60 -10.070   7.489  -5.305
  515    HG3  GLU  60          3HG       GLU  60  -9.597   8.508  -3.946
  516    H    ARG  61           H        ARG  61 -10.457   6.146  -2.660
  517    HA   ARG  61           HA       ARG  61 -11.695   3.914  -4.012
  518    HB2  ARG  61          2HB       ARG  61 -12.282   4.577  -1.661
  519    HB3  ARG  61          3HB       ARG  61 -12.958   6.083  -2.269
  520    HG2  ARG  61          2HG       ARG  61 -14.744   4.493  -1.815
  521    HG3  ARG  61          3HG       ARG  61 -14.651   4.787  -3.553
  522    HD2  ARG  61          2HD       ARG  61 -13.604   2.657  -3.941
  523    HD3  ARG  61          3HD       ARG  61 -13.333   2.401  -2.212
  524    HE   ARG  61           HE       ARG  61 -16.104   2.643  -3.154
  525   HH11  ARG  61          1HH1      ARG  61 -13.550   0.532  -2.030
  526   HH12  ARG  61          2HH1      ARG  61 -14.620  -0.778  -1.660
  527   HH21  ARG  61          1HH2      ARG  61 -17.504   0.902  -2.685
  528   HH22  ARG  61          2HH2      ARG  61 -16.854  -0.569  -2.032
  529    H    GLN  62           H        GLN  62 -12.129   4.187  -6.119
  530    HA   GLN  62           HA       GLN  62 -13.634   6.585  -7.014
  531    HB2  GLN  62          2HB       GLN  62 -11.738   4.753  -8.551
  532    HB3  GLN  62          3HB       GLN  62 -12.875   5.811  -9.371
  533    HG2  GLN  62          2HG       GLN  62 -10.757   6.788  -7.434
  534    HG3  GLN  62          3HG       GLN  62 -10.546   6.723  -9.181
  535   HE21  GLN  62          1HE2      GLN  62 -10.181   8.950  -9.258
  536   HE22  GLN  62          2HE2      GLN  62 -11.459  10.102  -9.097
  537    H    GLY  63           H        GLY  63 -15.677   6.004  -6.679
  538    HA2  GLY  63          2HA       GLY  63 -17.686   4.936  -6.877
  539    HA3  GLY  63          3HA       GLY  63 -16.985   3.939  -8.147
  540    H    ASN  64           H        ASN  64 -16.578   1.850  -7.685
  541    HA   ASN  64           HA       ASN  64 -16.496   0.924  -4.863
  542    HB2  ASN  64          2HB       ASN  64 -17.385  -0.535  -7.388
  543    HB3  ASN  64          3HB       ASN  64 -17.117  -1.353  -5.850
  544   HD21  ASN  64          1HD2      ASN  64 -19.576  -0.997  -7.476
  545   HD22  ASN  64          2HD2      ASN  64 -20.731  -0.300  -6.394
  546    H    THR  65           H        THR  65 -14.667   1.354  -7.708
  547    HA   THR  65           HA       THR  65 -12.842  -0.898  -7.267
  548    HB   THR  65           HB       THR  65 -11.730  -0.126  -9.357
  549    HG1  THR  65           HG1      THR  65 -12.846   2.199  -8.798
  550   HG21  THR  65          1HG2      THR  65 -13.679  -1.638  -9.568
  551   HG22  THR  65          2HG2      THR  65 -13.580  -0.535 -10.940
  552   HG23  THR  65          3HG2      THR  65 -14.758  -0.240  -9.658
  553    H    TRP  66           H        TRP  66 -11.010  -0.708  -6.111
  554    HA   TRP  66           HA       TRP  66  -9.976   1.836  -5.158
  555    HB2  TRP  66          2HB       TRP  66  -9.030  -1.050  -4.816
  556    HB3  TRP  66          3HB       TRP  66  -8.224   0.333  -4.080
  557    HD1  TRP  66           HD1      TRP  66 -11.065  -2.051  -3.466
  558    HE1  TRP  66           HE1      TRP  66 -12.334  -1.351  -1.343
  559    HE3  TRP  66           HE3      TRP  66  -9.003   2.592  -2.758
  560    HZ2  TRP  66           HZ2      TRP  66 -12.466   0.869   0.387
  561    HZ3  TRP  66           HZ3      TRP  66  -9.768   3.945  -0.846
  562    HH2  TRP  66           HH2      TRP  66 -11.468   3.095   0.697
  563    H    THR  67           H        THR  67  -8.261   2.932  -6.012
  564    HA   THR  67           HA       THR  67  -6.732   1.744  -8.249
  565    HB   THR  67           HB       THR  67  -8.560   3.054  -9.258
  566    HG1  THR  67           HG1      THR  67  -7.067   3.478 -10.665
  567   HG21  THR  67          1HG2      THR  67  -7.474   5.477  -7.770
  568   HG22  THR  67          2HG2      THR  67  -9.001   4.662  -7.421
  569   HG23  THR  67          3HG2      THR  67  -8.771   5.486  -8.966
  570    H    VAL  68           H        VAL  68  -4.633   1.925  -7.871
  571    HA   VAL  68           HA       VAL  68  -3.539   3.432  -5.688
  572    HB   VAL  68           HB       VAL  68  -2.168   1.791  -7.863
  573   HG11  VAL  68          1HG1      VAL  68  -0.179   1.765  -6.371
  574   HG12  VAL  68          2HG1      VAL  68  -0.987   2.897  -5.285
  575   HG13  VAL  68          3HG1      VAL  68  -0.565   3.398  -6.923
  576   HG21  VAL  68          1HG2      VAL  68  -2.883   1.059  -4.999
  577   HG22  VAL  68          2HG2      VAL  68  -2.010   0.034  -6.136
  578   HG23  VAL  68          3HG2      VAL  68  -3.690   0.463  -6.451
  579    H    LYS  69           H        LYS  69  -3.455   5.580  -5.912
  580    HA   LYS  69           HA       LYS  69  -3.189   6.992  -8.381
  581    HB2  LYS  69          2HB       LYS  69  -2.915   8.007  -5.512
  582    HB3  LYS  69          3HB       LYS  69  -3.120   9.021  -6.942
  583    HG2  LYS  69          2HG       LYS  69  -5.133   7.008  -5.887
  584    HG3  LYS  69          3HG       LYS  69  -5.231   8.759  -5.698
  585    HD2  LYS  69          2HD       LYS  69  -5.256   7.309  -8.378
  586    HD3  LYS  69          3HD       LYS  69  -6.698   7.847  -7.517
  587    HE2  LYS  69          2HE       LYS  69  -4.488   9.710  -8.464
  588    HE3  LYS  69          3HE       LYS  69  -5.981   9.398  -9.349
  589    HZ1  LYS  69          1HZ       LYS  69  -5.723  10.668  -6.686
  590    HZ2  LYS  69          2HZ       LYS  69  -7.198  10.219  -7.375
  591    HZ3  LYS  69          3HZ       LYS  69  -6.239  11.395  -8.122
  592    H    ARG  70           H        ARG  70  -1.018   6.529  -5.595
  593    HA   ARG  70           HA       ARG  70   1.334   6.583  -7.265
  594    HB2  ARG  70          2HB       ARG  70   0.858   9.037  -6.946
  595    HB3  ARG  70          3HB       ARG  70   0.975   8.814  -5.202
  596    HG2  ARG  70          2HG       ARG  70   3.050   9.763  -6.105
  597    HG3  ARG  70          3HG       ARG  70   3.340   8.156  -5.433
  598    HD2  ARG  70          2HD       ARG  70   3.160   7.234  -7.790
  599    HD3  ARG  70          3HD       ARG  70   3.092   8.901  -8.371
  600    HE   ARG  70           HE       ARG  70   5.370   8.417  -6.712
  601   HH11  ARG  70          1HH1      ARG  70   4.173   7.953  -9.990
  602   HH12  ARG  70          2HH1      ARG  70   5.762   7.910 -10.686
  603   HH21  ARG  70          1HH2      ARG  70   7.437   8.371  -7.643
  604   HH22  ARG  70          2HH2      ARG  70   7.608   8.147  -9.356
  605    H    ILE  71           H        ILE  71   3.102   5.662  -6.253
  606    HA   ILE  71           HA       ILE  71   2.809   4.728  -3.452
  607    HB   ILE  71           HB       ILE  71   4.555   3.604  -5.697
  608   HG12  ILE  71          2HG1      ILE  71   2.009   2.454  -4.468
  609   HG13  ILE  71          3HG1      ILE  71   2.107   3.212  -6.050
  610   HG21  ILE  71          1HG2      ILE  71   5.006   1.703  -4.156
  611   HG22  ILE  71          2HG2      ILE  71   4.099   2.532  -2.890
  612   HG23  ILE  71          3HG2      ILE  71   5.598   3.235  -3.499
  613   HD11  ILE  71          1HD1      ILE  71   3.612   1.414  -6.784
  614   HD12  ILE  71          2HD1      ILE  71   2.031   0.833  -6.268
  615   HD13  ILE  71          3HD1      ILE  71   3.428   0.639  -5.207
  616    H    THR  72           H        THR  72   3.778   6.247  -2.220
  617    HA   THR  72           HA       THR  72   6.242   7.601  -3.080
  618    HB   THR  72           HB       THR  72   4.405   8.214  -0.719
  619    HG1  THR  72           HG1      THR  72   3.451   8.605  -2.803
  620   HG21  THR  72          1HG2      THR  72   6.687   9.851  -1.906
  621   HG22  THR  72          2HG2      THR  72   6.723   9.031  -0.339
  622   HG23  THR  72          3HG2      THR  72   5.614  10.380  -0.617
  623    H    ARG  73           H        ARG  73   7.986   6.393  -2.574
  624    HA   ARG  73           HA       ARG  73   8.285   4.775  -0.220
  625    HB2  ARG  73          2HB       ARG  73   9.434   4.342  -2.398
  626    HB3  ARG  73          3HB       ARG  73  10.365   5.820  -2.173
  627    HG2  ARG  73          2HG       ARG  73  11.116   4.642   0.092
  628    HG3  ARG  73          3HG       ARG  73  10.605   3.172  -0.746
  629    HD2  ARG  73          2HD       ARG  73  12.994   3.559  -1.056
  630    HD3  ARG  73          3HD       ARG  73  12.143   3.711  -2.599
  631    HE   ARG  73           HE       ARG  73  12.769   6.119  -0.997
  632   HH11  ARG  73          1HH1      ARG  73  13.185   4.325  -3.985
  633   HH12  ARG  73          2HH1      ARG  73  13.954   5.645  -4.808
  634   HH21  ARG  73          1HH2      ARG  73  13.781   7.820  -2.056
  635   HH22  ARG  73          2HH2      ARG  73  14.295   7.641  -3.703
  636    H    THR  74           H        THR  74   9.605   5.214   1.597
  637    HA   THR  74           HA       THR  74  10.059   7.955   2.385
  638    HB   THR  74           HB       THR  74   9.409   6.180   4.047
  639    HG1  THR  74           HG1      THR  74  10.550   7.148   5.586
  640   HG21  THR  74          1HG2      THR  74  10.759   4.286   3.161
  641   HG22  THR  74          2HG2      THR  74  11.080   4.571   4.875
  642   HG23  THR  74          3HG2      THR  74  12.234   5.120   3.658
  643    H    VAL  75           H        VAL  75  12.140   8.883   2.798
  644    HA   VAL  75           HA       VAL  75  14.193   8.298   0.889
  645    HB   VAL  75           HB       VAL  75  14.283  10.178   3.299
  646   HG11  VAL  75          1HG1      VAL  75  16.088  10.106   0.850
  647   HG12  VAL  75          2HG1      VAL  75  16.553   9.658   2.492
  648   HG13  VAL  75          3HG1      VAL  75  16.134  11.332   2.121
  649   HG21  VAL  75          1HG2      VAL  75  13.731  11.987   1.693
  650   HG22  VAL  75          2HG2      VAL  75  12.447  10.778   1.768
  651   HG23  VAL  75          3HG2      VAL  75  13.567  10.789   0.403
  652    H    GLY  76           H        GLY  76  15.332   6.424   1.133
  653    HA2  GLY  76          2HA       GLY  76  17.227   6.018   3.182
  654    HA3  GLY  76          3HA       GLY  76  15.811   5.037   3.541
  655    H    SER  77           H        SER  77  16.905   5.743   0.268
  656    HA   SER  77           HA       SER  77  17.124   2.963  -0.441
  657    HB2  SER  77          2HB       SER  77  17.943   5.451  -2.006
  658    HB3  SER  77          3HB       SER  77  17.708   3.831  -2.673
  659    HG   SER  77           HG       SER  77  15.499   4.255  -1.490
  660    H    LEU  78           H        LEU  78  18.962   1.728  -0.732
  661    HA   LEU  78           HA       LEU  78  21.497   2.683   0.294
  662    HB2  LEU  78          2HB       LEU  78  20.518   0.274   0.495
  663    HB3  LEU  78          3HB       LEU  78  21.092   0.038  -1.143
  664    HG   LEU  78           HG       LEU  78  22.942   0.852   1.147
  665   HD11  LEU  78          1HD1      LEU  78  23.624  -1.479   1.359
  666   HD12  LEU  78          2HD1      LEU  78  22.411  -1.963   0.170
  667   HD13  LEU  78          3HD1      LEU  78  21.907  -1.282   1.719
  668   HD21  LEU  78          1HD2      LEU  78  23.613  -0.390  -1.549
  669   HD22  LEU  78          2HD2      LEU  78  24.769   0.013  -0.273
  670   HD23  LEU  78          3HD2      LEU  78  23.877   1.292  -1.092
  671    H    GLU  79           H        GLU  79  22.385   4.198  -0.992
  672    HA   GLU  79           HA       GLU  79  22.479   4.181  -3.836
  673    HB2  GLU  79          2HB       GLU  79  24.206   5.979  -3.558
  674    HB3  GLU  79          3HB       GLU  79  22.733   6.278  -2.640
  675    HG2  GLU  79          2HG       GLU  79  23.858   5.455  -0.589
  676    HG3  GLU  79          3HG       GLU  79  25.344   5.225  -1.514
  677    H    HIS  80           H        HIS  80  23.732   2.990  -5.132
  678    HA   HIS  80           HA       HIS  80  25.382   0.927  -3.941
  679    HB2  HIS  80          2HB       HIS  80  24.612   1.347  -6.861
  680    HB3  HIS  80          3HB       HIS  80  25.335  -0.108  -6.177
  681    HD1  HIS  80           HD1      HIS  80  22.216   0.871  -7.346
  682    HD2  HIS  80           HD2      HIS  80  23.444  -0.889  -3.782
  683    HE1  HIS  80           HE1      HIS  80  20.177  -0.241  -6.399
  684    HE2  HIS  80           HE2      HIS  80  20.981  -1.421  -4.326
  685    H    HIS  81           H        HIS  81  27.224   1.987  -3.245
  686    HA   HIS  81           HA       HIS  81  28.993   3.425  -4.998
  687    HB2  HIS  81          2HB       HIS  81  29.471   2.153  -2.263
  688    HB3  HIS  81          3HB       HIS  81  30.664   3.130  -3.117
  689    HD1  HIS  81           HD1      HIS  81  28.646   3.560  -0.389
  690    HD2  HIS  81           HD2      HIS  81  29.011   5.747  -3.902
  691    HE1  HIS  81           HE1      HIS  81  27.790   5.856   0.151
  692    HE2  HIS  81           HE2      HIS  81  27.810   7.074  -2.047
  693    H    HIS  82           H        HIS  82  30.273   2.544  -6.496
  694    HA   HIS  82           HA       HIS  82  30.840  -0.371  -6.414
  695    HB2  HIS  82          2HB       HIS  82  30.746  -0.402  -8.868
  696    HB3  HIS  82          3HB       HIS  82  29.237   0.206  -8.207
  697    HD1  HIS  82           HD1      HIS  82  32.003   1.071 -10.480
  698    HD2  HIS  82           HD2      HIS  82  28.834   3.055  -8.667
  699    HE1  HIS  82           HE1      HIS  82  31.764   3.232 -11.719
  700    HE2  HIS  82           HE2      HIS  82  29.984   4.493 -10.474
  701    H    HIS  83           H        HIS  83  32.872  -0.849  -6.176
  702    HA   HIS  83           HA       HIS  83  34.955   1.123  -6.109
  703    HB2  HIS  83          2HB       HIS  83  34.731  -0.689  -4.424
  704    HB3  HIS  83          3HB       HIS  83  35.060  -1.892  -5.664
  705    HD1  HIS  83           HD1      HIS  83  37.287  -2.807  -5.043
  706    HD2  HIS  83           HD2      HIS  83  37.227   1.342  -4.784
  707    HE1  HIS  83           HE1      HIS  83  39.621  -2.132  -4.430
  708    HE2  HIS  83           HE2      HIS  83  39.596   0.379  -4.441
  709    H    HIS  84           H        HIS  84  34.020  -1.441  -8.376
  710    HA   HIS  84           HA       HIS  84  36.498  -1.073  -9.953
  711    HB2  HIS  84          2HB       HIS  84  35.962  -3.090 -11.127
  712    HB3  HIS  84          3HB       HIS  84  35.644  -3.412  -9.431
  713    HD1  HIS  84           HD1      HIS  84  34.053  -3.383 -12.766
  714    HD2  HIS  84           HD2      HIS  84  32.816  -3.652  -8.815
  715    HE1  HIS  84           HE1      HIS  84  31.719  -4.296 -12.839
  716    HE2  HIS  84           HE2      HIS  84  30.927  -4.211 -10.462
  717    H    HIS  85           H        HIS  85  36.013  -1.241 -12.461
  718    HA   HIS  85           HA       HIS  85  34.470   1.077 -13.204
  719    HB2  HIS  85          2HB       HIS  85  36.574   0.700 -14.361
  720    HB3  HIS  85          3HB       HIS  85  36.067  -0.905 -14.881
  721    HD1  HIS  85           HD1      HIS  85  34.869  -1.052 -17.088
  722    HD2  HIS  85           HD2      HIS  85  35.050   2.857 -15.679
  723    HE1  HIS  85           HE1      HIS  85  33.990   0.380 -18.952
  724    HE2  HIS  85           HE2      HIS  85  33.928   2.707 -18.005
  Start of MODEL    3
    1    H1   MET   1          1H        MET   1 -21.015  -7.734   3.813
    2    H2   MET   1          2H        MET   1 -22.645  -7.327   3.971
    3    H3   MET   1          3H        MET   1 -21.506  -6.668   5.028
    4    HA   MET   1           HA       MET   1 -21.662  -6.165   2.117
    5    HB2  MET   1          2HB       MET   1 -22.223  -4.305   4.475
    6    HB3  MET   1          3HB       MET   1 -22.305  -3.852   2.774
    7    HG2  MET   1          2HG       MET   1 -24.114  -5.836   4.181
    8    HG3  MET   1          3HG       MET   1 -24.542  -4.192   3.710
    9    HE1  MET   1          1HE       MET   1 -24.930  -3.416   1.206
   10    HE2  MET   1          2HE       MET   1 -24.631  -4.443  -0.193
   11    HE3  MET   1          3HE       MET   1 -23.278  -3.889   0.793
   12    HA   PRO   2           HA       PRO   2 -17.357  -4.673   2.378
   13    HB2  PRO   2          2HB       PRO   2 -18.355  -2.228   0.922
   14    HB3  PRO   2          3HB       PRO   2 -16.987  -3.289   0.525
   15    HG2  PRO   2          2HG       PRO   2 -19.224  -3.449  -0.893
   16    HG3  PRO   2          3HG       PRO   2 -18.355  -4.935  -0.439
   17    HD2  PRO   2          2HD       PRO   2 -20.855  -3.775   0.776
   18    HD3  PRO   2          3HD       PRO   2 -20.441  -5.472   0.447
   19    H    SER   3           H        SER   3 -17.351  -4.356   4.596
   20    HA   SER   3           HA       SER   3 -18.504  -2.080   5.919
   21    HB2  SER   3          2HB       SER   3 -16.426  -4.079   6.929
   22    HB3  SER   3          3HB       SER   3 -17.373  -2.978   7.933
   23    HG   SER   3           HG       SER   3 -18.620  -4.846   6.210
   24    H    GLU   4           H        GLU   4 -17.230  -0.457   7.108
   25    HA   GLU   4           HA       GLU   4 -15.345   0.861   5.476
   26    HB2  GLU   4          2HB       GLU   4 -16.055   1.376   8.390
   27    HB3  GLU   4          3HB       GLU   4 -15.053   2.438   7.400
   28    HG2  GLU   4          2HG       GLU   4 -17.038   2.652   5.813
   29    HG3  GLU   4          3HG       GLU   4 -17.997   1.816   7.036
   30    H    GLU   5           H        GLU   5 -14.927  -1.541   7.952
   31    HA   GLU   5           HA       GLU   5 -12.043  -1.119   8.124
   32    HB2  GLU   5          2HB       GLU   5 -13.386  -1.852  10.118
   33    HB3  GLU   5          3HB       GLU   5 -13.745  -3.368   9.296
   34    HG2  GLU   5          2HG       GLU   5 -11.955  -3.771  10.859
   35    HG3  GLU   5          3HG       GLU   5 -11.278  -3.854   9.237
   36    H    GLU   6           H        GLU   6 -14.343  -3.229   6.474
   37    HA   GLU   6           HA       GLU   6 -12.574  -5.340   5.759
   38    HB2  GLU   6          2HB       GLU   6 -15.047  -5.582   5.835
   39    HB3  GLU   6          3HB       GLU   6 -15.201  -4.504   4.452
   40    HG2  GLU   6          2HG       GLU   6 -14.010  -6.134   3.038
   41    HG3  GLU   6          3HG       GLU   6 -13.797  -7.198   4.423
   42    H    GLU   7           H        GLU   7 -13.470  -2.307   4.201
   43    HA   GLU   7           HA       GLU   7 -12.367  -2.712   1.657
   44    HB2  GLU   7          2HB       GLU   7 -12.284  -0.245   1.477
   45    HB3  GLU   7          3HB       GLU   7 -13.821  -0.832   2.102
   46    HG2  GLU   7          2HG       GLU   7 -13.051  -0.272   4.412
   47    HG3  GLU   7          3HG       GLU   7 -11.591   0.433   3.717
   48    H    LYS   8           H        LYS   8 -10.819  -1.716   4.729
   49    HA   LYS   8           HA       LYS   8  -8.272  -0.933   3.855
   50    HB2  LYS   8          2HB       LYS   8  -9.230  -2.254   6.407
   51    HB3  LYS   8          3HB       LYS   8  -7.508  -2.013   6.164
   52    HG2  LYS   8          2HG       LYS   8  -8.564  -0.290   7.570
   53    HG3  LYS   8          3HG       LYS   8  -7.778   0.377   6.138
   54    HD2  LYS   8          2HD       LYS   8  -9.861   0.857   5.092
   55    HD3  LYS   8          3HD       LYS   8 -10.755  -0.190   6.199
   56    HE2  LYS   8          2HE       LYS   8  -9.313   2.310   7.135
   57    HE3  LYS   8          3HE       LYS   8 -10.993   2.312   6.594
   58    HZ1  LYS   8          1HZ       LYS   8 -11.583   0.809   8.318
   59    HZ2  LYS   8          2HZ       LYS   8 -10.730   2.083   9.023
   60    HZ3  LYS   8          3HZ       LYS   8  -9.974   0.587   8.789
   61    H    ARG   9           H        ARG   9  -9.581  -4.165   4.423
   62    HA   ARG   9           HA       ARG   9  -7.211  -5.706   4.209
   63    HB2  ARG   9          2HB       ARG   9 -10.053  -6.540   3.465
   64    HB3  ARG   9          3HB       ARG   9  -8.730  -7.623   3.884
   65    HG2  ARG   9          2HG       ARG   9  -9.952  -5.601   5.786
   66    HG3  ARG   9          3HG       ARG   9 -10.417  -7.299   5.703
   67    HD2  ARG   9          2HD       ARG   9  -7.627  -6.292   6.374
   68    HD3  ARG   9          3HD       ARG   9  -8.827  -6.832   7.550
   69    HE   ARG   9           HE       ARG   9  -7.678  -8.597   5.459
   70   HH11  ARG   9          1HH1      ARG   9  -8.824  -8.154   8.764
   71   HH12  ARG   9          2HH1      ARG   9  -8.511  -9.800   9.214
   72   HH21  ARG   9          1HH2      ARG   9  -7.277 -10.732   6.069
   73   HH22  ARG   9          2HH2      ARG   9  -7.632 -11.260   7.684
   74    H    GLN  10           H        GLN  10  -9.654  -4.676   1.864
   75    HA   GLN  10           HA       GLN  10  -8.555  -5.923  -0.444
   76    HB2  GLN  10          2HB       GLN  10 -10.214  -3.363  -0.501
   77    HB3  GLN  10          3HB       GLN  10 -10.124  -4.620  -1.730
   78    HG2  GLN  10          2HG       GLN  10 -11.453  -4.815   0.986
   79    HG3  GLN  10          3HG       GLN  10 -12.256  -4.768  -0.582
   80   HE21  GLN  10          1HE2      GLN  10 -12.362  -6.760   1.593
   81   HE22  GLN  10          2HE2      GLN  10 -11.925  -8.269   0.878
   82    H    VAL  11           H        VAL  11  -8.107  -2.709   0.994
   83    HA   VAL  11           HA       VAL  11  -6.724  -1.492  -1.169
   84    HB   VAL  11           HB       VAL  11  -6.800  -0.708   1.787
   85   HG11  VAL  11          1HG1      VAL  11  -6.185   1.554   1.052
   86   HG12  VAL  11          2HG1      VAL  11  -6.052   0.993  -0.615
   87   HG13  VAL  11          3HG1      VAL  11  -4.932   0.394   0.604
   88   HG21  VAL  11          1HG2      VAL  11  -8.487   0.293  -0.522
   89   HG22  VAL  11          2HG2      VAL  11  -8.577   0.850   1.146
   90   HG23  VAL  11          3HG2      VAL  11  -9.037  -0.796   0.741
   91    H    LYS  12           H        LYS  12  -5.601  -3.038   1.860
   92    HA   LYS  12           HA       LYS  12  -2.843  -2.490   1.575
   93    HB2  LYS  12          2HB       LYS  12  -4.247  -4.739   3.074
   94    HB3  LYS  12          3HB       LYS  12  -2.517  -4.420   3.182
   95    HG2  LYS  12          2HG       LYS  12  -3.026  -2.149   4.089
   96    HG3  LYS  12          3HG       LYS  12  -4.744  -2.554   4.070
   97    HD2  LYS  12          2HD       LYS  12  -2.614  -4.070   5.635
   98    HD3  LYS  12          3HD       LYS  12  -3.693  -2.861   6.327
   99    HE2  LYS  12          2HE       LYS  12  -5.640  -4.272   5.854
  100    HE3  LYS  12          3HE       LYS  12  -4.619  -5.449   5.022
  101    HZ1  LYS  12          1HZ       LYS  12  -4.478  -4.753   7.908
  102    HZ2  LYS  12          2HZ       LYS  12  -3.456  -5.841   7.123
  103    HZ3  LYS  12          3HZ       LYS  12  -5.104  -6.181   7.262
  104    H    GLN  13           H        GLN  13  -4.923  -5.043   0.324
  105    HA   GLN  13           HA       GLN  13  -2.903  -6.733  -0.742
  106    HB2  GLN  13          2HB       GLN  13  -5.216  -7.513  -0.442
  107    HB3  GLN  13          3HB       GLN  13  -5.804  -6.326  -1.599
  108    HG2  GLN  13          2HG       GLN  13  -4.503  -7.480  -3.388
  109    HG3  GLN  13          3HG       GLN  13  -4.003  -8.688  -2.206
  110   HE21  GLN  13          1HE2      GLN  13  -7.251  -7.256  -2.399
  111   HE22  GLN  13          2HE2      GLN  13  -8.044  -8.718  -2.867
  112    H    VAL  14           H        VAL  14  -4.920  -4.181  -2.259
  113    HA   VAL  14           HA       VAL  14  -3.779  -4.232  -4.837
  114    HB   VAL  14           HB       VAL  14  -5.117  -1.894  -3.381
  115   HG11  VAL  14          1HG1      VAL  14  -3.915  -1.087  -5.375
  116   HG12  VAL  14          2HG1      VAL  14  -5.659  -0.983  -5.613
  117   HG13  VAL  14          3HG1      VAL  14  -4.740  -2.284  -6.375
  118   HG21  VAL  14          1HG2      VAL  14  -6.565  -3.888  -3.474
  119   HG22  VAL  14          2HG2      VAL  14  -6.358  -3.972  -5.223
  120   HG23  VAL  14          3HG2      VAL  14  -7.201  -2.600  -4.498
  121    H    ALA  15           H        ALA  15  -2.757  -2.689  -1.875
  122    HA   ALA  15           HA       ALA  15  -0.800  -0.913  -2.993
  123    HB1  ALA  15          1HB       ALA  15  -0.206  -0.489  -0.645
  124    HB2  ALA  15          2HB       ALA  15  -1.203  -1.855  -0.134
  125    HB3  ALA  15          3HB       ALA  15  -1.956  -0.439  -0.872
  126    H    LYS  16           H        LYS  16  -0.674  -4.086  -1.341
  127    HA   LYS  16           HA       LYS  16   2.170  -4.162  -1.155
  128    HB2  LYS  16          2HB       LYS  16   1.928  -6.347  -0.198
  129    HB3  LYS  16          3HB       LYS  16   0.611  -5.360   0.409
  130    HG2  LYS  16          2HG       LYS  16  -0.950  -6.442  -1.134
  131    HG3  LYS  16          3HG       LYS  16   0.359  -7.392  -1.830
  132    HD2  LYS  16          2HD       LYS  16  -0.659  -7.571   1.032
  133    HD3  LYS  16          3HD       LYS  16  -0.963  -8.735  -0.259
  134    HE2  LYS  16          2HE       LYS  16   1.537  -9.117  -0.394
  135    HE3  LYS  16          3HE       LYS  16   1.708  -8.109   1.045
  136    HZ1  LYS  16          1HZ       LYS  16   0.171 -10.646   0.866
  137    HZ2  LYS  16          2HZ       LYS  16   0.272  -9.662   2.235
  138    HZ3  LYS  16          3HZ       LYS  16   1.657 -10.426   1.649
  139    H    GLU  17           H        GLU  17  -0.159  -5.408  -3.496
  140    HA   GLU  17           HA       GLU  17   1.590  -7.104  -4.931
  141    HB2  GLU  17          2HB       GLU  17  -0.910  -5.654  -5.900
  142    HB3  GLU  17          3HB       GLU  17  -0.091  -6.944  -6.772
  143    HG2  GLU  17          2HG       GLU  17  -1.487  -7.187  -4.099
  144    HG3  GLU  17          3HG       GLU  17  -2.056  -7.807  -5.642
  145    H    LYS  18           H        LYS  18   0.832  -3.649  -5.206
  146    HA   LYS  18           HA       LYS  18   2.213  -3.053  -7.574
  147    HB2  LYS  18          2HB       LYS  18   1.488  -1.406  -5.132
  148    HB3  LYS  18          3HB       LYS  18   2.414  -0.691  -6.442
  149    HG2  LYS  18          2HG       LYS  18  -0.334  -1.933  -6.731
  150    HG3  LYS  18          3HG       LYS  18   0.006  -0.205  -6.611
  151    HD2  LYS  18          2HD       LYS  18   1.312  -0.298  -8.706
  152    HD3  LYS  18          3HD       LYS  18   1.019  -2.034  -8.823
  153    HE2  LYS  18          2HE       LYS  18  -1.395  -1.607  -9.072
  154    HE3  LYS  18          3HE       LYS  18  -1.104   0.132  -8.952
  155    HZ1  LYS  18          1HZ       LYS  18   0.034  -1.642 -11.047
  156    HZ2  LYS  18          2HZ       LYS  18   0.204   0.036 -10.962
  157    HZ3  LYS  18          3HZ       LYS  18  -1.317  -0.640 -11.250
  158    H    LEU  19           H        LEU  19   3.310  -3.117  -4.192
  159    HA   LEU  19           HA       LEU  19   6.006  -2.331  -4.761
  160    HB2  LEU  19          2HB       LEU  19   4.821  -3.697  -2.325
  161    HB3  LEU  19          3HB       LEU  19   6.454  -3.051  -2.413
  162    HG   LEU  19           HG       LEU  19   3.852  -1.481  -2.468
  163   HD11  LEU  19          1HD1      LEU  19   4.754  -0.430  -0.447
  164   HD12  LEU  19          2HD1      LEU  19   6.186  -1.460  -0.541
  165   HD13  LEU  19          3HD1      LEU  19   4.597  -2.174  -0.261
  166   HD21  LEU  19          1HD2      LEU  19   5.330  -0.452  -4.110
  167   HD22  LEU  19          2HD2      LEU  19   6.657  -0.417  -2.945
  168   HD23  LEU  19          3HD2      LEU  19   5.217   0.569  -2.677
  169    H    LEU  20           H        LEU  20   4.363  -5.443  -4.588
  170    HA   LEU  20           HA       LEU  20   6.684  -7.098  -4.728
  171    HB2  LEU  20          2HB       LEU  20   3.758  -7.591  -5.365
  172    HB3  LEU  20          3HB       LEU  20   4.970  -8.841  -5.612
  173    HG   LEU  20           HG       LEU  20   4.417  -7.524  -2.925
  174   HD11  LEU  20          1HD1      LEU  20   2.472  -8.822  -3.651
  175   HD12  LEU  20          2HD1      LEU  20   3.277  -9.580  -2.279
  176   HD13  LEU  20          3HD1      LEU  20   3.497 -10.239  -3.905
  177   HD21  LEU  20          1HD2      LEU  20   6.088  -9.961  -3.625
  178   HD22  LEU  20          2HD2      LEU  20   5.755  -9.361  -1.996
  179   HD23  LEU  20          3HD2      LEU  20   6.700  -8.383  -3.115
  180    H    GLU  21           H        GLU  21   4.780  -5.387  -7.143
  181    HA   GLU  21           HA       GLU  21   5.905  -6.649  -9.455
  182    HB2  GLU  21          2HB       GLU  21   4.569  -3.935  -9.094
  183    HB3  GLU  21          3HB       GLU  21   5.083  -4.564 -10.661
  184    HG2  GLU  21          2HG       GLU  21   3.574  -6.515 -10.365
  185    HG3  GLU  21          3HG       GLU  21   3.036  -5.848  -8.824
  186    H    GLN  22           H        GLN  22   6.840  -3.943  -7.410
  187    HA   GLN  22           HA       GLN  22   9.072  -3.123  -9.076
  188    HB2  GLN  22          2HB       GLN  22   8.241  -2.248  -6.272
  189    HB3  GLN  22          3HB       GLN  22   9.501  -1.493  -7.247
  190    HG2  GLN  22          2HG       GLN  22   7.800  -0.897  -8.956
  191    HG3  GLN  22          3HG       GLN  22   6.550  -1.599  -7.934
  192   HE21  GLN  22          1HE2      GLN  22   7.683  -0.560  -5.429
  193   HE22  GLN  22          2HE2      GLN  22   7.355   1.131  -5.438
  194    H    SER  23           H        SER  23   8.557  -5.296  -6.394
  195    HA   SER  23           HA       SER  23  11.237  -6.325  -6.570
  196    HB2  SER  23          2HB       SER  23  11.603  -4.452  -4.977
  197    HB3  SER  23          3HB       SER  23  10.337  -5.088  -3.926
  198    HG   SER  23           HG       SER  23  12.716  -5.633  -3.576
  199    HA   PRO  24           HA       PRO  24   8.075  -9.543  -5.535
  200    HB2  PRO  24          2HB       PRO  24   8.845 -11.433  -7.303
  201    HB3  PRO  24          3HB       PRO  24   8.007  -9.965  -7.846
  202    HG2  PRO  24          2HG       PRO  24  10.949 -10.575  -7.930
  203    HG3  PRO  24          3HG       PRO  24   9.917  -9.854  -9.187
  204    HD2  PRO  24          2HD       PRO  24  11.512  -8.365  -7.478
  205    HD3  PRO  24          3HD       PRO  24  10.046  -7.736  -8.266
  206    H    ASN  25           H        ASN  25  11.464  -9.460  -5.146
  207    HA   ASN  25           HA       ASN  25  11.763 -12.139  -4.021
  208    HB2  ASN  25          2HB       ASN  25  13.748  -9.831  -4.234
  209    HB3  ASN  25          3HB       ASN  25  14.140 -11.462  -3.693
  210   HD21  ASN  25          1HD2      ASN  25  14.198 -13.152  -5.216
  211   HD22  ASN  25          2HD2      ASN  25  14.229 -12.855  -6.916
  212    H    SER  26           H        SER  26  10.536  -9.286  -2.884
  213    HA   SER  26           HA       SER  26  11.471  -9.657  -0.094
  214    HB2  SER  26          2HB       SER  26  10.892  -7.231   0.156
  215    HB3  SER  26          3HB       SER  26  12.150  -7.512  -1.047
  216    HG   SER  26           HG       SER  26  10.715  -7.117  -2.649
  217    H    LYS  27           H        LYS  27   9.924  -9.952   1.495
  218    HA   LYS  27           HA       LYS  27   7.118 -10.208   0.803
  219    HB2  LYS  27          2HB       LYS  27   8.429 -10.256   3.556
  220    HB3  LYS  27          3HB       LYS  27   6.772 -10.734   3.193
  221    HG2  LYS  27          2HG       LYS  27   7.721 -12.563   1.722
  222    HG3  LYS  27          3HG       LYS  27   9.321 -12.145   2.337
  223    HD2  LYS  27          2HD       LYS  27   6.954 -13.147   3.967
  224    HD3  LYS  27          3HD       LYS  27   8.421 -14.049   3.587
  225    HE2  LYS  27          2HE       LYS  27   9.752 -12.454   4.942
  226    HE3  LYS  27          3HE       LYS  27   8.282 -11.545   5.313
  227    HZ1  LYS  27          1HZ       LYS  27   8.772 -14.381   6.042
  228    HZ2  LYS  27          2HZ       LYS  27   7.395 -13.482   6.423
  229    HZ3  LYS  27          3HZ       LYS  27   8.881 -13.063   7.101
  230    H    VAL  28           H        VAL  28   5.644  -8.605   0.913
  231    HA   VAL  28           HA       VAL  28   6.426  -5.985   2.000
  232    HB   VAL  28           HB       VAL  28   4.004  -6.657   0.268
  233   HG11  VAL  28          1HG1      VAL  28   5.279  -3.993   0.993
  234   HG12  VAL  28          2HG1      VAL  28   3.734  -4.604   1.592
  235   HG13  VAL  28          3HG1      VAL  28   3.922  -4.207  -0.117
  236   HG21  VAL  28          1HG2      VAL  28   5.266  -5.720  -1.638
  237   HG22  VAL  28          2HG2      VAL  28   6.078  -7.141  -0.974
  238   HG23  VAL  28          3HG2      VAL  28   6.686  -5.526  -0.605
  239    H    GLN  29           H        GLN  29   5.859  -5.723   4.073
  240    HA   GLN  29           HA       GLN  29   3.331  -6.804   5.150
  241    HB2  GLN  29          2HB       GLN  29   5.620  -5.415   6.623
  242    HB3  GLN  29          3HB       GLN  29   4.268  -6.271   7.351
  243    HG2  GLN  29          2HG       GLN  29   6.597  -7.458   5.827
  244    HG3  GLN  29          3HG       GLN  29   6.210  -7.669   7.533
  245   HE21  GLN  29          1HE2      GLN  29   4.326  -8.947   8.046
  246   HE22  GLN  29          2HE2      GLN  29   3.800 -10.192   6.973
  247    H    VAL  30           H        VAL  30   2.189  -5.227   6.716
  248    HA   VAL  30           HA       VAL  30   2.059  -2.518   5.553
  249    HB   VAL  30           HB       VAL  30  -0.099  -3.732   5.814
  250   HG11  VAL  30          1HG1      VAL  30   0.389  -3.636   8.806
  251   HG12  VAL  30          2HG1      VAL  30   0.362  -5.087   7.802
  252   HG13  VAL  30          3HG1      VAL  30  -1.112  -4.140   8.021
  253   HG21  VAL  30          1HG2      VAL  30   0.131  -1.269   7.578
  254   HG22  VAL  30          2HG2      VAL  30  -1.372  -1.901   6.897
  255   HG23  VAL  30          3HG2      VAL  30  -0.110  -1.286   5.828
  256    H    ARG  31           H        ARG  31   2.865  -0.815   6.620
  257    HA   ARG  31           HA       ARG  31   4.068  -1.093   9.272
  258    HB2  ARG  31          2HB       ARG  31   5.321   0.060   7.450
  259    HB3  ARG  31          3HB       ARG  31   4.049   1.276   7.337
  260    HG2  ARG  31          2HG       ARG  31   5.946   2.161   8.589
  261    HG3  ARG  31          3HG       ARG  31   4.553   2.000   9.662
  262    HD2  ARG  31          2HD       ARG  31   5.537  -0.212  10.436
  263    HD3  ARG  31          3HD       ARG  31   6.988   0.188   9.506
  264    HE   ARG  31           HE       ARG  31   6.200   2.235  11.376
  265   HH11  ARG  31          1HH1      ARG  31   8.047  -0.748  11.049
  266   HH12  ARG  31          2HH1      ARG  31   9.051  -0.412  12.426
  267   HH21  ARG  31          1HH2      ARG  31   7.520   2.655  13.180
  268   HH22  ARG  31          2HH2      ARG  31   8.751   1.518  13.631
  269    H    ARG  32           H        ARG  32   1.617   0.922   7.620
  270    HA   ARG  32           HA       ARG  32  -0.210   0.846   9.817
  271    HB2  ARG  32          2HB       ARG  32   1.585   3.212   9.618
  272    HB3  ARG  32          3HB       ARG  32  -0.114   3.668   9.610
  273    HG2  ARG  32          2HG       ARG  32  -0.444   2.420  11.730
  274    HG3  ARG  32          3HG       ARG  32   1.271   2.006  11.746
  275    HD2  ARG  32          2HD       ARG  32   1.869   4.374  11.958
  276    HD3  ARG  32          3HD       ARG  32   0.165   4.838  11.833
  277    HE   ARG  32           HE       ARG  32   0.235   3.111  13.946
  278   HH11  ARG  32          1HH1      ARG  32   1.920   6.128  13.269
  279   HH12  ARG  32          2HH1      ARG  32   2.068   6.550  14.946
  280   HH21  ARG  32          1HH2      ARG  32   0.433   3.678  16.121
  281   HH22  ARG  32          2HH2      ARG  32   1.223   5.161  16.561
  282    H    VAL  33           H        VAL  33  -2.281   1.815   9.262
  283    HA   VAL  33           HA       VAL  33  -2.664   2.394   6.372
  284    HB   VAL  33           HB       VAL  33  -4.679   1.179   8.330
  285   HG11  VAL  33          1HG1      VAL  33  -6.134   0.852   6.356
  286   HG12  VAL  33          2HG1      VAL  33  -4.956   1.690   5.348
  287   HG13  VAL  33          3HG1      VAL  33  -5.797   2.563   6.631
  288   HG21  VAL  33          1HG2      VAL  33  -3.221  -0.164   6.027
  289   HG22  VAL  33          2HG2      VAL  33  -4.475  -0.905   7.023
  290   HG23  VAL  33          3HG2      VAL  33  -2.929  -0.452   7.745
  291    H    GLN  34           H        GLN  34  -2.913   4.544   6.149
  292    HA   GLN  34           HA       GLN  34  -4.121   6.159   8.306
  293    HB2  GLN  34          2HB       GLN  34  -2.510   7.075   5.876
  294    HB3  GLN  34          3HB       GLN  34  -3.041   8.086   7.214
  295    HG2  GLN  34          2HG       GLN  34  -1.036   5.820   7.384
  296    HG3  GLN  34          3HG       GLN  34  -0.658   7.539   7.401
  297   HE21  GLN  34          1HE2      GLN  34  -2.862   8.264   9.201
  298   HE22  GLN  34          2HE2      GLN  34  -2.405   7.678  10.760
  299    H    LYS  35           H        LYS  35  -6.244   6.363   8.046
  300    HA   LYS  35           HA       LYS  35  -7.596   6.326   5.498
  301    HB2  LYS  35          2HB       LYS  35  -8.309   5.924   8.277
  302    HB3  LYS  35          3HB       LYS  35  -9.346   7.191   7.660
  303    HG2  LYS  35          2HG       LYS  35  -9.020   4.474   6.371
  304    HG3  LYS  35          3HG       LYS  35 -10.297   4.894   7.513
  305    HD2  LYS  35          2HD       LYS  35 -11.070   6.680   5.922
  306    HD3  LYS  35          3HD       LYS  35  -9.851   6.133   4.764
  307    HE2  LYS  35          2HE       LYS  35 -10.919   3.928   4.649
  308    HE3  LYS  35          3HE       LYS  35 -12.104   4.411   5.863
  309    HZ1  LYS  35          1HZ       LYS  35 -11.801   5.699   3.207
  310    HZ2  LYS  35          2HZ       LYS  35 -13.007   6.012   4.351
  311    HZ3  LYS  35          3HZ       LYS  35 -12.942   4.511   3.578
  312    H    GLN  36           H        GLN  36  -8.396   8.047   4.402
  313    HA   GLN  36           HA       GLN  36  -8.451  10.757   5.481
  314    HB2  GLN  36          2HB       GLN  36  -6.083  10.380   4.661
  315    HB3  GLN  36          3HB       GLN  36  -6.722  10.056   3.053
  316    HG2  GLN  36          2HG       GLN  36  -7.590  12.360   2.937
  317    HG3  GLN  36          3HG       GLN  36  -6.959  12.683   4.555
  318   HE21  GLN  36          1HE2      GLN  36  -4.679  12.836   4.833
  319   HE22  GLN  36          2HE2      GLN  36  -3.627  13.113   3.494
  320    H    GLY  37           H        GLY  37 -10.695   9.892   5.147
  321    HA2  GLY  37          2HA       GLY  37 -12.706   9.885   4.040
  322    HA3  GLY  37          3HA       GLY  37 -11.943  10.830   2.767
  323    H    ASN  38           H        ASN  38 -12.571   9.768   0.927
  324    HA   ASN  38           HA       ASN  38 -12.590   6.879   0.681
  325    HB2  ASN  38          2HB       ASN  38 -12.975   9.099  -1.380
  326    HB3  ASN  38          3HB       ASN  38 -13.040   7.390  -1.789
  327   HD21  ASN  38          1HD2      ASN  38 -14.658   9.978  -0.123
  328   HD22  ASN  38          2HD2      ASN  38 -16.160   9.162   0.092
  329    H    THR  39           H        THR  39 -10.058   9.047   0.721
  330    HA   THR  39           HA       THR  39  -8.293   7.324  -0.901
  331    HB   THR  39           HB       THR  39  -7.667   9.942   0.559
  332    HG1  THR  39           HG1      THR  39  -8.897   9.487  -1.814
  333   HG21  THR  39          1HG2      THR  39  -6.013   8.405  -1.488
  334   HG22  THR  39          2HG2      THR  39  -5.637   8.535   0.235
  335   HG23  THR  39          3HG2      THR  39  -5.596   9.969  -0.795
  336    H    ILE  40           H        ILE  40  -6.783   6.005   0.092
  337    HA   ILE  40           HA       ILE  40  -6.307   6.235   3.001
  338    HB   ILE  40           HB       ILE  40  -6.625   3.645   1.407
  339   HG12  ILE  40          2HG1      ILE  40  -8.203   4.748   3.775
  340   HG13  ILE  40          3HG1      ILE  40  -8.780   4.611   2.121
  341   HG21  ILE  40          1HG2      ILE  40  -4.711   3.431   2.935
  342   HG22  ILE  40          2HG2      ILE  40  -6.059   2.443   3.497
  343   HG23  ILE  40          3HG2      ILE  40  -5.708   3.983   4.283
  344   HD11  ILE  40          1HD1      ILE  40  -9.725   2.881   3.509
  345   HD12  ILE  40          2HD1      ILE  40  -8.119   2.311   3.964
  346   HD13  ILE  40          3HD1      ILE  40  -8.668   2.172   2.293
  347    H    ARG  41           H        ARG  41  -4.256   6.911   3.218
  348    HA   ARG  41           HA       ARG  41  -2.097   6.173   1.419
  349    HB2  ARG  41          2HB       ARG  41  -2.246   7.769   3.995
  350    HB3  ARG  41          3HB       ARG  41  -0.694   7.250   3.357
  351    HG2  ARG  41          2HG       ARG  41  -1.251   8.483   1.223
  352    HG3  ARG  41          3HG       ARG  41  -2.662   9.150   2.057
  353    HD2  ARG  41          2HD       ARG  41  -0.637  10.653   2.092
  354    HD3  ARG  41          3HD       ARG  41  -1.259  10.250   3.690
  355    HE   ARG  41           HE       ARG  41   0.566   8.461   3.671
  356   HH11  ARG  41          1HH1      ARG  41   0.999  11.583   2.095
  357   HH12  ARG  41          2HH1      ARG  41   2.722  11.557   2.276
  358   HH21  ARG  41          1HH2      ARG  41   2.805   8.423   3.859
  359   HH22  ARG  41          2HH2      ARG  41   3.747   9.766   3.276
  360    H    VAL  42           H        VAL  42  -1.882   3.933   1.528
  361    HA   VAL  42           HA       VAL  42  -1.588   2.581   4.083
  362    HB   VAL  42           HB       VAL  42  -0.815   1.430   1.363
  363   HG11  VAL  42          1HG1      VAL  42  -1.234  -0.750   2.464
  364   HG12  VAL  42          2HG1      VAL  42  -1.659   0.080   3.963
  365   HG13  VAL  42          3HG1      VAL  42  -0.009   0.172   3.344
  366   HG21  VAL  42          1HG2      VAL  42  -3.070   0.462   1.228
  367   HG22  VAL  42          2HG2      VAL  42  -3.133   2.227   1.222
  368   HG23  VAL  42          3HG2      VAL  42  -3.539   1.333   2.689
  369    H    GLU  43           H        GLU  43   0.190   3.022   5.203
  370    HA   GLU  43           HA       GLU  43   2.819   3.402   3.987
  371    HB2  GLU  43          2HB       GLU  43   2.155   3.001   6.938
  372    HB3  GLU  43          3HB       GLU  43   3.581   3.774   6.250
  373    HG2  GLU  43          2HG       GLU  43   0.753   4.842   6.126
  374    HG3  GLU  43          3HG       GLU  43   2.011   5.416   7.220
  375    H    LEU  44           H        LEU  44   3.928   1.619   3.350
  376    HA   LEU  44           HA       LEU  44   3.384  -0.985   4.676
  377    HB2  LEU  44          2HB       LEU  44   4.529  -0.632   1.879
  378    HB3  LEU  44          3HB       LEU  44   3.970  -2.111   2.638
  379    HG   LEU  44           HG       LEU  44   1.633  -0.725   2.725
  380   HD11  LEU  44          1HD1      LEU  44   2.998   0.386   0.266
  381   HD12  LEU  44          2HD1      LEU  44   2.532   1.293   1.707
  382   HD13  LEU  44          3HD1      LEU  44   1.291   0.575   0.682
  383   HD21  LEU  44          1HD2      LEU  44   2.576  -2.222   0.266
  384   HD22  LEU  44          2HD2      LEU  44   0.900  -1.896   0.712
  385   HD23  LEU  44          3HD2      LEU  44   1.890  -2.943   1.723
  386    H    GLU  45           H        GLU  45   5.291  -2.515   4.477
  387    HA   GLU  45           HA       GLU  45   7.890  -1.182   4.694
  388    HB2  GLU  45          2HB       GLU  45   6.843  -1.287   6.982
  389    HB3  GLU  45          3HB       GLU  45   6.849  -3.047   6.872
  390    HG2  GLU  45          2HG       GLU  45   9.275  -3.102   6.793
  391    HG3  GLU  45          3HG       GLU  45   9.356  -1.342   6.643
  392    H    LEU  46           H        LEU  46   9.001  -2.167   3.234
  393    HA   LEU  46           HA       LEU  46   8.651  -5.025   2.555
  394    HB2  LEU  46          2HB       LEU  46   7.817  -3.632   0.808
  395    HB3  LEU  46          3HB       LEU  46   9.136  -2.498   0.939
  396    HG   LEU  46           HG       LEU  46   9.658  -5.302  -0.100
  397   HD11  LEU  46          1HD1      LEU  46   8.708  -2.968  -1.792
  398   HD12  LEU  46          2HD1      LEU  46   7.794  -4.441  -1.458
  399   HD13  LEU  46          3HD1      LEU  46   9.284  -4.526  -2.395
  400   HD21  LEU  46          1HD2      LEU  46  11.004  -2.631  -0.643
  401   HD22  LEU  46          2HD2      LEU  46  11.467  -4.177  -1.358
  402   HD23  LEU  46          3HD2      LEU  46  11.635  -3.927   0.376
  403    H    ARG  47           H        ARG  47  10.524  -6.302   2.583
  404    HA   ARG  47           HA       ARG  47  13.094  -4.940   3.197
  405    HB2  ARG  47          2HB       ARG  47  12.167  -7.640   4.254
  406    HB3  ARG  47          3HB       ARG  47  13.747  -6.917   4.536
  407    HG2  ARG  47          2HG       ARG  47  12.476  -4.951   5.622
  408    HG3  ARG  47          3HG       ARG  47  11.066  -6.011   5.619
  409    HD2  ARG  47          2HD       ARG  47  12.197  -6.093   7.787
  410    HD3  ARG  47          3HD       ARG  47  12.334  -7.659   6.978
  411    HE   ARG  47           HE       ARG  47  14.595  -6.047   6.373
  412   HH11  ARG  47          1HH1      ARG  47  13.281  -7.955   9.033
  413   HH12  ARG  47          2HH1      ARG  47  14.843  -8.265   9.725
  414   HH21  ARG  47          1HH2      ARG  47  16.619  -6.456   7.312
  415   HH22  ARG  47          2HH2      ARG  47  16.732  -7.417   8.752
  416    H    THR  48           H        THR  48  14.187  -4.953   1.314
  417    HA   THR  48           HA       THR  48  14.445  -7.472  -0.236
  418    HB   THR  48           HB       THR  48  15.175  -4.640  -1.111
  419    HG1  THR  48           HG1      THR  48  12.807  -5.574  -0.821
  420   HG21  THR  48          1HG2      THR  48  15.271  -5.606  -3.384
  421   HG22  THR  48          2HG2      THR  48  14.914  -7.204  -2.727
  422   HG23  THR  48          3HG2      THR  48  16.438  -6.409  -2.325
  423    H    ASN  49           H        ASN  49  16.309  -8.579   0.039
  424    HA   ASN  49           HA       ASN  49  18.461  -9.181   0.385
  425    HB2  ASN  49          2HB       ASN  49  19.021  -6.292  -0.417
  426    HB3  ASN  49          3HB       ASN  49  20.279  -7.505  -0.195
  427   HD21  ASN  49          1HD2      ASN  49  20.910  -7.202  -2.378
  428   HD22  ASN  49          2HD2      ASN  49  20.001  -7.870  -3.683
  429    H    GLY  50           H        GLY  50  16.813  -7.955   2.595
  430    HA2  GLY  50          2HA       GLY  50  17.281  -8.014   4.910
  431    HA3  GLY  50          3HA       GLY  50  18.953  -7.576   4.596
  432    H    LYS  51           H        LYS  51  17.862  -5.442   2.664
  433    HA   LYS  51           HA       LYS  51  17.858  -3.246   4.481
  434    HB2  LYS  51          2HB       LYS  51  17.281  -3.477   1.494
  435    HB3  LYS  51          3HB       LYS  51  17.283  -1.933   2.335
  436    HG2  LYS  51          2HG       LYS  51  19.680  -3.799   2.274
  437    HG3  LYS  51          3HG       LYS  51  19.426  -2.499   1.108
  438    HD2  LYS  51          2HD       LYS  51  19.656  -2.103   4.123
  439    HD3  LYS  51          3HD       LYS  51  20.963  -1.839   2.968
  440    HE2  LYS  51          2HE       LYS  51  19.806  -0.002   1.932
  441    HE3  LYS  51          3HE       LYS  51  18.308  -0.370   2.792
  442    HZ1  LYS  51          1HZ       LYS  51  19.343   0.274   4.844
  443    HZ2  LYS  51          2HZ       LYS  51  19.504   1.530   3.721
  444    HZ3  LYS  51          3HZ       LYS  51  20.824   0.534   4.074
  445    H    LYS  52           H        LYS  52  16.167  -2.356   5.543
  446    HA   LYS  52           HA       LYS  52  13.426  -3.260   4.908
  447    HB2  LYS  52          2HB       LYS  52  14.289  -3.755   7.193
  448    HB3  LYS  52          3HB       LYS  52  14.502  -2.031   7.484
  449    HG2  LYS  52          2HG       LYS  52  12.062  -1.677   7.267
  450    HG3  LYS  52          3HG       LYS  52  11.844  -3.393   6.916
  451    HD2  LYS  52          2HD       LYS  52  11.257  -3.017   9.234
  452    HD3  LYS  52          3HD       LYS  52  12.769  -3.927   9.190
  453    HE2  LYS  52          2HE       LYS  52  14.035  -1.855   9.626
  454    HE3  LYS  52          3HE       LYS  52  12.531  -0.931   9.624
  455    HZ1  LYS  52          1HZ       LYS  52  13.304  -1.460  11.860
  456    HZ2  LYS  52          2HZ       LYS  52  13.168  -3.112  11.534
  457    HZ3  LYS  52          3HZ       LYS  52  11.789  -2.134  11.540
  458    H    GLU  53           H        GLU  53  12.633  -1.868   3.474
  459    HA   GLU  53           HA       GLU  53  12.966   1.056   3.803
  460    HB2  GLU  53          2HB       GLU  53  12.200  -0.550   1.324
  461    HB3  GLU  53          3HB       GLU  53  12.501   1.182   1.377
  462    HG2  GLU  53          2HG       GLU  53  14.575  -0.951   1.978
  463    HG3  GLU  53          3HG       GLU  53  14.400  -0.137   0.427
  464    H    ASN  54           H        ASN  54  11.226   2.129   4.498
  465    HA   ASN  54           HA       ASN  54   8.544   1.053   4.440
  466    HB2  ASN  54          2HB       ASN  54   9.658   3.769   5.269
  467    HB3  ASN  54          3HB       ASN  54   7.937   3.404   5.304
  468   HD21  ASN  54          1HD2      ASN  54   7.950   0.802   6.280
  469   HD22  ASN  54          2HD2      ASN  54   8.567   0.821   7.895
  470    H    TYR  55           H        TYR  55   6.847   1.769   3.164
  471    HA   TYR  55           HA       TYR  55   7.384   3.622   0.922
  472    HB2  TYR  55          2HB       TYR  55   6.024   0.896   0.728
  473    HB3  TYR  55          3HB       TYR  55   5.954   2.112  -0.538
  474    HD1  TYR  55           HD1      TYR  55   7.728   2.298  -2.153
  475    HD2  TYR  55           HD2      TYR  55   8.299  -0.122   1.315
  476    HE1  TYR  55           HE1      TYR  55   9.785   1.367  -3.140
  477    HE2  TYR  55           HE2      TYR  55  10.343  -1.045   0.336
  478    HH   TYR  55           HH       TYR  55  11.360  -1.369  -1.886
  479    H    THR  56           H        THR  56   5.282   4.211  -0.139
  480    HA   THR  56           HA       THR  56   2.940   4.244   1.619
  481    HB   THR  56           HB       THR  56   4.157   6.748   0.358
  482    HG1  THR  56           HG1      THR  56   3.984   5.898   3.064
  483   HG21  THR  56          1HG2      THR  56   1.671   6.451   2.078
  484   HG22  THR  56          2HG2      THR  56   1.687   6.804   0.348
  485   HG23  THR  56          3HG2      THR  56   2.350   7.969   1.491
  486    H    VAL  57           H        VAL  57   1.657   3.088   0.260
  487    HA   VAL  57           HA       VAL  57   1.459   3.943  -2.573
  488    HB   VAL  57           HB       VAL  57   0.341   1.439  -1.239
  489   HG11  VAL  57          1HG1      VAL  57  -0.317   0.753  -3.532
  490   HG12  VAL  57          2HG1      VAL  57   0.196   2.325  -4.143
  491   HG13  VAL  57          3HG1      VAL  57  -1.164   2.216  -3.026
  492   HG21  VAL  57          1HG2      VAL  57   2.585   1.765  -3.272
  493   HG22  VAL  57          2HG2      VAL  57   1.973   0.228  -2.656
  494   HG23  VAL  57          3HG2      VAL  57   2.792   1.350  -1.567
  495    H    GLU  58           H        GLU  58   0.221   5.584  -2.702
  496    HA   GLU  58           HA       GLU  58  -1.978   6.207  -0.930
  497    HB2  GLU  58          2HB       GLU  58  -0.882   7.650  -3.387
  498    HB3  GLU  58          3HB       GLU  58  -2.038   8.321  -2.237
  499    HG2  GLU  58          2HG       GLU  58  -0.402   8.410  -0.484
  500    HG3  GLU  58          3HG       GLU  58   0.714   7.387  -1.384
  501    H    VAL  59           H        VAL  59  -3.679   4.911  -1.302
  502    HA   VAL  59           HA       VAL  59  -4.612   4.302  -4.034
  503    HB   VAL  59           HB       VAL  59  -5.469   3.039  -1.386
  504   HG11  VAL  59          1HG1      VAL  59  -5.887   2.073  -4.232
  505   HG12  VAL  59          2HG1      VAL  59  -7.132   2.751  -3.181
  506   HG13  VAL  59          3HG1      VAL  59  -6.371   1.212  -2.769
  507   HG21  VAL  59          1HG2      VAL  59  -4.004   1.131  -1.946
  508   HG22  VAL  59          2HG2      VAL  59  -3.069   2.620  -1.761
  509   HG23  VAL  59          3HG2      VAL  59  -3.423   1.996  -3.373
  510    H    GLU  60           H        GLU  60  -6.895   4.580  -4.501
  511    HA   GLU  60           HA       GLU  60  -8.456   6.385  -2.801
  512    HB2  GLU  60          2HB       GLU  60  -6.981   7.804  -4.283
  513    HB3  GLU  60          3HB       GLU  60  -7.727   7.050  -5.688
  514    HG2  GLU  60          2HG       GLU  60  -9.965   7.927  -4.810
  515    HG3  GLU  60          3HG       GLU  60  -9.027   8.879  -3.651
  516    H    ARG  61           H        ARG  61 -10.650   6.045  -3.098
  517    HA   ARG  61           HA       ARG  61 -11.359   3.584  -4.434
  518    HB2  ARG  61          2HB       ARG  61 -12.160   4.037  -2.192
  519    HB3  ARG  61          3HB       ARG  61 -12.999   5.492  -2.721
  520    HG2  ARG  61          2HG       ARG  61 -14.731   4.278  -3.746
  521    HG3  ARG  61          3HG       ARG  61 -13.728   2.845  -3.982
  522    HD2  ARG  61          2HD       ARG  61 -15.443   2.470  -2.276
  523    HD3  ARG  61          3HD       ARG  61 -13.808   2.353  -1.615
  524    HE   ARG  61           HE       ARG  61 -14.975   4.964  -1.294
  525   HH11  ARG  61          1HH1      ARG  61 -14.821   1.751   0.122
  526   HH12  ARG  61          2HH1      ARG  61 -15.221   2.301   1.714
  527   HH21  ARG  61          1HH2      ARG  61 -15.469   5.677   0.797
  528   HH22  ARG  61          2HH2      ARG  61 -15.591   4.541   2.103
  529    H    GLN  62           H        GLN  62 -12.446   3.336  -6.240
  530    HA   GLN  62           HA       GLN  62 -13.815   5.604  -7.580
  531    HB2  GLN  62          2HB       GLN  62 -12.502   3.212  -8.976
  532    HB3  GLN  62          3HB       GLN  62 -13.156   4.656  -9.732
  533    HG2  GLN  62          2HG       GLN  62 -10.653   4.454  -8.049
  534    HG3  GLN  62          3HG       GLN  62 -10.753   4.778  -9.778
  535   HE21  GLN  62          1HE2      GLN  62  -9.568   6.319  -7.511
  536   HE22  GLN  62          2HE2      GLN  62 -10.256   7.898  -7.634
  537    H    GLY  63           H        GLY  63 -15.961   5.251  -7.347
  538    HA2  GLY  63          2HA       GLY  63 -18.002   4.226  -7.149
  539    HA3  GLY  63          3HA       GLY  63 -17.315   2.828  -7.975
  540    H    ASN  64           H        ASN  64 -16.996   1.025  -6.788
  541    HA   ASN  64           HA       ASN  64 -16.875   1.183  -3.825
  542    HB2  ASN  64          2HB       ASN  64 -18.747  -0.188  -4.759
  543    HB3  ASN  64          3HB       ASN  64 -17.579  -1.200  -5.604
  544   HD21  ASN  64          1HD2      ASN  64 -18.267  -3.051  -4.501
  545   HD22  ASN  64          2HD2      ASN  64 -17.914  -3.334  -2.836
  546    H    THR  65           H        THR  65 -15.177   0.281  -6.740
  547    HA   THR  65           HA       THR  65 -13.230  -1.467  -5.477
  548    HB   THR  65           HB       THR  65 -12.085  -1.354  -7.748
  549    HG1  THR  65           HG1      THR  65 -13.427   0.787  -8.121
  550   HG21  THR  65          1HG2      THR  65 -15.017  -2.164  -7.772
  551   HG22  THR  65          2HG2      THR  65 -13.668  -3.167  -7.224
  552   HG23  THR  65          3HG2      THR  65 -13.790  -2.694  -8.921
  553    H    TRP  66           H        TRP  66 -10.795  -0.909  -6.025
  554    HA   TRP  66           HA       TRP  66 -10.237   1.884  -5.173
  555    HB2  TRP  66          2HB       TRP  66  -9.027  -0.717  -4.117
  556    HB3  TRP  66          3HB       TRP  66  -8.384   0.880  -3.753
  557    HD1  TRP  66           HD1      TRP  66 -11.418  -1.362  -2.946
  558    HE1  TRP  66           HE1      TRP  66 -12.597  -0.414  -0.866
  559    HE3  TRP  66           HE3      TRP  66  -8.798   3.015  -2.420
  560    HZ2  TRP  66           HZ2      TRP  66 -12.443   1.844   0.772
  561    HZ3  TRP  66           HZ3      TRP  66  -9.392   4.516  -0.562
  562    HH2  TRP  66           HH2      TRP  66 -11.177   3.942   1.007
  563    H    THR  67           H        THR  67  -8.318   2.813  -5.970
  564    HA   THR  67           HA       THR  67  -6.684   1.252  -7.862
  565    HB   THR  67           HB       THR  67  -8.500   2.563  -9.135
  566    HG1  THR  67           HG1      THR  67  -6.974   3.230 -10.714
  567   HG21  THR  67          1HG2      THR  67  -8.121   4.982  -9.496
  568   HG22  THR  67          2HG2      THR  67  -6.835   4.969  -8.290
  569   HG23  THR  67          3HG2      THR  67  -8.500   4.649  -7.801
  570    H    VAL  68           H        VAL  68  -4.548   1.893  -7.966
  571    HA   VAL  68           HA       VAL  68  -3.529   3.554  -5.812
  572    HB   VAL  68           HB       VAL  68  -2.118   1.949  -7.985
  573   HG11  VAL  68          1HG1      VAL  68  -0.862   3.362  -5.597
  574   HG12  VAL  68          2HG1      VAL  68  -0.670   3.825  -7.289
  575   HG13  VAL  68          3HG1      VAL  68  -0.023   2.287  -6.716
  576   HG21  VAL  68          1HG2      VAL  68  -2.521   1.372  -5.029
  577   HG22  VAL  68          2HG2      VAL  68  -1.603   0.376  -6.155
  578   HG23  VAL  68          3HG2      VAL  68  -3.340   0.563  -6.371
  579    H    LYS  69           H        LYS  69  -3.308   5.677  -6.046
  580    HA   LYS  69           HA       LYS  69  -3.175   6.946  -8.679
  581    HB2  LYS  69          2HB       LYS  69  -3.420   8.111  -5.873
  582    HB3  LYS  69          3HB       LYS  69  -3.281   9.096  -7.325
  583    HG2  LYS  69          2HG       LYS  69  -5.539   7.194  -6.644
  584    HG3  LYS  69          3HG       LYS  69  -5.603   8.958  -6.688
  585    HD2  LYS  69          2HD       LYS  69  -5.062   8.844  -9.155
  586    HD3  LYS  69          3HD       LYS  69  -5.205   7.087  -9.053
  587    HE2  LYS  69          2HE       LYS  69  -7.284   7.915  -9.895
  588    HE3  LYS  69          3HE       LYS  69  -7.579   7.432  -8.225
  589    HZ1  LYS  69          1HZ       LYS  69  -7.306   9.794  -7.604
  590    HZ2  LYS  69          2HZ       LYS  69  -8.617   9.523  -8.629
  591    HZ3  LYS  69          3HZ       LYS  69  -7.193  10.196  -9.239
  592    H    ARG  70           H        ARG  70  -1.046   6.269  -5.936
  593    HA   ARG  70           HA       ARG  70   1.276   7.005  -7.506
  594    HB2  ARG  70          2HB       ARG  70   0.452   9.195  -6.487
  595    HB3  ARG  70          3HB       ARG  70   0.801   8.528  -4.895
  596    HG2  ARG  70          2HG       ARG  70   3.194   8.350  -5.474
  597    HG3  ARG  70          3HG       ARG  70   2.854   8.947  -7.102
  598    HD2  ARG  70          2HD       ARG  70   1.970  11.073  -6.021
  599    HD3  ARG  70          3HD       ARG  70   2.601  10.471  -4.486
  600    HE   ARG  70           HE       ARG  70   4.141  11.399  -6.800
  601   HH11  ARG  70          1HH1      ARG  70   4.236  10.066  -3.548
  602   HH12  ARG  70          2HH1      ARG  70   5.905  10.483  -3.311
  603   HH21  ARG  70          1HH2      ARG  70   6.319  11.932  -6.469
  604   HH22  ARG  70          2HH2      ARG  70   7.078  11.535  -4.958
  605    H    ILE  71           H        ILE  71   2.981   5.759  -6.967
  606    HA   ILE  71           HA       ILE  71   3.070   4.358  -4.365
  607    HB   ILE  71           HB       ILE  71   4.771   3.890  -6.866
  608   HG12  ILE  71          2HG1      ILE  71   2.519   2.149  -5.760
  609   HG13  ILE  71          3HG1      ILE  71   2.360   3.213  -7.153
  610   HG21  ILE  71          1HG2      ILE  71   4.622   2.292  -4.279
  611   HG22  ILE  71          2HG2      ILE  71   5.974   3.306  -4.789
  612   HG23  ILE  71          3HG2      ILE  71   5.568   1.852  -5.703
  613   HD11  ILE  71          1HD1      ILE  71   4.178   0.809  -6.954
  614   HD12  ILE  71          2HD1      ILE  71   4.059   1.901  -8.339
  615   HD13  ILE  71          3HD1      ILE  71   2.668   0.932  -7.857
  616    H    THR  72           H        THR  72   4.562   4.977  -2.898
  617    HA   THR  72           HA       THR  72   6.658   6.959  -3.590
  618    HB   THR  72           HB       THR  72   4.918   6.967  -1.074
  619    HG1  THR  72           HG1      THR  72   3.533   7.886  -2.369
  620   HG21  THR  72          1HG2      THR  72   5.887   9.160  -0.594
  621   HG22  THR  72          2HG2      THR  72   6.859   9.084  -2.063
  622   HG23  THR  72          3HG2      THR  72   7.183   7.965  -0.737
  623    H    ARG  73           H        ARG  73   8.566   6.754  -2.352
  624    HA   ARG  73           HA       ARG  73   8.830   4.460  -0.489
  625    HB2  ARG  73          2HB       ARG  73   9.931   3.944  -2.651
  626    HB3  ARG  73          3HB       ARG  73  10.825   5.458  -2.577
  627    HG2  ARG  73          2HG       ARG  73  11.993   4.626  -0.528
  628    HG3  ARG  73          3HG       ARG  73  11.144   3.086  -0.705
  629    HD2  ARG  73          2HD       ARG  73  13.404   2.935  -1.615
  630    HD3  ARG  73          3HD       ARG  73  12.209   2.754  -2.903
  631    HE   ARG  73           HE       ARG  73  12.729   5.365  -3.077
  632   HH11  ARG  73          1HH1      ARG  73  15.005   2.687  -2.803
  633   HH12  ARG  73          2HH1      ARG  73  16.255   3.512  -3.673
  634   HH21  ARG  73          1HH2      ARG  73  14.361   6.417  -4.217
  635   HH22  ARG  73          2HH2      ARG  73  15.885   5.632  -4.477
  636    H    THR  74           H        THR  74  10.095   4.912   1.379
  637    HA   THR  74           HA       THR  74  10.351   7.634   2.174
  638    HB   THR  74           HB       THR  74   9.908   5.841   3.842
  639    HG1  THR  74           HG1      THR  74  10.720   7.315   5.086
  640   HG21  THR  74          1HG2      THR  74  11.695   4.371   4.670
  641   HG22  THR  74          2HG2      THR  74  12.800   4.991   3.441
  642   HG23  THR  74          3HG2      THR  74  11.388   4.047   2.963
  643    H    VAL  75           H        VAL  75  12.028   8.983   1.919
  644    HA   VAL  75           HA       VAL  75  14.639   7.967   0.992
  645    HB   VAL  75           HB       VAL  75  13.814   9.642  -0.497
  646   HG11  VAL  75          1HG1      VAL  75  13.360  11.507   1.853
  647   HG12  VAL  75          2HG1      VAL  75  12.109  10.703   0.903
  648   HG13  VAL  75          3HG1      VAL  75  13.143  11.918   0.149
  649   HG21  VAL  75          1HG2      VAL  75  16.225   9.787  -0.023
  650   HG22  VAL  75          2HG2      VAL  75  15.915  10.942   1.275
  651   HG23  VAL  75          3HG2      VAL  75  15.564  11.384  -0.397
  652    H    GLY  76           H        GLY  76  15.782   7.373   2.734
  653    HA2  GLY  76          2HA       GLY  76  16.166   9.297   4.977
  654    HA3  GLY  76          3HA       GLY  76  15.973   7.567   5.240
  655    H    SER  77           H        SER  77  17.722   8.889   2.530
  656    HA   SER  77           HA       SER  77  20.331   8.161   3.694
  657    HB2  SER  77          2HB       SER  77  19.288   7.179   0.988
  658    HB3  SER  77          3HB       SER  77  20.916   6.905   1.616
  659    HG   SER  77           HG       SER  77  19.183   5.210   1.902
  660    H    LEU  78           H        LEU  78  22.093   9.244   2.746
  661    HA   LEU  78           HA       LEU  78  21.562  11.831   1.634
  662    HB2  LEU  78          2HB       LEU  78  23.438  11.464   3.197
  663    HB3  LEU  78          3HB       LEU  78  24.197  10.367   2.056
  664    HG   LEU  78           HG       LEU  78  24.488  12.274   0.440
  665   HD11  LEU  78          1HD1      LEU  78  22.627  13.677   1.149
  666   HD12  LEU  78          2HD1      LEU  78  24.137  14.583   1.165
  667   HD13  LEU  78          3HD1      LEU  78  23.435  14.014   2.683
  668   HD21  LEU  78          1HD2      LEU  78  25.719  12.782   3.161
  669   HD22  LEU  78          2HD2      LEU  78  26.319  13.394   1.616
  670   HD23  LEU  78          3HD2      LEU  78  26.326  11.662   1.940
  671    H    GLU  79           H        GLU  79  20.792  11.822  -0.385
  672    HA   GLU  79           HA       GLU  79  21.711  10.135  -2.530
  673    HB2  GLU  79          2HB       GLU  79  19.951  12.633  -2.560
  674    HB3  GLU  79          3HB       GLU  79  20.171  11.529  -3.914
  675    HG2  GLU  79          2HG       GLU  79  18.912  10.819  -1.247
  676    HG3  GLU  79          3HG       GLU  79  18.033  11.143  -2.738
  677    H    HIS  80           H        HIS  80  23.224  10.616  -4.071
  678    HA   HIS  80           HA       HIS  80  24.895  12.975  -3.797
  679    HB2  HIS  80          2HB       HIS  80  24.966  10.689  -5.827
  680    HB3  HIS  80          3HB       HIS  80  26.145  11.997  -5.763
  681    HD1  HIS  80           HD1      HIS  80  26.445   8.762  -5.209
  682    HD2  HIS  80           HD2      HIS  80  26.747  11.901  -2.499
  683    HE1  HIS  80           HE1      HIS  80  27.896   7.912  -3.344
  684    HE2  HIS  80           HE2      HIS  80  28.201   9.880  -1.819
  685    H    HIS  81           H        HIS  81  24.821  14.794  -5.087
  686    HA   HIS  81           HA       HIS  81  22.599  15.277  -6.828
  687    HB2  HIS  81          2HB       HIS  81  25.217  16.848  -6.601
  688    HB3  HIS  81          3HB       HIS  81  23.746  17.411  -7.387
  689    HD1  HIS  81           HD1      HIS  81  25.467  17.411  -4.178
  690    HD2  HIS  81           HD2      HIS  81  21.541  17.821  -5.476
  691    HE1  HIS  81           HE1      HIS  81  24.225  18.444  -2.258
  692    HE2  HIS  81           HE2      HIS  81  21.830  18.528  -3.016
  693    H    HIS  82           H        HIS  82  22.409  14.450  -8.842
  694    HA   HIS  82           HA       HIS  82  24.837  13.761 -10.406
  695    HB2  HIS  82          2HB       HIS  82  23.392  12.364 -11.814
  696    HB3  HIS  82          3HB       HIS  82  23.194  11.917 -10.121
  697    HD1  HIS  82           HD1      HIS  82  21.313  12.889 -13.102
  698    HD2  HIS  82           HD2      HIS  82  20.663  12.923  -8.990
  699    HE1  HIS  82           HE1      HIS  82  18.834  13.128 -12.803
  700    HE2  HIS  82           HE2      HIS  82  18.466  13.024 -10.321
  701    H    HIS  83           H        HIS  83  25.078  14.499 -12.515
  702    HA   HIS  83           HA       HIS  83  24.041  17.126 -13.099
  703    HB2  HIS  83          2HB       HIS  83  25.739  15.273 -14.846
  704    HB3  HIS  83          3HB       HIS  83  25.528  17.009 -15.058
  705    HD1  HIS  83           HD1      HIS  83  27.764  14.593 -13.560
  706    HD2  HIS  83           HD2      HIS  83  26.672  18.520 -12.734
  707    HE1  HIS  83           HE1      HIS  83  29.570  15.504 -12.077
  708    HE2  HIS  83           HE2      HIS  83  28.977  17.918 -11.753
  709    H    HIS  84           H        HIS  84  22.099  17.464 -14.138
  710    HA   HIS  84           HA       HIS  84  20.644  15.372 -15.464
  711    HB2  HIS  84          2HB       HIS  84  19.441  17.254 -14.393
  712    HB3  HIS  84          3HB       HIS  84  20.149  18.388 -15.541
  713    HD1  HIS  84           HD1      HIS  84  19.073  18.557 -17.839
  714    HD2  HIS  84           HD2      HIS  84  17.469  15.491 -15.542
  715    HE1  HIS  84           HE1      HIS  84  17.099  17.713 -19.121
  716    HE2  HIS  84           HE2      HIS  84  16.041  16.013 -17.619
  717    H    HIS  85           H        HIS  85  22.841  17.909 -16.463
  718    HA   HIS  85           HA       HIS  85  22.659  17.597 -19.270
  719    HB2  HIS  85          2HB       HIS  85  23.772  19.549 -18.305
  720    HB3  HIS  85          3HB       HIS  85  24.974  18.533 -17.518
  721    HD1  HIS  85           HD1      HIS  85  26.838  17.517 -19.026
  722    HD2  HIS  85           HD2      HIS  85  24.276  20.107 -21.026
  723    HE1  HIS  85           HE1      HIS  85  27.966  18.030 -21.205
  724    HE2  HIS  85           HE2      HIS  85  26.306  19.423 -22.469
  Start of MODEL    4
    1    H1   MET   1          1H        MET   1 -16.666  -8.342   0.971
    2    H2   MET   1          2H        MET   1 -18.066  -8.418   0.021
    3    H3   MET   1          3H        MET   1 -17.304  -9.840   0.521
    4    HA   MET   1           HA       MET   1 -19.285  -9.433   1.791
    5    HB2  MET   1          2HB       MET   1 -17.370 -10.623   2.825
    6    HB3  MET   1          3HB       MET   1 -16.700  -9.094   3.373
    7    HG2  MET   1          2HG       MET   1 -18.631  -8.768   4.854
    8    HG3  MET   1          3HG       MET   1 -19.336 -10.279   4.276
    9    HE1  MET   1          1HE       MET   1 -19.619 -11.349   6.608
   10    HE2  MET   1          2HE       MET   1 -19.078  -9.833   7.333
   11    HE3  MET   1          3HE       MET   1 -18.371 -11.359   7.852
   12    HA   PRO   2           HA       PRO   2 -20.043  -4.963   2.474
   13    HB2  PRO   2          2HB       PRO   2 -22.489  -5.245   3.773
   14    HB3  PRO   2          3HB       PRO   2 -22.297  -5.281   2.008
   15    HG2  PRO   2          2HG       PRO   2 -22.522  -7.588   3.918
   16    HG3  PRO   2          3HG       PRO   2 -23.299  -7.358   2.334
   17    HD2  PRO   2          2HD       PRO   2 -21.133  -8.929   2.592
   18    HD3  PRO   2          3HD       PRO   2 -21.374  -7.921   1.148
   19    H    SER   3           H        SER   3 -18.318  -4.673   3.902
   20    HA   SER   3           HA       SER   3 -18.976  -4.379   6.728
   21    HB2  SER   3          2HB       SER   3 -18.046  -6.703   6.606
   22    HB3  SER   3          3HB       SER   3 -16.599  -6.082   5.814
   23    HG   SER   3           HG       SER   3 -17.023  -6.332   8.392
   24    H    GLU   4           H        GLU   4 -17.378  -3.032   7.820
   25    HA   GLU   4           HA       GLU   4 -16.041  -1.114   6.121
   26    HB2  GLU   4          2HB       GLU   4 -15.589   0.136   8.143
   27    HB3  GLU   4          3HB       GLU   4 -17.244  -0.443   8.201
   28    HG2  GLU   4          2HG       GLU   4 -16.681  -0.922  10.363
   29    HG3  GLU   4          3HG       GLU   4 -16.101  -2.420   9.640
   30    H    GLU   5           H        GLU   5 -15.188  -3.926   8.044
   31    HA   GLU   5           HA       GLU   5 -12.385  -3.756   8.100
   32    HB2  GLU   5          2HB       GLU   5 -14.090  -6.279   7.809
   33    HB3  GLU   5          3HB       GLU   5 -12.388  -6.250   8.257
   34    HG2  GLU   5          2HG       GLU   5 -12.995  -4.995  10.331
   35    HG3  GLU   5          3HG       GLU   5 -14.694  -5.146   9.885
   36    H    GLU   6           H        GLU   6 -14.640  -4.694   5.602
   37    HA   GLU   6           HA       GLU   6 -12.996  -6.037   3.817
   38    HB2  GLU   6          2HB       GLU   6 -15.500  -5.930   3.702
   39    HB3  GLU   6          3HB       GLU   6 -15.381  -4.271   3.124
   40    HG2  GLU   6          2HG       GLU   6 -15.790  -5.809   1.265
   41    HG3  GLU   6          3HG       GLU   6 -14.203  -5.056   1.093
   42    H    GLU   7           H        GLU   7 -13.690  -2.566   4.125
   43    HA   GLU   7           HA       GLU   7 -12.437  -1.534   1.888
   44    HB2  GLU   7          2HB       GLU   7 -12.530  -0.362   4.699
   45    HB3  GLU   7          3HB       GLU   7 -12.104   0.553   3.257
   46    HG2  GLU   7          2HG       GLU   7 -14.781  -0.780   3.758
   47    HG3  GLU   7          3HG       GLU   7 -14.436   0.930   3.985
   48    H    LYS   8           H        LYS   8 -11.024  -2.196   5.067
   49    HA   LYS   8           HA       LYS   8  -8.389  -1.318   4.494
   50    HB2  LYS   8          2HB       LYS   8  -9.439  -3.196   6.663
   51    HB3  LYS   8          3HB       LYS   8  -7.769  -2.646   6.585
   52    HG2  LYS   8          2HG       LYS   8  -8.936  -1.336   8.244
   53    HG3  LYS   8          3HG       LYS   8  -8.559  -0.289   6.877
   54    HD2  LYS   8          2HD       LYS   8 -10.857  -0.346   6.112
   55    HD3  LYS   8          3HD       LYS   8 -11.272  -1.607   7.271
   56    HE2  LYS   8          2HE       LYS   8 -10.390   1.179   8.093
   57    HE3  LYS   8          3HE       LYS   8 -12.075   0.719   7.855
   58    HZ1  LYS   8          1HZ       LYS   8 -10.222  -0.541   9.802
   59    HZ2  LYS   8          2HZ       LYS   8 -11.854  -0.930   9.586
   60    HZ3  LYS   8          3HZ       LYS   8 -11.419   0.593  10.176
   61    H    ARG   9           H        ARG   9  -9.966  -4.515   4.426
   62    HA   ARG   9           HA       ARG   9  -7.742  -6.146   3.866
   63    HB2  ARG   9          2HB       ARG   9 -10.680  -6.551   3.145
   64    HB3  ARG   9          3HB       ARG   9  -9.445  -7.785   2.903
   65    HG2  ARG   9          2HG       ARG   9  -8.980  -7.693   5.374
   66    HG3  ARG   9          3HG       ARG   9 -10.376  -6.626   5.540
   67    HD2  ARG   9          2HD       ARG   9 -10.458  -9.438   4.401
   68    HD3  ARG   9          3HD       ARG   9 -10.892  -9.006   6.054
   69    HE   ARG   9           HE       ARG   9 -12.353  -7.960   3.681
   70   HH11  ARG   9          1HH1      ARG   9 -12.384  -9.429   6.897
   71   HH12  ARG   9          2HH1      ARG   9 -14.116  -9.400   7.024
   72   HH21  ARG   9          1HH2      ARG   9 -14.657  -7.953   3.880
   73   HH22  ARG   9          2HH2      ARG   9 -15.393  -8.568   5.328
   74    H    GLN  10           H        GLN  10  -9.813  -4.262   1.737
   75    HA   GLN  10           HA       GLN  10  -8.789  -5.301  -0.747
   76    HB2  GLN  10          2HB       GLN  10 -10.408  -2.791  -0.125
   77    HB3  GLN  10          3HB       GLN  10 -10.026  -3.341  -1.754
   78    HG2  GLN  10          2HG       GLN  10 -11.348  -5.349  -1.461
   79    HG3  GLN  10          3HG       GLN  10 -11.614  -4.978   0.245
   80   HE21  GLN  10          1HE2      GLN  10 -12.975  -3.187   0.780
   81   HE22  GLN  10          2HE2      GLN  10 -14.140  -2.578  -0.336
   82    H    VAL  11           H        VAL  11  -8.329  -2.220   1.049
   83    HA   VAL  11           HA       VAL  11  -6.724  -0.949  -0.901
   84    HB   VAL  11           HB       VAL  11  -6.839  -0.312   2.092
   85   HG11  VAL  11          1HG1      VAL  11  -4.969   0.810   0.892
   86   HG12  VAL  11          2HG1      VAL  11  -6.171   1.956   1.476
   87   HG13  VAL  11          3HG1      VAL  11  -6.135   1.510  -0.227
   88   HG21  VAL  11          1HG2      VAL  11  -8.611   1.287   1.576
   89   HG22  VAL  11          2HG2      VAL  11  -9.097  -0.326   1.062
   90   HG23  VAL  11          3HG2      VAL  11  -8.551   0.843  -0.130
   91    H    LYS  12           H        LYS  12  -5.826  -2.660   2.116
   92    HA   LYS  12           HA       LYS  12  -3.015  -2.233   1.956
   93    HB2  LYS  12          2HB       LYS  12  -4.543  -4.444   3.394
   94    HB3  LYS  12          3HB       LYS  12  -2.837  -4.077   3.638
   95    HG2  LYS  12          2HG       LYS  12  -3.433  -1.853   4.516
   96    HG3  LYS  12          3HG       LYS  12  -5.144  -2.200   4.260
   97    HD2  LYS  12          2HD       LYS  12  -3.288  -3.715   6.144
   98    HD3  LYS  12          3HD       LYS  12  -4.490  -2.519   6.629
   99    HE2  LYS  12          2HE       LYS  12  -6.276  -4.007   5.679
  100    HE3  LYS  12          3HE       LYS  12  -5.037  -5.218   5.346
  101    HZ1  LYS  12          1HZ       LYS  12  -4.565  -5.345   7.706
  102    HZ2  LYS  12          2HZ       LYS  12  -6.205  -5.642   7.429
  103    HZ3  LYS  12          3HZ       LYS  12  -5.709  -4.147   8.034
  104    H    GLN  13           H        GLN  13  -5.174  -4.692   0.646
  105    HA   GLN  13           HA       GLN  13  -3.159  -6.566  -0.141
  106    HB2  GLN  13          2HB       GLN  13  -5.593  -7.141   0.193
  107    HB3  GLN  13          3HB       GLN  13  -5.975  -6.256  -1.275
  108    HG2  GLN  13          2HG       GLN  13  -4.531  -7.838  -2.555
  109    HG3  GLN  13          3HG       GLN  13  -4.263  -8.747  -1.063
  110   HE21  GLN  13          1HE2      GLN  13  -7.345  -7.295  -2.096
  111   HE22  GLN  13          2HE2      GLN  13  -8.176  -8.793  -2.312
  112    H    VAL  14           H        VAL  14  -4.959  -3.997  -1.869
  113    HA   VAL  14           HA       VAL  14  -3.796  -4.250  -4.421
  114    HB   VAL  14           HB       VAL  14  -4.710  -1.661  -3.027
  115   HG11  VAL  14          1HG1      VAL  14  -4.288  -2.186  -5.990
  116   HG12  VAL  14          2HG1      VAL  14  -3.284  -1.160  -4.964
  117   HG13  VAL  14          3HG1      VAL  14  -4.957  -0.706  -5.297
  118   HG21  VAL  14          1HG2      VAL  14  -6.851  -1.920  -4.231
  119   HG22  VAL  14          2HG2      VAL  14  -6.550  -3.294  -3.168
  120   HG23  VAL  14          3HG2      VAL  14  -6.294  -3.457  -4.901
  121    H    ALA  15           H        ALA  15  -2.873  -2.340  -1.596
  122    HA   ALA  15           HA       ALA  15  -0.726  -0.892  -2.627
  123    HB1  ALA  15          1HB       ALA  15  -1.246  -1.755   0.241
  124    HB2  ALA  15          2HB       ALA  15  -1.947  -0.344  -0.552
  125    HB3  ALA  15          3HB       ALA  15  -0.208  -0.415  -0.277
  126    H    LYS  16           H        LYS  16  -0.738  -4.000  -0.844
  127    HA   LYS  16           HA       LYS  16   2.094  -4.320  -0.814
  128    HB2  LYS  16          2HB       LYS  16   1.720  -6.554   0.047
  129    HB3  LYS  16          3HB       LYS  16   0.595  -5.452   0.824
  130    HG2  LYS  16          2HG       LYS  16  -1.211  -6.254  -0.611
  131    HG3  LYS  16          3HG       LYS  16  -0.104  -7.344  -1.439
  132    HD2  LYS  16          2HD       LYS  16  -0.809  -7.489   1.525
  133    HD3  LYS  16          3HD       LYS  16  -1.525  -8.488   0.263
  134    HE2  LYS  16          2HE       LYS  16   0.705  -9.458  -0.226
  135    HE3  LYS  16          3HE       LYS  16   1.403  -8.482   1.073
  136    HZ1  LYS  16          1HZ       LYS  16  -0.794 -10.452   1.491
  137    HZ2  LYS  16          2HZ       LYS  16   0.100  -9.646   2.683
  138    HZ3  LYS  16          3HZ       LYS  16   0.845 -10.810   1.711
  139    H    GLU  17           H        GLU  17  -0.486  -5.376  -3.011
  140    HA   GLU  17           HA       GLU  17   1.036  -7.152  -4.615
  141    HB2  GLU  17          2HB       GLU  17  -1.517  -5.600  -5.199
  142    HB3  GLU  17          3HB       GLU  17  -0.776  -6.665  -6.394
  143    HG2  GLU  17          2HG       GLU  17  -1.004  -8.557  -4.803
  144    HG3  GLU  17          3HG       GLU  17  -1.820  -7.485  -3.673
  145    H    LYS  18           H        LYS  18   0.587  -3.646  -4.719
  146    HA   LYS  18           HA       LYS  18   1.833  -3.223  -7.257
  147    HB2  LYS  18          2HB       LYS  18   1.561  -1.270  -4.934
  148    HB3  LYS  18          3HB       LYS  18   1.959  -0.845  -6.596
  149    HG2  LYS  18          2HG       LYS  18  -0.654  -1.892  -5.524
  150    HG3  LYS  18          3HG       LYS  18  -0.338  -0.316  -6.230
  151    HD2  LYS  18          2HD       LYS  18  -0.297  -2.968  -7.735
  152    HD3  LYS  18          3HD       LYS  18  -1.610  -1.795  -7.750
  153    HE2  LYS  18          2HE       LYS  18  -0.100  -0.123  -8.776
  154    HE3  LYS  18          3HE       LYS  18   1.194  -1.327  -8.811
  155    HZ1  LYS  18          1HZ       LYS  18  -1.414  -1.510 -10.227
  156    HZ2  LYS  18          2HZ       LYS  18  -0.227  -2.713 -10.227
  157    HZ3  LYS  18          3HZ       LYS  18   0.089  -1.215 -10.944
  158    H    LEU  19           H        LEU  19   2.970  -3.316  -3.928
  159    HA   LEU  19           HA       LEU  19   5.720  -2.756  -4.485
  160    HB2  LEU  19          2HB       LEU  19   4.407  -4.147  -2.118
  161    HB3  LEU  19          3HB       LEU  19   6.081  -3.616  -2.164
  162    HG   LEU  19           HG       LEU  19   3.591  -1.879  -2.121
  163   HD11  LEU  19          1HD1      LEU  19   4.339  -2.692   0.056
  164   HD12  LEU  19          2HD1      LEU  19   4.566  -0.950  -0.077
  165   HD13  LEU  19          3HD1      LEU  19   5.953  -2.034  -0.229
  166   HD21  LEU  19          1HD2      LEU  19   6.437  -0.956  -2.631
  167   HD22  LEU  19          2HD2      LEU  19   5.054   0.095  -2.308
  168   HD23  LEU  19          3HD2      LEU  19   5.084  -0.889  -3.768
  169    H    LEU  20           H        LEU  20   3.750  -5.611  -4.686
  170    HA   LEU  20           HA       LEU  20   5.967  -7.477  -4.964
  171    HB2  LEU  20          2HB       LEU  20   2.955  -7.825  -5.280
  172    HB3  LEU  20          3HB       LEU  20   4.110  -9.134  -5.479
  173    HG   LEU  20           HG       LEU  20   3.680  -7.576  -2.899
  174   HD11  LEU  20          1HD1      LEU  20   2.596  -9.580  -2.018
  175   HD12  LEU  20          2HD1      LEU  20   2.757 -10.381  -3.585
  176   HD13  LEU  20          3HD1      LEU  20   1.731  -8.953  -3.421
  177   HD21  LEU  20          1HD2      LEU  20   5.977  -8.394  -3.077
  178   HD22  LEU  20          2HD2      LEU  20   5.394 -10.029  -3.394
  179   HD23  LEU  20          3HD2      LEU  20   5.092  -9.269  -1.829
  180    H    GLU  21           H        GLU  21   4.056  -5.454  -7.090
  181    HA   GLU  21           HA       GLU  21   4.834  -6.718  -9.552
  182    HB2  GLU  21          2HB       GLU  21   4.211  -3.753  -9.116
  183    HB3  GLU  21          3HB       GLU  21   4.239  -4.595 -10.659
  184    HG2  GLU  21          2HG       GLU  21   2.211  -4.871  -8.436
  185    HG3  GLU  21          3HG       GLU  21   1.956  -4.231 -10.054
  186    H    GLN  22           H        GLN  22   6.139  -4.160  -7.510
  187    HA   GLN  22           HA       GLN  22   8.429  -3.546  -9.153
  188    HB2  GLN  22          2HB       GLN  22   7.766  -2.727  -6.287
  189    HB3  GLN  22          3HB       GLN  22   9.021  -2.012  -7.295
  190    HG2  GLN  22          2HG       GLN  22   7.330  -1.150  -8.846
  191    HG3  GLN  22          3HG       GLN  22   6.051  -1.919  -7.909
  192   HE21  GLN  22          1HE2      GLN  22   5.511  -1.036  -5.852
  193   HE22  GLN  22          2HE2      GLN  22   5.955   0.578  -5.421
  194    H    SER  23           H        SER  23   7.761  -5.615  -6.395
  195    HA   SER  23           HA       SER  23  10.404  -6.820  -6.411
  196    HB2  SER  23          2HB       SER  23   9.399  -5.307  -3.957
  197    HB3  SER  23          3HB       SER  23  10.836  -6.316  -4.001
  198    HG   SER  23           HG       SER  23  10.365  -3.860  -5.310
  199    HA   PRO  24           HA       PRO  24   6.873  -9.721  -5.267
  200    HB2  PRO  24          2HB       PRO  24   7.559 -11.786  -6.946
  201    HB3  PRO  24          3HB       PRO  24   6.632 -10.370  -7.487
  202    HG2  PRO  24          2HG       PRO  24   9.569 -10.909  -7.797
  203    HG3  PRO  24          3HG       PRO  24   8.408 -10.292  -8.995
  204    HD2  PRO  24          2HD       PRO  24  10.089  -8.639  -7.631
  205    HD3  PRO  24          3HD       PRO  24   8.467  -8.128  -8.146
  206    H    ASN  25           H        ASN  25  10.347 -10.189  -5.395
  207    HA   ASN  25           HA       ASN  25  10.339 -12.632  -3.798
  208    HB2  ASN  25          2HB       ASN  25  12.605 -10.947  -4.951
  209    HB3  ASN  25          3HB       ASN  25  12.887 -12.350  -3.934
  210   HD21  ASN  25          1HD2      ASN  25  10.361 -12.139  -6.437
  211   HD22  ASN  25          2HD2      ASN  25  11.069 -13.321  -7.470
  212    H    SER  26           H        SER  26  10.107  -9.357  -3.096
  213    HA   SER  26           HA       SER  26  11.655  -9.400  -0.622
  214    HB2  SER  26          2HB       SER  26   9.974  -7.183  -1.867
  215    HB3  SER  26          3HB       SER  26  11.070  -7.010  -0.495
  216    HG   SER  26           HG       SER  26  12.790  -7.399  -1.810
  217    H    LYS  27           H        LYS  27  10.782  -9.159   1.435
  218    HA   LYS  27           HA       LYS  27   8.089 -10.232   1.806
  219    HB2  LYS  27          2HB       LYS  27  10.028 -11.201   3.046
  220    HB3  LYS  27          3HB       LYS  27  10.305  -9.653   3.824
  221    HG2  LYS  27          2HG       LYS  27   9.235 -11.025   5.427
  222    HG3  LYS  27          3HG       LYS  27   8.018  -9.875   4.893
  223    HD2  LYS  27          2HD       LYS  27   8.149 -12.638   3.652
  224    HD3  LYS  27          3HD       LYS  27   7.394 -12.410   5.226
  225    HE2  LYS  27          2HE       LYS  27   6.541 -11.051   2.646
  226    HE3  LYS  27          3HE       LYS  27   5.725 -12.403   3.423
  227    HZ1  LYS  27          1HZ       LYS  27   6.078  -9.732   4.665
  228    HZ2  LYS  27          2HZ       LYS  27   5.199 -11.030   5.291
  229    HZ3  LYS  27          3HZ       LYS  27   4.670 -10.258   3.886
  230    H    VAL  28           H        VAL  28   6.485  -8.797   1.847
  231    HA   VAL  28           HA       VAL  28   6.908  -6.004   2.668
  232    HB   VAL  28           HB       VAL  28   4.566  -7.298   1.171
  233   HG11  VAL  28          1HG1      VAL  28   3.858  -5.285   2.398
  234   HG12  VAL  28          2HG1      VAL  28   3.836  -5.002   0.656
  235   HG13  VAL  28          3HG1      VAL  28   5.152  -4.352   1.638
  236   HG21  VAL  28          1HG2      VAL  28   6.636  -7.339  -0.174
  237   HG22  VAL  28          2HG2      VAL  28   6.840  -5.603   0.065
  238   HG23  VAL  28          3HG2      VAL  28   5.461  -6.209  -0.857
  239    H    GLN  29           H        GLN  29   6.263  -5.416   4.625
  240    HA   GLN  29           HA       GLN  29   4.349  -6.990   6.239
  241    HB2  GLN  29          2HB       GLN  29   6.190  -4.701   7.104
  242    HB3  GLN  29          3HB       GLN  29   5.285  -5.775   8.163
  243    HG2  GLN  29          2HG       GLN  29   7.639  -6.540   6.416
  244    HG3  GLN  29          3HG       GLN  29   7.667  -6.322   8.164
  245   HE21  GLN  29          1HE2      GLN  29   8.415  -8.658   6.628
  246   HE22  GLN  29          2HE2      GLN  29   7.420  -9.956   7.186
  247    H    VAL  30           H        VAL  30   2.442  -5.964   7.019
  248    HA   VAL  30           HA       VAL  30   1.678  -3.351   5.996
  249    HB   VAL  30           HB       VAL  30   0.323  -5.020   8.185
  250   HG11  VAL  30          1HG1      VAL  30  -0.781  -2.678   6.572
  251   HG12  VAL  30          2HG1      VAL  30  -0.335  -2.642   8.280
  252   HG13  VAL  30          3HG1      VAL  30  -1.685  -3.643   7.746
  253   HG21  VAL  30          1HG2      VAL  30   0.409  -6.269   6.066
  254   HG22  VAL  30          2HG2      VAL  30  -0.322  -4.908   5.211
  255   HG23  VAL  30          3HG2      VAL  30  -1.247  -5.781   6.435
  256    H    ARG  31           H        ARG  31   2.772  -1.617   6.785
  257    HA   ARG  31           HA       ARG  31   3.999  -1.632   9.432
  258    HB2  ARG  31          2HB       ARG  31   5.236  -0.711   7.503
  259    HB3  ARG  31          3HB       ARG  31   3.973   0.483   7.234
  260    HG2  ARG  31          2HG       ARG  31   5.850   1.557   8.314
  261    HG3  ARG  31          3HG       ARG  31   4.503   1.500   9.451
  262    HD2  ARG  31          2HD       ARG  31   5.595  -0.592  10.447
  263    HD3  ARG  31          3HD       ARG  31   7.006  -0.225   9.442
  264    HE   ARG  31           HE       ARG  31   6.003   1.876  11.213
  265   HH11  ARG  31          1HH1      ARG  31   8.466  -0.598  10.689
  266   HH12  ARG  31          2HH1      ARG  31   9.535   0.061  11.881
  267   HH21  ARG  31          1HH2      ARG  31   7.392   2.699  12.769
  268   HH22  ARG  31          2HH2      ARG  31   8.919   1.934  13.058
  269    H    ARG  32           H        ARG  32   1.825   0.637   7.736
  270    HA   ARG  32           HA       ARG  32   0.092   1.009  10.063
  271    HB2  ARG  32          2HB       ARG  32   1.612   3.301   8.728
  272    HB3  ARG  32          3HB       ARG  32   0.191   3.557   9.724
  273    HG2  ARG  32          2HG       ARG  32   2.751   2.292  10.743
  274    HG3  ARG  32          3HG       ARG  32   2.397   4.015  10.837
  275    HD2  ARG  32          2HD       ARG  32   1.867   3.108  12.971
  276    HD3  ARG  32          3HD       ARG  32   0.328   3.420  12.172
  277    HE   ARG  32           HE       ARG  32   1.543   0.727  12.247
  278   HH11  ARG  32          1HH1      ARG  32  -1.234   2.798  12.895
  279   HH12  ARG  32          2HH1      ARG  32  -2.267   1.471  13.318
  280   HH21  ARG  32          1HH2      ARG  32   0.153  -0.993  12.778
  281   HH22  ARG  32          2HH2      ARG  32  -1.483  -0.666  13.253
  282    H    VAL  33           H        VAL  33  -1.846   2.401   9.398
  283    HA   VAL  33           HA       VAL  33  -2.387   2.511   6.487
  284    HB   VAL  33           HB       VAL  33  -4.463   1.551   8.544
  285   HG11  VAL  33          1HG1      VAL  33  -4.712   1.795   5.519
  286   HG12  VAL  33          2HG1      VAL  33  -5.497   2.829   6.715
  287   HG13  VAL  33          3HG1      VAL  33  -5.933   1.125   6.605
  288   HG21  VAL  33          1HG2      VAL  33  -3.069  -0.090   6.395
  289   HG22  VAL  33          2HG2      VAL  33  -4.372  -0.655   7.446
  290   HG23  VAL  33          3HG2      VAL  33  -2.807  -0.221   8.136
  291    H    GLN  34           H        GLN  34  -2.690   4.634   6.065
  292    HA   GLN  34           HA       GLN  34  -3.830   6.441   8.122
  293    HB2  GLN  34          2HB       GLN  34  -1.504   6.968   7.344
  294    HB3  GLN  34          3HB       GLN  34  -2.087   7.109   5.689
  295    HG2  GLN  34          2HG       GLN  34  -1.752   9.313   6.720
  296    HG3  GLN  34          3HG       GLN  34  -3.445   9.054   6.310
  297   HE21  GLN  34          1HE2      GLN  34  -1.160   9.417   8.925
  298   HE22  GLN  34          2HE2      GLN  34  -2.327   9.603  10.185
  299    H    LYS  35           H        LYS  35  -5.963   6.793   7.761
  300    HA   LYS  35           HA       LYS  35  -7.128   6.514   5.073
  301    HB2  LYS  35          2HB       LYS  35  -7.983   5.410   7.299
  302    HB3  LYS  35          3HB       LYS  35  -8.648   6.989   7.672
  303    HG2  LYS  35          2HG       LYS  35  -9.358   5.391   5.193
  304    HG3  LYS  35          3HG       LYS  35 -10.261   5.322   6.704
  305    HD2  LYS  35          2HD       LYS  35 -10.770   7.742   6.498
  306    HD3  LYS  35          3HD       LYS  35  -9.892   7.790   4.964
  307    HE2  LYS  35          2HE       LYS  35 -12.314   7.639   4.593
  308    HE3  LYS  35          3HE       LYS  35 -11.505   6.191   3.994
  309    HZ1  LYS  35          1HZ       LYS  35 -13.540   5.683   5.206
  310    HZ2  LYS  35          2HZ       LYS  35 -12.918   6.416   6.597
  311    HZ3  LYS  35          3HZ       LYS  35 -12.194   5.021   5.977
  312    H    GLN  36           H        GLN  36  -7.043   8.381   3.882
  313    HA   GLN  36           HA       GLN  36  -7.693  10.982   5.162
  314    HB2  GLN  36          2HB       GLN  36  -5.658  10.405   2.966
  315    HB3  GLN  36          3HB       GLN  36  -6.160  12.029   3.427
  316    HG2  GLN  36          2HG       GLN  36  -4.809  10.033   5.276
  317    HG3  GLN  36          3HG       GLN  36  -3.991  11.354   4.439
  318   HE21  GLN  36          1HE2      GLN  36  -4.420  10.755   7.349
  319   HE22  GLN  36          2HE2      GLN  36  -5.057  12.208   8.010
  320    H    GLY  37           H        GLY  37  -9.887  10.583   4.667
  321    HA2  GLY  37          2HA       GLY  37 -11.795  11.078   3.513
  322    HA3  GLY  37          3HA       GLY  37 -10.798  11.804   2.262
  323    H    ASN  38           H        ASN  38 -10.708  10.789   0.347
  324    HA   ASN  38           HA       ASN  38 -11.965   8.151   0.012
  325    HB2  ASN  38          2HB       ASN  38 -11.003  10.099  -2.132
  326    HB3  ASN  38          3HB       ASN  38 -12.005   8.667  -2.382
  327   HD21  ASN  38          1HD2      ASN  38 -14.198   8.710  -1.566
  328   HD22  ASN  38          2HD2      ASN  38 -15.006  10.213  -1.298
  329    H    THR  39           H        THR  39  -8.851   9.711  -0.076
  330    HA   THR  39           HA       THR  39  -7.495   7.422  -1.311
  331    HB   THR  39           HB       THR  39  -6.322  10.077  -0.363
  332    HG1  THR  39           HG1      THR  39  -7.730   9.429  -2.622
  333   HG21  THR  39          1HG2      THR  39  -4.407   9.482  -1.845
  334   HG22  THR  39          2HG2      THR  39  -5.139   7.905  -2.144
  335   HG23  THR  39          3HG2      THR  39  -4.591   8.331  -0.520
  336    H    ILE  40           H        ILE  40  -7.545   5.814   0.244
  337    HA   ILE  40           HA       ILE  40  -6.465   6.254   2.921
  338    HB   ILE  40           HB       ILE  40  -7.233   3.609   1.593
  339   HG12  ILE  40          2HG1      ILE  40  -8.916   5.430   3.378
  340   HG13  ILE  40          3HG1      ILE  40  -9.198   5.104   1.673
  341   HG21  ILE  40          1HG2      ILE  40  -6.802   4.286   4.529
  342   HG22  ILE  40          2HG2      ILE  40  -5.712   3.336   3.515
  343   HG23  ILE  40          3HG2      ILE  40  -7.320   2.720   3.901
  344   HD11  ILE  40          1HD1      ILE  40  -9.435   3.094   3.916
  345   HD12  ILE  40          2HD1      ILE  40  -9.720   2.776   2.202
  346   HD13  ILE  40          3HD1      ILE  40 -10.759   3.902   3.074
  347    H    ARG  41           H        ARG  41  -4.359   6.580   2.971
  348    HA   ARG  41           HA       ARG  41  -2.443   5.379   1.129
  349    HB2  ARG  41          2HB       ARG  41  -2.048   7.319   3.457
  350    HB3  ARG  41          3HB       ARG  41  -0.826   6.884   2.265
  351    HG2  ARG  41          2HG       ARG  41  -2.193   7.930   0.495
  352    HG3  ARG  41          3HG       ARG  41  -3.396   8.389   1.702
  353    HD2  ARG  41          2HD       ARG  41  -1.844   9.877   2.795
  354    HD3  ARG  41          3HD       ARG  41  -0.494   9.271   1.827
  355    HE   ARG  41           HE       ARG  41  -1.567  10.278  -0.130
  356   HH11  ARG  41          1HH1      ARG  41  -2.581  11.530   2.999
  357   HH12  ARG  41          2HH1      ARG  41  -3.096  13.054   2.349
  358   HH21  ARG  41          1HH2      ARG  41  -2.178  12.260  -0.951
  359   HH22  ARG  41          2HH2      ARG  41  -2.864  13.471   0.091
  360    H    VAL  42           H        VAL  42  -2.293   3.190   1.737
  361    HA   VAL  42           HA       VAL  42  -1.773   2.452   4.508
  362    HB   VAL  42           HB       VAL  42  -1.571   0.710   1.999
  363   HG11  VAL  42          1HG1      VAL  42  -1.635  -1.217   3.550
  364   HG12  VAL  42          2HG1      VAL  42  -1.622  -0.118   4.933
  365   HG13  VAL  42          3HG1      VAL  42  -0.222  -0.206   3.861
  366   HG21  VAL  42          1HG2      VAL  42  -3.755  -0.203   2.710
  367   HG22  VAL  42          2HG2      VAL  42  -3.847   1.520   2.333
  368   HG23  VAL  42          3HG2      VAL  42  -3.817   0.983   4.019
  369    H    GLU  43           H        GLU  43   0.138   2.552   5.388
  370    HA   GLU  43           HA       GLU  43   2.614   2.873   3.854
  371    HB2  GLU  43          2HB       GLU  43   2.058   2.936   6.864
  372    HB3  GLU  43          3HB       GLU  43   3.586   3.373   6.098
  373    HG2  GLU  43          2HG       GLU  43   2.538   5.288   4.998
  374    HG3  GLU  43          3HG       GLU  43   0.955   4.799   5.592
  375    H    LEU  44           H        LEU  44   3.866   1.112   3.439
  376    HA   LEU  44           HA       LEU  44   3.636  -1.315   5.127
  377    HB2  LEU  44          2HB       LEU  44   4.097  -1.488   2.116
  378    HB3  LEU  44          3HB       LEU  44   3.718  -2.772   3.244
  379    HG   LEU  44           HG       LEU  44   1.429  -1.370   3.529
  380   HD11  LEU  44          1HD1      LEU  44   0.683  -0.400   1.417
  381   HD12  LEU  44          2HD1      LEU  44   2.271  -0.687   0.699
  382   HD13  LEU  44          3HD1      LEU  44   2.098   0.448   2.039
  383   HD21  LEU  44          1HD2      LEU  44   0.355  -2.836   1.892
  384   HD22  LEU  44          2HD2      LEU  44   1.535  -3.719   2.860
  385   HD23  LEU  44          3HD2      LEU  44   1.932  -3.248   1.206
  386    H    GLU  45           H        GLU  45   5.542  -2.523   5.304
  387    HA   GLU  45           HA       GLU  45   8.012  -1.031   4.643
  388    HB2  GLU  45          2HB       GLU  45   7.440  -1.318   7.045
  389    HB3  GLU  45          3HB       GLU  45   7.479  -3.068   6.848
  390    HG2  GLU  45          2HG       GLU  45   9.859  -3.033   6.389
  391    HG3  GLU  45          3HG       GLU  45   9.867  -1.268   6.319
  392    H    LEU  46           H        LEU  46   8.825  -1.831   2.850
  393    HA   LEU  46           HA       LEU  46   8.583  -4.641   2.077
  394    HB2  LEU  46          2HB       LEU  46   7.963  -2.836   0.500
  395    HB3  LEU  46          3HB       LEU  46   9.579  -2.170   0.576
  396    HG   LEU  46           HG       LEU  46   9.116  -4.984  -0.505
  397   HD11  LEU  46          1HD1      LEU  46   8.937  -4.069  -2.769
  398   HD12  LEU  46          2HD1      LEU  46   8.963  -2.423  -2.131
  399   HD13  LEU  46          3HD1      LEU  46   7.613  -3.496  -1.758
  400   HD21  LEU  46          1HD2      LEU  46  11.460  -4.365  -0.087
  401   HD22  LEU  46          2HD2      LEU  46  11.278  -2.928  -1.094
  402   HD23  LEU  46          3HD2      LEU  46  11.155  -4.536  -1.816
  403    H    ARG  47           H        ARG  47  10.100  -5.886   2.879
  404    HA   ARG  47           HA       ARG  47  12.791  -4.904   3.554
  405    HB2  ARG  47          2HB       ARG  47  11.312  -7.433   4.413
  406    HB3  ARG  47          3HB       ARG  47  12.906  -6.945   4.981
  407    HG2  ARG  47          2HG       ARG  47  11.927  -4.972   6.080
  408    HG3  ARG  47          3HG       ARG  47  10.327  -5.422   5.478
  409    HD2  ARG  47          2HD       ARG  47  10.406  -7.509   6.784
  410    HD3  ARG  47          3HD       ARG  47  12.031  -7.107   7.351
  411    HE   ARG  47           HE       ARG  47  10.220  -5.030   8.005
  412   HH11  ARG  47          1HH1      ARG  47  11.056  -8.314   9.006
  413   HH12  ARG  47          2HH1      ARG  47  10.499  -8.078  10.633
  414   HH21  ARG  47          1HH2      ARG  47   9.542  -4.736  10.127
  415   HH22  ARG  47          2HH2      ARG  47   9.639  -6.042  11.270
  416    H    THR  48           H        THR  48  14.404  -5.470   2.283
  417    HA   THR  48           HA       THR  48  14.378  -7.974   0.691
  418    HB   THR  48           HB       THR  48  15.756  -5.407  -0.236
  419    HG1  THR  48           HG1      THR  48  13.410  -5.146  -0.007
  420   HG21  THR  48          1HG2      THR  48  14.799  -7.843  -1.799
  421   HG22  THR  48          2HG2      THR  48  16.476  -7.517  -1.352
  422   HG23  THR  48          3HG2      THR  48  15.635  -6.444  -2.474
  423    H    ASN  49           H        ASN  49  16.770  -8.635   0.182
  424    HA   ASN  49           HA       ASN  49  18.298  -8.792   2.553
  425    HB2  ASN  49          2HB       ASN  49  19.120  -9.343  -0.326
  426    HB3  ASN  49          3HB       ASN  49  20.112  -9.745   1.072
  427   HD21  ASN  49          1HD2      ASN  49  19.025 -11.520  -0.947
  428   HD22  ASN  49          2HD2      ASN  49  18.039 -12.669  -0.109
  429    H    GLY  50           H        GLY  50  18.968  -6.950   3.476
  430    HA2  GLY  50          2HA       GLY  50  20.722  -5.408   3.844
  431    HA3  GLY  50          3HA       GLY  50  21.021  -5.317   2.116
  432    H    LYS  51           H        LYS  51  17.783  -5.058   2.195
  433    HA   LYS  51           HA       LYS  51  17.787  -2.117   2.610
  434    HB2  LYS  51          2HB       LYS  51  16.071  -3.743   0.665
  435    HB3  LYS  51          3HB       LYS  51  15.873  -2.023   0.985
  436    HG2  LYS  51          2HG       LYS  51  18.320  -1.773   0.188
  437    HG3  LYS  51          3HG       LYS  51  18.150  -3.410  -0.444
  438    HD2  LYS  51          2HD       LYS  51  16.440  -1.008  -1.205
  439    HD3  LYS  51          3HD       LYS  51  17.697  -1.736  -2.203
  440    HE2  LYS  51          2HE       LYS  51  16.394  -3.748  -2.504
  441    HE3  LYS  51          3HE       LYS  51  15.218  -3.238  -1.289
  442    HZ1  LYS  51          1HZ       LYS  51  15.697  -1.852  -3.876
  443    HZ2  LYS  51          2HZ       LYS  51  14.527  -1.439  -2.724
  444    HZ3  LYS  51          3HZ       LYS  51  14.417  -2.909  -3.561
  445    H    LYS  52           H        LYS  52  16.262  -1.251   3.893
  446    HA   LYS  52           HA       LYS  52  13.811  -2.747   4.564
  447    HB2  LYS  52          2HB       LYS  52  15.349  -2.902   6.535
  448    HB3  LYS  52          3HB       LYS  52  15.518  -1.150   6.548
  449    HG2  LYS  52          2HG       LYS  52  13.078  -0.947   7.037
  450    HG3  LYS  52          3HG       LYS  52  12.970  -2.712   7.111
  451    HD2  LYS  52          2HD       LYS  52  14.549  -2.748   9.007
  452    HD3  LYS  52          3HD       LYS  52  14.742  -0.995   8.905
  453    HE2  LYS  52          2HE       LYS  52  12.330  -0.732   9.427
  454    HE3  LYS  52          3HE       LYS  52  12.195  -2.482   9.595
  455    HZ1  LYS  52          1HZ       LYS  52  13.891  -0.708  11.266
  456    HZ2  LYS  52          2HZ       LYS  52  13.767  -2.385  11.429
  457    HZ3  LYS  52          3HZ       LYS  52  12.424  -1.407  11.730
  458    H    GLU  53           H        GLU  53  12.516  -1.573   3.280
  459    HA   GLU  53           HA       GLU  53  12.751   1.394   3.189
  460    HB2  GLU  53          2HB       GLU  53  11.642  -0.496   1.062
  461    HB3  GLU  53          3HB       GLU  53  11.865   1.243   0.904
  462    HG2  GLU  53          2HG       GLU  53  14.267   1.010   0.908
  463    HG3  GLU  53          3HG       GLU  53  14.149  -0.704   1.310
  464    H    ASN  54           H        ASN  54  10.892   2.579   3.525
  465    HA   ASN  54           HA       ASN  54   8.346   1.137   4.032
  466    HB2  ASN  54          2HB       ASN  54   9.442   3.724   5.233
  467    HB3  ASN  54          3HB       ASN  54   7.748   3.278   5.351
  468   HD21  ASN  54          1HD2      ASN  54  10.601   1.117   5.686
  469   HD22  ASN  54          2HD2      ASN  54  10.248   0.671   7.312
  470    H    TYR  55           H        TYR  55   6.961   1.329   2.409
  471    HA   TYR  55           HA       TYR  55   6.921   3.691   0.623
  472    HB2  TYR  55          2HB       TYR  55   5.819   0.863   0.262
  473    HB3  TYR  55          3HB       TYR  55   5.603   2.164  -0.898
  474    HD1  TYR  55           HD1      TYR  55   7.213   2.517  -2.590
  475    HD2  TYR  55           HD2      TYR  55   8.249   0.055   0.737
  476    HE1  TYR  55           HE1      TYR  55   9.241   1.798  -3.753
  477    HE2  TYR  55           HE2      TYR  55  10.287  -0.660  -0.433
  478    HH   TYR  55           HH       TYR  55  11.307  -0.745  -2.507
  479    H    THR  56           H        THR  56   5.324   5.106   1.167
  480    HA   THR  56           HA       THR  56   2.757   4.255   2.261
  481    HB   THR  56           HB       THR  56   3.687   7.027   1.362
  482    HG1  THR  56           HG1      THR  56   4.627   5.654   3.340
  483   HG21  THR  56          1HG2      THR  56   1.212   6.847   1.534
  484   HG22  THR  56          2HG2      THR  56   1.871   7.879   2.803
  485   HG23  THR  56          3HG2      THR  56   1.377   6.231   3.186
  486    H    VAL  57           H        VAL  57   1.623   3.138   0.713
  487    HA   VAL  57           HA       VAL  57   1.491   4.064  -2.067
  488    HB   VAL  57           HB       VAL  57   0.169   1.591  -0.837
  489   HG11  VAL  57          1HG1      VAL  57  -0.031   0.802  -3.179
  490   HG12  VAL  57          2HG1      VAL  57   0.659   2.322  -3.752
  491   HG13  VAL  57          3HG1      VAL  57  -0.903   2.319  -2.932
  492   HG21  VAL  57          1HG2      VAL  57   2.807   1.748  -2.340
  493   HG22  VAL  57          2HG2      VAL  57   2.014   0.270  -1.792
  494   HG23  VAL  57          3HG2      VAL  57   2.620   1.436  -0.612
  495    H    GLU  58           H        GLU  58   0.182   5.668  -2.313
  496    HA   GLU  58           HA       GLU  58  -2.194   6.248  -0.801
  497    HB2  GLU  58          2HB       GLU  58  -1.178   7.522  -3.391
  498    HB3  GLU  58          3HB       GLU  58  -2.303   8.244  -2.241
  499    HG2  GLU  58          2HG       GLU  58  -0.492   8.366  -0.552
  500    HG3  GLU  58          3HG       GLU  58   0.618   7.612  -1.691
  501    H    VAL  59           H        VAL  59  -3.855   4.812  -1.152
  502    HA   VAL  59           HA       VAL  59  -4.639   4.071  -3.927
  503    HB   VAL  59           HB       VAL  59  -5.426   2.656  -1.340
  504   HG11  VAL  59          1HG1      VAL  59  -5.647   1.732  -4.218
  505   HG12  VAL  59          2HG1      VAL  59  -6.978   2.260  -3.187
  506   HG13  VAL  59          3HG1      VAL  59  -6.094   0.784  -2.796
  507   HG21  VAL  59          1HG2      VAL  59  -3.194   1.816  -3.223
  508   HG22  VAL  59          2HG2      VAL  59  -3.768   0.906  -1.819
  509   HG23  VAL  59          3HG2      VAL  59  -2.983   2.472  -1.595
  510    H    GLU  60           H        GLU  60  -6.677   4.732  -4.616
  511    HA   GLU  60           HA       GLU  60  -8.393   6.224  -2.688
  512    HB2  GLU  60          2HB       GLU  60  -7.158   7.728  -4.179
  513    HB3  GLU  60          3HB       GLU  60  -7.737   6.859  -5.595
  514    HG2  GLU  60          2HG       GLU  60 -10.046   7.598  -5.113
  515    HG3  GLU  60          3HG       GLU  60  -9.485   8.451  -3.676
  516    H    ARG  61           H        ARG  61 -10.565   5.889  -2.797
  517    HA   ARG  61           HA       ARG  61 -11.628   3.597  -4.176
  518    HB2  ARG  61          2HB       ARG  61 -12.422   4.284  -1.926
  519    HB3  ARG  61          3HB       ARG  61 -13.038   5.794  -2.587
  520    HG2  ARG  61          2HG       ARG  61 -14.884   4.291  -2.253
  521    HG3  ARG  61          3HG       ARG  61 -14.634   4.483  -3.986
  522    HD2  ARG  61          2HD       ARG  61 -14.674   2.213  -4.112
  523    HD3  ARG  61          3HD       ARG  61 -13.090   2.221  -3.353
  524    HE   ARG  61           HE       ARG  61 -14.054   1.570  -1.345
  525   HH11  ARG  61          1HH1      ARG  61 -16.603   2.155  -3.695
  526   HH12  ARG  61          2HH1      ARG  61 -17.819   1.376  -2.734
  527   HH21  ARG  61          1HH2      ARG  61 -15.662   0.561  -0.112
  528   HH22  ARG  61          2HH2      ARG  61 -17.287   0.481  -0.721
  529    H    GLN  62           H        GLN  62 -12.076   3.664  -6.295
  530    HA   GLN  62           HA       GLN  62 -13.571   5.957  -7.453
  531    HB2  GLN  62          2HB       GLN  62 -11.741   3.924  -8.824
  532    HB3  GLN  62          3HB       GLN  62 -12.743   5.082  -9.689
  533    HG2  GLN  62          2HG       GLN  62 -10.456   5.762  -7.813
  534    HG3  GLN  62          3HG       GLN  62 -10.410   5.836  -9.569
  535   HE21  GLN  62          1HE2      GLN  62 -11.417   7.449  -6.681
  536   HE22  GLN  62          2HE2      GLN  62 -11.961   8.902  -7.437
  537    H    GLY  63           H        GLY  63 -15.687   5.441  -7.419
  538    HA2  GLY  63          2HA       GLY  63 -17.669   4.305  -7.476
  539    HA3  GLY  63          3HA       GLY  63 -16.895   3.174  -8.581
  540    H    ASN  64           H        ASN  64 -16.858   1.111  -7.821
  541    HA   ASN  64           HA       ASN  64 -16.908   0.517  -4.943
  542    HB2  ASN  64          2HB       ASN  64 -18.345  -0.770  -6.582
  543    HB3  ASN  64          3HB       ASN  64 -16.888  -1.407  -7.327
  544   HD21  ASN  64          1HD2      ASN  64 -19.029  -1.621  -4.595
  545   HD22  ASN  64          2HD2      ASN  64 -18.329  -3.043  -3.906
  546    H    THR  65           H        THR  65 -14.702   0.587  -7.662
  547    HA   THR  65           HA       THR  65 -12.810  -1.344  -6.573
  548    HB   THR  65           HB       THR  65 -11.562  -0.942  -8.685
  549    HG1  THR  65           HG1      THR  65 -13.593   1.014  -9.146
  550   HG21  THR  65          1HG2      THR  65 -14.544  -1.373  -9.117
  551   HG22  THR  65          2HG2      THR  65 -13.370  -2.624  -8.700
  552   HG23  THR  65          3HG2      THR  65 -13.272  -1.805 -10.260
  553    H    TRP  66           H        TRP  66 -10.357  -0.654  -6.854
  554    HA   TRP  66           HA       TRP  66  -9.867   1.904  -5.424
  555    HB2  TRP  66          2HB       TRP  66  -8.732  -0.855  -4.742
  556    HB3  TRP  66          3HB       TRP  66  -8.171   0.653  -4.034
  557    HD1  TRP  66           HD1      TRP  66 -11.043  -1.862  -3.797
  558    HE1  TRP  66           HE1      TRP  66 -12.469  -1.297  -1.730
  559    HE3  TRP  66           HE3      TRP  66  -8.984   2.673  -2.576
  560    HZ2  TRP  66           HZ2      TRP  66 -12.698   0.769   0.148
  561    HZ3  TRP  66           HZ3      TRP  66  -9.884   3.886  -0.628
  562    HH2  TRP  66           HH2      TRP  66 -11.715   2.948   0.699
  563    H    THR  67           H        THR  67  -8.670   3.087  -6.809
  564    HA   THR  67           HA       THR  67  -6.660   1.859  -8.581
  565    HB   THR  67           HB       THR  67  -8.267   3.598  -9.477
  566    HG1  THR  67           HG1      THR  67  -6.754   4.129 -10.853
  567   HG21  THR  67          1HG2      THR  67  -6.650   5.564  -7.800
  568   HG22  THR  67          2HG2      THR  67  -8.336   5.125  -7.515
  569   HG23  THR  67          3HG2      THR  67  -7.886   5.979  -8.990
  570    H    VAL  68           H        VAL  68  -4.481   2.794  -8.698
  571    HA   VAL  68           HA       VAL  68  -3.431   3.698  -6.090
  572    HB   VAL  68           HB       VAL  68  -1.884   2.637  -8.506
  573   HG11  VAL  68          1HG1      VAL  68  -0.935   3.168  -5.658
  574   HG12  VAL  68          2HG1      VAL  68  -0.519   4.126  -7.081
  575   HG13  VAL  68          3HG1      VAL  68   0.031   2.454  -6.953
  576   HG21  VAL  68          1HG2      VAL  68  -1.652   0.553  -7.223
  577   HG22  VAL  68          2HG2      VAL  68  -3.349   0.910  -7.538
  578   HG23  VAL  68          3HG2      VAL  68  -2.666   1.208  -5.938
  579    H    LYS  69           H        LYS  69  -3.041   5.757  -5.858
  580    HA   LYS  69           HA       LYS  69  -3.049   7.647  -8.052
  581    HB2  LYS  69          2HB       LYS  69  -2.732   8.065  -5.044
  582    HB3  LYS  69          3HB       LYS  69  -3.002   9.333  -6.237
  583    HG2  LYS  69          2HG       LYS  69  -4.932   7.086  -5.582
  584    HG3  LYS  69          3HG       LYS  69  -5.076   8.755  -5.033
  585    HD2  LYS  69          2HD       LYS  69  -5.146   7.874  -7.950
  586    HD3  LYS  69          3HD       LYS  69  -6.569   8.208  -6.962
  587    HE2  LYS  69          2HE       LYS  69  -4.408  10.232  -7.641
  588    HE3  LYS  69          3HE       LYS  69  -5.982  10.112  -8.429
  589    HZ1  LYS  69          1HZ       LYS  69  -5.904  11.826  -6.693
  590    HZ2  LYS  69          2HZ       LYS  69  -5.607  10.637  -5.531
  591    HZ3  LYS  69          3HZ       LYS  69  -7.064  10.641  -6.387
  592    H    ARG  70           H        ARG  70  -0.782   6.823  -5.386
  593    HA   ARG  70           HA       ARG  70   1.518   6.901  -7.095
  594    HB2  ARG  70          2HB       ARG  70   1.158   9.356  -6.746
  595    HB3  ARG  70          3HB       ARG  70   1.265   9.120  -5.008
  596    HG2  ARG  70          2HG       ARG  70   3.353  10.035  -5.880
  597    HG3  ARG  70          3HG       ARG  70   3.626   8.409  -5.247
  598    HD2  ARG  70          2HD       ARG  70   4.817   8.779  -7.375
  599    HD3  ARG  70          3HD       ARG  70   3.606   7.502  -7.535
  600    HE   ARG  70           HE       ARG  70   2.695  10.149  -8.278
  601   HH11  ARG  70          1HH1      ARG  70   4.268   7.243  -9.547
  602   HH12  ARG  70          2HH1      ARG  70   3.809   7.580 -11.185
  603   HH21  ARG  70          1HH2      ARG  70   2.035  10.500 -10.410
  604   HH22  ARG  70          2HH2      ARG  70   2.544   9.423 -11.670
  605    H    ILE  71           H        ILE  71   3.238   5.829  -6.179
  606    HA   ILE  71           HA       ILE  71   3.010   4.862  -3.390
  607    HB   ILE  71           HB       ILE  71   4.823   3.857  -5.649
  608   HG12  ILE  71          2HG1      ILE  71   2.248   2.610  -4.576
  609   HG13  ILE  71          3HG1      ILE  71   2.392   3.453  -6.112
  610   HG21  ILE  71          1HG2      ILE  71   5.775   3.402  -3.431
  611   HG22  ILE  71          2HG2      ILE  71   5.225   1.899  -4.174
  612   HG23  ILE  71          3HG2      ILE  71   4.260   2.662  -2.910
  613   HD11  ILE  71          1HD1      ILE  71   3.736   0.863  -5.359
  614   HD12  ILE  71          2HD1      ILE  71   3.969   1.729  -6.881
  615   HD13  ILE  71          3HD1      ILE  71   2.380   1.091  -6.463
  616    H    THR  72           H        THR  72   3.978   6.323  -2.092
  617    HA   THR  72           HA       THR  72   6.368   7.821  -2.920
  618    HB   THR  72           HB       THR  72   4.535   8.166  -0.487
  619    HG1  THR  72           HG1      THR  72   3.266   8.925  -2.037
  620   HG21  THR  72          1HG2      THR  72   6.806   9.106  -0.104
  621   HG22  THR  72          2HG2      THR  72   5.582  10.372  -0.210
  622   HG23  THR  72          3HG2      THR  72   6.650  10.066  -1.580
  623    H    ARG  73           H        ARG  73   8.154   6.496  -2.551
  624    HA   ARG  73           HA       ARG  73   8.427   4.947  -0.083
  625    HB2  ARG  73          2HB       ARG  73   9.360   4.120  -2.291
  626    HB3  ARG  73          3HB       ARG  73  10.524   5.439  -2.242
  627    HG2  ARG  73          2HG       ARG  73  11.258   4.474   0.053
  628    HG3  ARG  73          3HG       ARG  73  10.329   3.040  -0.394
  629    HD2  ARG  73          2HD       ARG  73  12.673   2.712  -0.936
  630    HD3  ARG  73          3HD       ARG  73  11.737   2.805  -2.434
  631    HE   ARG  73           HE       ARG  73  12.592   5.377  -1.959
  632   HH11  ARG  73          1HH1      ARG  73  14.242   2.279  -2.376
  633   HH12  ARG  73          2HH1      ARG  73  15.665   3.018  -3.045
  634   HH21  ARG  73          1HH2      ARG  73  14.438   6.306  -2.857
  635   HH22  ARG  73          2HH2      ARG  73  15.777   5.305  -3.319
  636    H    THR  74           H        THR  74   9.846   5.440   1.571
  637    HA   THR  74           HA       THR  74  10.642   8.088   2.139
  638    HB   THR  74           HB       THR  74  10.329   6.448   3.940
  639    HG1  THR  74           HG1      THR  74  11.692   8.071   4.538
  640   HG21  THR  74          1HG2      THR  74  11.953   4.635   4.396
  641   HG22  THR  74          2HG2      THR  74  12.817   5.022   2.906
  642   HG23  THR  74          3HG2      THR  74  11.171   4.393   2.831
  643    H    VAL  75           H        VAL  75  12.555   9.203   1.774
  644    HA   VAL  75           HA       VAL  75  14.280   8.280  -0.359
  645    HB   VAL  75           HB       VAL  75  14.528  10.840   1.300
  646   HG11  VAL  75          1HG1      VAL  75  15.736  10.161  -1.412
  647   HG12  VAL  75          2HG1      VAL  75  16.611  10.299   0.115
  648   HG13  VAL  75          3HG1      VAL  75  15.853  11.725  -0.595
  649   HG21  VAL  75          1HG2      VAL  75  12.322  10.756   0.206
  650   HG22  VAL  75          2HG2      VAL  75  13.087  10.459  -1.357
  651   HG23  VAL  75          3HG2      VAL  75  13.337  11.999  -0.531
  652    H    GLY  76           H        GLY  76  15.636   6.652   0.244
  653    HA2  GLY  76          2HA       GLY  76  16.819   6.348   2.825
  654    HA3  GLY  76          3HA       GLY  76  17.238   5.454   1.372
  655    H    SER  77           H        SER  77  18.197   7.239  -0.320
  656    HA   SER  77           HA       SER  77  20.542   8.492   0.996
  657    HB2  SER  77          2HB       SER  77  20.373   7.237  -1.798
  658    HB3  SER  77          3HB       SER  77  21.814   7.921  -1.039
  659    HG   SER  77           HG       SER  77  21.763   6.279   0.486
  660    H    LEU  78           H        LEU  78  20.232  10.641   0.967
  661    HA   LEU  78           HA       LEU  78  18.552  11.980  -0.964
  662    HB2  LEU  78          2HB       LEU  78  18.627  12.730   1.391
  663    HB3  LEU  78          3HB       LEU  78  20.337  13.101   1.237
  664    HG   LEU  78           HG       LEU  78  19.800  14.909  -0.402
  665   HD11  LEU  78          1HD1      LEU  78  16.902  14.216   0.136
  666   HD12  LEU  78          2HD1      LEU  78  17.772  14.025  -1.388
  667   HD13  LEU  78          3HD1      LEU  78  17.474  15.636  -0.744
  668   HD21  LEU  78          1HD2      LEU  78  18.291  15.177   2.223
  669   HD22  LEU  78          2HD2      LEU  78  18.811  16.509   1.186
  670   HD23  LEU  78          3HD2      LEU  78  20.011  15.487   1.973
  671    H    GLU  79           H        GLU  79  19.360  12.000  -2.967
  672    HA   GLU  79           HA       GLU  79  22.124  12.489  -3.641
  673    HB2  GLU  79          2HB       GLU  79  19.610  12.405  -5.365
  674    HB3  GLU  79          3HB       GLU  79  21.254  12.480  -5.995
  675    HG2  GLU  79          2HG       GLU  79  21.755  10.285  -5.020
  676    HG3  GLU  79          3HG       GLU  79  20.146  10.208  -4.309
  677    H    HIS  80           H        HIS  80  22.594  14.476  -2.682
  678    HA   HIS  80           HA       HIS  80  21.516  16.888  -3.990
  679    HB2  HIS  80          2HB       HIS  80  20.261  16.544  -1.831
  680    HB3  HIS  80          3HB       HIS  80  21.789  16.587  -0.957
  681    HD1  HIS  80           HD1      HIS  80  19.350  18.790  -2.764
  682    HD2  HIS  80           HD2      HIS  80  22.843  19.163  -0.554
  683    HE1  HIS  80           HE1      HIS  80  19.602  21.244  -2.301
  684    HE2  HIS  80           HE2      HIS  80  21.867  21.442  -1.236
  685    H    HIS  81           H        HIS  81  22.997  18.550  -4.173
  686    HA   HIS  81           HA       HIS  81  25.779  17.792  -4.188
  687    HB2  HIS  81          2HB       HIS  81  24.378  20.394  -4.981
  688    HB3  HIS  81          3HB       HIS  81  26.099  20.096  -5.209
  689    HD1  HIS  81           HD1      HIS  81  26.499  19.676  -7.605
  690    HD2  HIS  81           HD2      HIS  81  22.962  17.903  -6.337
  691    HE1  HIS  81           HE1      HIS  81  25.587  18.476  -9.610
  692    HE2  HIS  81           HE2      HIS  81  23.416  17.472  -8.835
  693    H    HIS  82           H        HIS  82  27.441  18.654  -2.969
  694    HA   HIS  82           HA       HIS  82  26.727  19.758  -0.354
  695    HB2  HIS  82          2HB       HIS  82  29.423  18.841  -1.456
  696    HB3  HIS  82          3HB       HIS  82  29.128  19.337   0.206
  697    HD1  HIS  82           HD1      HIS  82  28.123  17.625   1.787
  698    HD2  HIS  82           HD2      HIS  82  28.296  16.308  -2.148
  699    HE1  HIS  82           HE1      HIS  82  27.624  15.165   1.872
  700    HE2  HIS  82           HE2      HIS  82  27.764  14.389  -0.518
  701    H    HIS  83           H        HIS  83  27.453  21.730   0.453
  702    HA   HIS  83           HA       HIS  83  28.052  23.850  -1.414
  703    HB2  HIS  83          2HB       HIS  83  27.995  25.344   0.554
  704    HB3  HIS  83          3HB       HIS  83  26.605  24.269   0.573
  705    HD1  HIS  83           HD1      HIS  83  26.208  23.017   2.701
  706    HD2  HIS  83           HD2      HIS  83  30.082  24.511   2.507
  707    HE1  HIS  83           HE1      HIS  83  27.222  22.572   4.951
  708    HE2  HIS  83           HE2      HIS  83  29.499  23.627   4.853
  709    H    HIS  84           H        HIS  84  29.900  25.266  -1.279
  710    HA   HIS  84           HA       HIS  84  32.440  23.948  -0.674
  711    HB2  HIS  84          2HB       HIS  84  31.865  26.754  -1.769
  712    HB3  HIS  84          3HB       HIS  84  33.467  26.031  -1.620
  713    HD1  HIS  84           HD1      HIS  84  30.826  26.480  -4.000
  714    HD2  HIS  84           HD2      HIS  84  33.646  23.516  -3.242
  715    HE1  HIS  84           HE1      HIS  84  30.903  25.076  -6.076
  716    HE2  HIS  84           HE2      HIS  84  32.426  23.164  -5.489
  717    H    HIS  85           H        HIS  85  31.118  27.183   0.148
  718    HA   HIS  85           HA       HIS  85  31.956  26.851   2.965
  719    HB2  HIS  85          2HB       HIS  85  32.405  29.337   1.234
  720    HB3  HIS  85          3HB       HIS  85  32.612  29.297   2.981
  721    HD1  HIS  85           HD1      HIS  85  34.760  28.277   3.895
  722    HD2  HIS  85           HD2      HIS  85  34.407  27.917  -0.232
  723    HE1  HIS  85           HE1      HIS  85  37.010  27.521   3.081
  724    HE2  HIS  85           HE2      HIS  85  36.753  27.234   0.596
  Start of MODEL    5
    1    H1   MET   1          1H        MET   1 -23.299  -5.316   6.380
    2    H2   MET   1          2H        MET   1 -24.427  -4.287   7.098
    3    H3   MET   1          3H        MET   1 -24.307  -5.893   7.606
    4    HA   MET   1           HA       MET   1 -23.286  -4.420   9.194
    5    HB2  MET   1          2HB       MET   1 -21.257  -6.104   7.651
    6    HB3  MET   1          3HB       MET   1 -21.063  -5.556   9.312
    7    HG2  MET   1          2HG       MET   1 -21.706  -7.860   9.379
    8    HG3  MET   1          3HG       MET   1 -23.101  -6.923   9.909
    9    HE1  MET   1          1HE       MET   1 -21.574  -9.200   7.091
   10    HE2  MET   1          2HE       MET   1 -21.693  -7.661   6.237
   11    HE3  MET   1          3HE       MET   1 -22.744  -9.006   5.790
   12    HA   PRO   2           HA       PRO   2 -20.964  -0.782   7.656
   13    HB2  PRO   2          2HB       PRO   2 -19.246  -1.135  10.109
   14    HB3  PRO   2          3HB       PRO   2 -20.143   0.297   9.555
   15    HG2  PRO   2          2HG       PRO   2 -21.032  -1.107  11.626
   16    HG3  PRO   2          3HG       PRO   2 -22.170  -0.455  10.422
   17    HD2  PRO   2          2HD       PRO   2 -21.143  -3.283  10.700
   18    HD3  PRO   2          3HD       PRO   2 -22.794  -2.714  10.356
   19    H    SER   3           H        SER   3 -19.673  -1.204   5.935
   20    HA   SER   3           HA       SER   3 -17.525  -3.204   6.038
   21    HB2  SER   3          2HB       SER   3 -17.429  -2.759   3.551
   22    HB3  SER   3          3HB       SER   3 -19.006  -3.306   4.120
   23    HG   SER   3           HG       SER   3 -19.313  -1.570   2.767
   24    H    GLU   4           H        GLU   4 -17.158  -0.814   7.560
   25    HA   GLU   4           HA       GLU   4 -15.637   1.160   6.171
   26    HB2  GLU   4          2HB       GLU   4 -15.639   0.826   9.203
   27    HB3  GLU   4          3HB       GLU   4 -15.496   2.305   8.267
   28    HG2  GLU   4          2HG       GLU   4 -17.983   0.680   8.825
   29    HG3  GLU   4          3HG       GLU   4 -17.648   2.344   9.292
   30    H    GLU   5           H        GLU   5 -14.879  -1.439   8.481
   31    HA   GLU   5           HA       GLU   5 -12.049  -1.185   8.434
   32    HB2  GLU   5          2HB       GLU   5 -13.274  -2.293  10.277
   33    HB3  GLU   5          3HB       GLU   5 -13.787  -3.573   9.183
   34    HG2  GLU   5          2HG       GLU   5 -11.419  -4.258   8.888
   35    HG3  GLU   5          3HG       GLU   5 -10.916  -2.979   9.992
   36    H    GLU   6           H        GLU   6 -14.397  -2.926   6.485
   37    HA   GLU   6           HA       GLU   6 -12.825  -4.908   5.303
   38    HB2  GLU   6          2HB       GLU   6 -15.214  -3.446   4.110
   39    HB3  GLU   6          3HB       GLU   6 -14.545  -4.958   3.503
   40    HG2  GLU   6          2HG       GLU   6 -15.901  -4.502   6.171
   41    HG3  GLU   6          3HG       GLU   6 -16.523  -5.421   4.800
   42    H    GLU   7           H        GLU   7 -13.344  -1.536   4.402
   43    HA   GLU   7           HA       GLU   7 -12.132  -1.298   1.923
   44    HB2  GLU   7          2HB       GLU   7 -11.912   0.685   4.231
   45    HB3  GLU   7          3HB       GLU   7 -11.662   1.051   2.521
   46    HG2  GLU   7          2HG       GLU   7 -14.004   0.545   2.045
   47    HG3  GLU   7          3HG       GLU   7 -14.268   0.119   3.742
   48    H    LYS   8           H        LYS   8 -10.636  -1.096   5.141
   49    HA   LYS   8           HA       LYS   8  -7.987  -0.500   4.316
   50    HB2  LYS   8          2HB       LYS   8  -8.969  -1.721   6.950
   51    HB3  LYS   8          3HB       LYS   8  -7.309  -1.214   6.659
   52    HG2  LYS   8          2HG       LYS   8  -8.383   0.505   7.943
   53    HG3  LYS   8          3HG       LYS   8  -8.123   1.127   6.312
   54    HD2  LYS   8          2HD       LYS   8 -10.484   0.749   5.755
   55    HD3  LYS   8          3HD       LYS   8 -10.764  -0.001   7.325
   56    HE2  LYS   8          2HE       LYS   8  -9.976   2.894   6.899
   57    HE3  LYS   8          3HE       LYS   8 -11.617   2.323   7.197
   58    HZ1  LYS   8          1HZ       LYS   8 -10.716   3.092   9.225
   59    HZ2  LYS   8          2HZ       LYS   8  -9.310   2.181   9.034
   60    HZ3  LYS   8          3HZ       LYS   8 -10.779   1.403   9.323
   61    H    ARG   9           H        ARG   9  -9.678  -3.493   5.121
   62    HA   ARG   9           HA       ARG   9  -7.553  -5.334   5.055
   63    HB2  ARG   9          2HB       ARG   9 -10.486  -5.824   4.354
   64    HB3  ARG   9          3HB       ARG   9  -9.312  -7.061   4.805
   65    HG2  ARG   9          2HG       ARG   9  -9.118  -6.103   7.056
   66    HG3  ARG   9          3HG       ARG   9 -10.222  -4.798   6.617
   67    HD2  ARG   9          2HD       ARG   9 -11.468  -6.401   7.893
   68    HD3  ARG   9          3HD       ARG   9 -11.998  -6.545   6.215
   69    HE   ARG   9           HE       ARG   9  -9.909  -8.393   6.753
   70   HH11  ARG   9          1HH1      ARG   9 -13.343  -7.937   7.390
   71   HH12  ARG   9          2HH1      ARG   9 -13.641  -9.637   7.575
   72   HH21  ARG   9          1HH2      ARG   9 -10.321 -10.589   7.083
   73   HH22  ARG   9          2HH2      ARG   9 -11.936 -11.133   7.404
   74    H    GLN  10           H        GLN  10  -9.737  -4.185   2.508
   75    HA   GLN  10           HA       GLN  10  -8.776  -5.749   0.341
   76    HB2  GLN  10          2HB       GLN  10 -10.221  -3.059   0.366
   77    HB3  GLN  10          3HB       GLN  10  -9.946  -4.013  -1.090
   78    HG2  GLN  10          2HG       GLN  10 -11.424  -5.729  -0.389
   79    HG3  GLN  10          3HG       GLN  10 -11.439  -5.151   1.278
   80   HE21  GLN  10          1HE2      GLN  10 -13.685  -4.985   1.355
   81   HE22  GLN  10          2HE2      GLN  10 -14.560  -3.774   0.489
   82    H    VAL  11           H        VAL  11  -8.028  -2.465   1.458
   83    HA   VAL  11           HA       VAL  11  -6.472  -1.697  -0.788
   84    HB   VAL  11           HB       VAL  11  -6.725  -0.436   1.983
   85   HG11  VAL  11          1HG1      VAL  11  -5.770   1.626   0.977
   86   HG12  VAL  11          2HG1      VAL  11  -5.448   0.736  -0.512
   87   HG13  VAL  11          3HG1      VAL  11  -4.607   0.299   0.971
   88   HG21  VAL  11          1HG2      VAL  11  -8.812  -0.475   0.656
   89   HG22  VAL  11          2HG2      VAL  11  -7.983   0.327  -0.676
   90   HG23  VAL  11          3HG2      VAL  11  -8.213   1.172   0.856
   91    H    LYS  12           H        LYS  12  -5.592  -3.040   2.394
   92    HA   LYS  12           HA       LYS  12  -2.796  -2.689   2.273
   93    HB2  LYS  12          2HB       LYS  12  -4.427  -4.881   3.619
   94    HB3  LYS  12          3HB       LYS  12  -2.695  -4.658   3.865
   95    HG2  LYS  12          2HG       LYS  12  -3.113  -2.413   4.793
   96    HG3  LYS  12          3HG       LYS  12  -4.848  -2.635   4.563
   97    HD2  LYS  12          2HD       LYS  12  -3.064  -4.319   6.369
   98    HD3  LYS  12          3HD       LYS  12  -4.171  -3.056   6.911
   99    HE2  LYS  12          2HE       LYS  12  -6.086  -4.373   6.077
  100    HE3  LYS  12          3HE       LYS  12  -4.983  -5.626   5.502
  101    HZ1  LYS  12          1HZ       LYS  12  -5.322  -4.799   8.327
  102    HZ2  LYS  12          2HZ       LYS  12  -4.293  -6.015   7.771
  103    HZ3  LYS  12          3HZ       LYS  12  -5.965  -6.191   7.627
  104    H    GLN  13           H        GLN  13  -4.931  -5.165   0.951
  105    HA   GLN  13           HA       GLN  13  -2.887  -6.871  -0.094
  106    HB2  GLN  13          2HB       GLN  13  -5.147  -7.734   0.341
  107    HB3  GLN  13          3HB       GLN  13  -5.832  -6.624  -0.840
  108    HG2  GLN  13          2HG       GLN  13  -4.597  -7.788  -2.642
  109    HG3  GLN  13          3HG       GLN  13  -3.905  -8.884  -1.448
  110   HE21  GLN  13          1HE2      GLN  13  -7.271  -7.777  -1.449
  111   HE22  GLN  13          2HE2      GLN  13  -7.949  -9.322  -1.802
  112    H    VAL  14           H        VAL  14  -5.000  -4.352  -1.567
  113    HA   VAL  14           HA       VAL  14  -4.115  -4.476  -4.215
  114    HB   VAL  14           HB       VAL  14  -5.052  -1.977  -2.697
  115   HG11  VAL  14          1HG1      VAL  14  -5.716  -1.071  -4.914
  116   HG12  VAL  14          2HG1      VAL  14  -5.000  -2.476  -5.704
  117   HG13  VAL  14          3HG1      VAL  14  -3.973  -1.345  -4.824
  118   HG21  VAL  14          1HG2      VAL  14  -6.705  -3.947  -4.335
  119   HG22  VAL  14          2HG2      VAL  14  -7.314  -2.472  -3.577
  120   HG23  VAL  14          3HG2      VAL  14  -6.721  -3.798  -2.579
  121    H    ALA  15           H        ALA  15  -2.803  -2.774  -1.449
  122    HA   ALA  15           HA       ALA  15  -0.883  -1.155  -2.781
  123    HB1  ALA  15          1HB       ALA  15  -0.094  -0.635  -0.508
  124    HB2  ALA  15          2HB       ALA  15  -1.073  -1.952   0.146
  125    HB3  ALA  15          3HB       ALA  15  -1.854  -0.555  -0.597
  126    H    LYS  16           H        LYS  16  -0.663  -4.227  -0.934
  127    HA   LYS  16           HA       LYS  16   2.168  -4.413  -1.033
  128    HB2  LYS  16          2HB       LYS  16   1.958  -6.630  -0.099
  129    HB3  LYS  16          3HB       LYS  16   0.769  -5.592   0.672
  130    HG2  LYS  16          2HG       LYS  16  -1.018  -6.578  -0.634
  131    HG3  LYS  16          3HG       LYS  16   0.125  -7.540  -1.564
  132    HD2  LYS  16          2HD       LYS  16  -0.332  -7.811   1.436
  133    HD3  LYS  16          3HD       LYS  16  -1.078  -8.836   0.209
  134    HE2  LYS  16          2HE       LYS  16   1.207  -9.573  -0.514
  135    HE3  LYS  16          3HE       LYS  16   1.900  -8.611   0.795
  136    HZ1  LYS  16          1HZ       LYS  16   0.682  -9.962   2.379
  137    HZ2  LYS  16          2HZ       LYS  16   1.695 -10.918   1.427
  138    HZ3  LYS  16          3HZ       LYS  16   0.029 -10.897   1.130
  139    H    GLU  17           H        GLU  17  -0.413  -5.550  -3.156
  140    HA   GLU  17           HA       GLU  17   1.016  -7.374  -4.760
  141    HB2  GLU  17          2HB       GLU  17  -1.392  -5.632  -5.459
  142    HB3  GLU  17          3HB       GLU  17  -0.747  -6.881  -6.527
  143    HG2  GLU  17          2HG       GLU  17  -1.198  -8.580  -4.783
  144    HG3  GLU  17          3HG       GLU  17  -1.899  -7.333  -3.762
  145    H    LYS  18           H        LYS  18   0.588  -3.847  -4.976
  146    HA   LYS  18           HA       LYS  18   1.833  -3.521  -7.523
  147    HB2  LYS  18          2HB       LYS  18   1.609  -1.408  -5.339
  148    HB3  LYS  18          3HB       LYS  18   1.831  -1.129  -7.066
  149    HG2  LYS  18          2HG       LYS  18  -0.609  -2.261  -5.708
  150    HG3  LYS  18          3HG       LYS  18  -0.449  -0.665  -6.425
  151    HD2  LYS  18          2HD       LYS  18  -0.303  -1.646  -8.666
  152    HD3  LYS  18          3HD       LYS  18  -0.301  -3.273  -7.982
  153    HE2  LYS  18          2HE       LYS  18  -2.592  -2.891  -7.107
  154    HE3  LYS  18          3HE       LYS  18  -2.597  -1.286  -7.848
  155    HZ1  LYS  18          1HZ       LYS  18  -2.246  -3.832  -9.331
  156    HZ2  LYS  18          2HZ       LYS  18  -2.395  -2.286 -10.004
  157    HZ3  LYS  18          3HZ       LYS  18  -3.705  -2.990  -9.201
  158    H    LEU  19           H        LEU  19   3.017  -3.422  -4.187
  159    HA   LEU  19           HA       LEU  19   5.722  -2.735  -4.789
  160    HB2  LEU  19          2HB       LEU  19   4.527  -4.157  -2.380
  161    HB3  LEU  19          3HB       LEU  19   6.196  -3.603  -2.472
  162    HG   LEU  19           HG       LEU  19   3.708  -1.845  -2.498
  163   HD11  LEU  19          1HD1      LEU  19   4.267  -2.705  -0.279
  164   HD12  LEU  19          2HD1      LEU  19   4.566  -0.970  -0.375
  165   HD13  LEU  19          3HD1      LEU  19   5.920  -2.104  -0.441
  166   HD21  LEU  19          1HD2      LEU  19   5.377  -0.888  -4.013
  167   HD22  LEU  19          2HD2      LEU  19   6.620  -1.012  -2.763
  168   HD23  LEU  19          3HD2      LEU  19   5.253   0.082  -2.547
  169    H    LEU  20           H        LEU  20   3.961  -5.764  -4.728
  170    HA   LEU  20           HA       LEU  20   6.293  -7.458  -5.103
  171    HB2  LEU  20          2HB       LEU  20   3.314  -8.056  -5.336
  172    HB3  LEU  20          3HB       LEU  20   4.581  -9.267  -5.467
  173    HG   LEU  20           HG       LEU  20   4.029  -7.609  -2.973
  174   HD11  LEU  20          1HD1      LEU  20   3.119  -9.648  -1.978
  175   HD12  LEU  20          2HD1      LEU  20   3.324 -10.506  -3.509
  176   HD13  LEU  20          3HD1      LEU  20   2.189  -9.155  -3.393
  177   HD21  LEU  20          1HD2      LEU  20   5.937  -9.942  -3.367
  178   HD22  LEU  20          2HD2      LEU  20   5.575  -9.154  -1.829
  179   HD23  LEU  20          3HD2      LEU  20   6.384  -8.253  -3.108
  180    H    GLU  21           H        GLU  21   4.216  -5.584  -7.138
  181    HA   GLU  21           HA       GLU  21   4.913  -6.942  -9.615
  182    HB2  GLU  21          2HB       GLU  21   3.516  -4.308  -8.997
  183    HB3  GLU  21          3HB       GLU  21   3.879  -4.814 -10.647
  184    HG2  GLU  21          2HG       GLU  21   2.447  -6.732 -10.475
  185    HG3  GLU  21          3HG       GLU  21   2.259  -6.520  -8.738
  186    H    GLN  22           H        GLN  22   5.840  -3.938  -7.933
  187    HA   GLN  22           HA       GLN  22   7.882  -3.162  -9.776
  188    HB2  GLN  22          2HB       GLN  22   7.368  -2.302  -6.896
  189    HB3  GLN  22          3HB       GLN  22   8.545  -1.541  -7.964
  190    HG2  GLN  22          2HG       GLN  22   6.711  -0.894  -9.497
  191    HG3  GLN  22          3HG       GLN  22   5.546  -1.624  -8.398
  192   HE21  GLN  22          1HE2      GLN  22   6.917  -0.634  -5.969
  193   HE22  GLN  22          2HE2      GLN  22   6.580   1.055  -5.910
  194    H    SER  23           H        SER  23   7.774  -5.349  -7.058
  195    HA   SER  23           HA       SER  23  10.489  -6.219  -7.516
  196    HB2  SER  23          2HB       SER  23  10.538  -4.163  -5.886
  197    HB3  SER  23          3HB       SER  23   9.897  -5.286  -4.691
  198    HG   SER  23           HG       SER  23  11.721  -6.509  -4.863
  199    HA   PRO  24           HA       PRO  24   7.380  -9.558  -6.446
  200    HB2  PRO  24          2HB       PRO  24   8.605 -11.497  -8.050
  201    HB3  PRO  24          3HB       PRO  24   7.378 -10.347  -8.616
  202    HG2  PRO  24          2HG       PRO  24  10.373 -10.158  -8.846
  203    HG3  PRO  24          3HG       PRO  24   9.125  -9.834 -10.076
  204    HD2  PRO  24          2HD       PRO  24  10.278  -7.802  -8.773
  205    HD3  PRO  24          3HD       PRO  24   8.535  -7.763  -9.134
  206    H    ASN  25           H        ASN  25  10.910  -9.740  -6.364
  207    HA   ASN  25           HA       ASN  25  11.010 -12.186  -4.843
  208    HB2  ASN  25          2HB       ASN  25  13.193 -10.166  -5.487
  209    HB3  ASN  25          3HB       ASN  25  13.471 -11.731  -4.724
  210   HD21  ASN  25          1HD2      ASN  25  13.147 -13.645  -5.977
  211   HD22  ASN  25          2HD2      ASN  25  13.134 -13.584  -7.707
  212    H    SER  26           H        SER  26  10.556  -8.913  -3.996
  213    HA   SER  26           HA       SER  26  11.812  -8.938  -1.407
  214    HB2  SER  26          2HB       SER  26   9.827  -7.008  -2.670
  215    HB3  SER  26          3HB       SER  26  10.702  -6.722  -1.161
  216    HG   SER  26           HG       SER  26  12.236  -5.993  -2.354
  217    H    LYS  27           H        LYS  27  10.828  -9.001   0.608
  218    HA   LYS  27           HA       LYS  27   8.078 -10.057   0.780
  219    HB2  LYS  27          2HB       LYS  27  10.358 -10.137   2.792
  220    HB3  LYS  27          3HB       LYS  27   8.724 -10.686   3.145
  221    HG2  LYS  27          2HG       LYS  27  10.369 -11.878   0.886
  222    HG3  LYS  27          3HG       LYS  27  10.468 -12.461   2.540
  223    HD2  LYS  27          2HD       LYS  27   8.972 -13.943   1.410
  224    HD3  LYS  27          3HD       LYS  27   7.970 -12.932   2.444
  225    HE2  LYS  27          2HE       LYS  27   6.984 -13.344   0.177
  226    HE3  LYS  27          3HE       LYS  27   7.224 -11.631   0.514
  227    HZ1  LYS  27          1HZ       LYS  27   9.359 -11.843  -0.754
  228    HZ2  LYS  27          2HZ       LYS  27   7.955 -12.027  -1.671
  229    HZ3  LYS  27          3HZ       LYS  27   8.853 -13.386  -1.227
  230    H    VAL  28           H        VAL  28   6.581  -8.721   1.269
  231    HA   VAL  28           HA       VAL  28   7.149  -6.056   2.392
  232    HB   VAL  28           HB       VAL  28   4.662  -7.060   0.917
  233   HG11  VAL  28          1HG1      VAL  28   5.475  -4.232   1.678
  234   HG12  VAL  28          2HG1      VAL  28   4.170  -5.165   2.412
  235   HG13  VAL  28          3HG1      VAL  28   4.055  -4.669   0.721
  236   HG21  VAL  28          1HG2      VAL  28   6.628  -7.052  -0.585
  237   HG22  VAL  28          2HG2      VAL  28   6.960  -5.372  -0.155
  238   HG23  VAL  28          3HG2      VAL  28   5.487  -5.780  -1.038
  239    H    GLN  29           H        GLN  29   6.131  -5.364   4.237
  240    HA   GLN  29           HA       GLN  29   4.239  -7.128   5.684
  241    HB2  GLN  29          2HB       GLN  29   6.442  -7.429   6.735
  242    HB3  GLN  29          3HB       GLN  29   6.705  -5.690   6.787
  243    HG2  GLN  29          2HG       GLN  29   6.169  -6.527   9.013
  244    HG3  GLN  29          3HG       GLN  29   4.883  -5.464   8.452
  245   HE21  GLN  29          1HE2      GLN  29   2.829  -6.347   8.045
  246   HE22  GLN  29          2HE2      GLN  29   2.392  -7.941   8.547
  247    H    VAL  30           H        VAL  30   2.369  -5.933   5.670
  248    HA   VAL  30           HA       VAL  30   2.190  -3.148   5.318
  249    HB   VAL  30           HB       VAL  30   0.141  -4.958   6.678
  250   HG11  VAL  30          1HG1      VAL  30  -0.184  -2.177   5.473
  251   HG12  VAL  30          2HG1      VAL  30  -0.301  -2.596   7.183
  252   HG13  VAL  30          3HG1      VAL  30  -1.505  -3.192   6.047
  253   HG21  VAL  30          1HG2      VAL  30   0.680  -5.742   4.392
  254   HG22  VAL  30          2HG2      VAL  30   0.339  -4.133   3.750
  255   HG23  VAL  30          3HG2      VAL  30  -0.960  -5.089   4.465
  256    H    ARG  31           H        ARG  31   2.791  -1.588   6.656
  257    HA   ARG  31           HA       ARG  31   3.531  -2.222   9.421
  258    HB2  ARG  31          2HB       ARG  31   5.166  -1.184   7.778
  259    HB3  ARG  31          3HB       ARG  31   4.182   0.276   7.794
  260    HG2  ARG  31          2HG       ARG  31   6.085   0.571   9.272
  261    HG3  ARG  31          3HG       ARG  31   4.612   0.509  10.242
  262    HD2  ARG  31          2HD       ARG  31   5.114  -1.922  10.713
  263    HD3  ARG  31          3HD       ARG  31   6.655  -1.718   9.870
  264    HE   ARG  31           HE       ARG  31   6.058   0.057  12.127
  265   HH11  ARG  31          1HH1      ARG  31   7.897  -2.715  10.975
  266   HH12  ARG  31          2HH1      ARG  31   9.005  -2.656  12.305
  267   HH21  ARG  31          1HH2      ARG  31   7.523   0.111  13.835
  268   HH22  ARG  31          2HH2      ARG  31   8.796  -1.066  13.917
  269    H    ARG  32           H        ARG  32   1.622   0.212   7.611
  270    HA   ARG  32           HA       ARG  32  -0.186   0.645   9.829
  271    HB2  ARG  32          2HB       ARG  32   1.794   2.145  10.346
  272    HB3  ARG  32          3HB       ARG  32   1.507   2.989   8.831
  273    HG2  ARG  32          2HG       ARG  32   0.598   4.271  10.703
  274    HG3  ARG  32          3HG       ARG  32  -0.714   3.719   9.660
  275    HD2  ARG  32          2HD       ARG  32  -1.142   1.844  11.255
  276    HD3  ARG  32          3HD       ARG  32   0.121   2.486  12.311
  277    HE   ARG  32           HE       ARG  32  -1.939   4.407  11.706
  278   HH11  ARG  32          1HH1      ARG  32  -1.154   1.697  13.815
  279   HH12  ARG  32          2HH1      ARG  32  -2.234   2.213  15.071
  280   HH21  ARG  32          1HH2      ARG  32  -3.346   5.065  13.364
  281   HH22  ARG  32          2HH2      ARG  32  -3.477   4.122  14.815
  282    H    VAL  33           H        VAL  33  -2.070   1.847   9.189
  283    HA   VAL  33           HA       VAL  33  -2.419   2.412   6.291
  284    HB   VAL  33           HB       VAL  33  -4.471   1.177   8.208
  285   HG11  VAL  33          1HG1      VAL  33  -4.800   1.849   5.262
  286   HG12  VAL  33          2HG1      VAL  33  -5.571   2.699   6.601
  287   HG13  VAL  33          3HG1      VAL  33  -5.989   1.018   6.269
  288   HG21  VAL  33          1HG2      VAL  33  -4.354  -0.829   6.774
  289   HG22  VAL  33          2HG2      VAL  33  -2.774  -0.458   7.469
  290   HG23  VAL  33          3HG2      VAL  33  -3.110  -0.055   5.783
  291    H    GLN  34           H        GLN  34  -3.490   4.333   5.817
  292    HA   GLN  34           HA       GLN  34  -4.577   6.033   8.006
  293    HB2  GLN  34          2HB       GLN  34  -3.070   7.069   5.546
  294    HB3  GLN  34          3HB       GLN  34  -3.644   8.024   6.909
  295    HG2  GLN  34          2HG       GLN  34  -1.457   5.935   7.030
  296    HG3  GLN  34          3HG       GLN  34  -1.190   7.671   6.896
  297   HE21  GLN  34          1HE2      GLN  34  -0.376   5.731   8.940
  298   HE22  GLN  34          2HE2      GLN  34  -0.954   6.376  10.440
  299    H    LYS  35           H        LYS  35  -6.775   6.008   7.591
  300    HA   LYS  35           HA       LYS  35  -7.786   5.994   4.833
  301    HB2  LYS  35          2HB       LYS  35  -8.725   4.483   6.681
  302    HB3  LYS  35          3HB       LYS  35  -9.397   5.919   7.431
  303    HG2  LYS  35          2HG       LYS  35 -10.092   5.082   4.600
  304    HG3  LYS  35          3HG       LYS  35 -10.976   4.485   5.998
  305    HD2  LYS  35          2HD       LYS  35 -11.683   6.774   6.560
  306    HD3  LYS  35          3HD       LYS  35 -10.717   7.421   5.231
  307    HE2  LYS  35          2HE       LYS  35 -13.046   7.342   4.575
  308    HE3  LYS  35          3HE       LYS  35 -12.132   6.174   3.623
  309    HZ1  LYS  35          1HZ       LYS  35 -12.983   4.412   4.982
  310    HZ2  LYS  35          2HZ       LYS  35 -14.277   5.339   4.419
  311    HZ3  LYS  35          3HZ       LYS  35 -13.750   5.507   6.016
  312    H    GLN  36           H        GLN  36  -7.862   7.973   3.903
  313    HA   GLN  36           HA       GLN  36  -8.796  10.321   5.465
  314    HB2  GLN  36          2HB       GLN  36  -6.731  10.270   3.213
  315    HB3  GLN  36          3HB       GLN  36  -7.324  11.725   4.003
  316    HG2  GLN  36          2HG       GLN  36  -5.708   9.514   5.305
  317    HG3  GLN  36          3HG       GLN  36  -5.109  11.111   4.849
  318   HE21  GLN  36          1HE2      GLN  36  -5.175   9.810   7.478
  319   HE22  GLN  36          2HE2      GLN  36  -6.055  10.869   8.517
  320    H    GLY  37           H        GLY  37 -10.952  10.025   4.829
  321    HA2  GLY  37          2HA       GLY  37 -12.769  10.680   3.582
  322    HA3  GLY  37          3HA       GLY  37 -11.686  11.261   2.329
  323    H    ASN  38           H        ASN  38 -10.934   9.785   0.753
  324    HA   ASN  38           HA       ASN  38 -11.800   6.985   0.796
  325    HB2  ASN  38          2HB       ASN  38 -12.509   8.958  -1.391
  326    HB3  ASN  38          3HB       ASN  38 -12.207   7.281  -1.823
  327   HD21  ASN  38          1HD2      ASN  38 -14.346   9.442  -0.112
  328   HD22  ASN  38          2HD2      ASN  38 -15.644   8.321   0.082
  329    H    THR  39           H        THR  39  -9.343   9.144   0.562
  330    HA   THR  39           HA       THR  39  -7.620   7.463  -1.116
  331    HB   THR  39           HB       THR  39  -6.950  10.111   0.246
  332    HG1  THR  39           HG1      THR  39  -8.557   9.648  -1.839
  333   HG21  THR  39          1HG2      THR  39  -5.091  10.205  -1.384
  334   HG22  THR  39          2HG2      THR  39  -5.570   8.641  -2.047
  335   HG23  THR  39          3HG2      THR  39  -4.961   8.748  -0.392
  336    H    ILE  40           H        ILE  40  -7.214   5.685   0.120
  337    HA   ILE  40           HA       ILE  40  -6.335   5.922   2.899
  338    HB   ILE  40           HB       ILE  40  -6.855   3.434   1.208
  339   HG12  ILE  40          2HG1      ILE  40  -8.568   4.846   3.312
  340   HG13  ILE  40          3HG1      ILE  40  -8.953   4.640   1.608
  341   HG21  ILE  40          1HG2      ILE  40  -6.729   2.183   3.345
  342   HG22  ILE  40          2HG2      ILE  40  -6.297   3.670   4.191
  343   HG23  ILE  40          3HG2      ILE  40  -5.201   2.993   2.986
  344   HD11  ILE  40          1HD1      ILE  40  -8.815   2.447   3.677
  345   HD12  ILE  40          2HD1      ILE  40  -9.187   2.228   1.966
  346   HD13  ILE  40          3HD1      ILE  40 -10.271   3.163   2.989
  347    H    ARG  41           H        ARG  41  -4.271   6.531   3.064
  348    HA   ARG  41           HA       ARG  41  -2.121   5.563   1.342
  349    HB2  ARG  41          2HB       ARG  41  -2.192   7.466   3.724
  350    HB3  ARG  41          3HB       ARG  41  -0.690   6.970   2.954
  351    HG2  ARG  41          2HG       ARG  41  -1.472   7.979   0.823
  352    HG3  ARG  41          3HG       ARG  41  -2.937   8.534   1.638
  353    HD2  ARG  41          2HD       ARG  41  -1.720  10.047   3.021
  354    HD3  ARG  41          3HD       ARG  41  -0.173   9.283   2.647
  355    HE   ARG  41           HE       ARG  41  -1.178  10.279   0.246
  356   HH11  ARG  41          1HH1      ARG  41  -0.110  11.619   3.326
  357   HH12  ARG  41          2HH1      ARG  41   0.409  13.119   2.629
  358   HH21  ARG  41          1HH2      ARG  41  -0.452  12.238  -0.645
  359   HH22  ARG  41          2HH2      ARG  41   0.217  13.470   0.384
  360    H    VAL  42           H        VAL  42  -1.638   3.439   1.771
  361    HA   VAL  42           HA       VAL  42  -1.346   2.521   4.561
  362    HB   VAL  42           HB       VAL  42  -1.131   0.904   1.973
  363   HG11  VAL  42          1HG1      VAL  42  -1.352  -0.049   4.858
  364   HG12  VAL  42          2HG1      VAL  42   0.097  -0.139   3.855
  365   HG13  VAL  42          3HG1      VAL  42  -1.329  -1.090   3.428
  366   HG21  VAL  42          1HG2      VAL  42  -3.405   1.778   2.255
  367   HG22  VAL  42          2HG2      VAL  42  -3.461   1.151   3.906
  368   HG23  VAL  42          3HG2      VAL  42  -3.380   0.034   2.540
  369    H    GLU  43           H        GLU  43   0.626   2.822   5.447
  370    HA   GLU  43           HA       GLU  43   3.084   2.885   3.895
  371    HB2  GLU  43          2HB       GLU  43   2.597   2.899   6.912
  372    HB3  GLU  43          3HB       GLU  43   4.180   3.041   6.164
  373    HG2  GLU  43          2HG       GLU  43   3.567   5.253   6.749
  374    HG3  GLU  43          3HG       GLU  43   3.336   5.142   5.009
  375    H    LEU  44           H        LEU  44   3.949   0.971   3.195
  376    HA   LEU  44           HA       LEU  44   3.766  -1.424   4.930
  377    HB2  LEU  44          2HB       LEU  44   4.268  -1.501   1.933
  378    HB3  LEU  44          3HB       LEU  44   3.915  -2.841   3.008
  379    HG   LEU  44           HG       LEU  44   1.584  -1.573   3.336
  380   HD11  LEU  44          1HD1      LEU  44   2.199   0.423   2.062
  381   HD12  LEU  44          2HD1      LEU  44   0.816  -0.398   1.345
  382   HD13  LEU  44          3HD1      LEU  44   2.417  -0.558   0.610
  383   HD21  LEU  44          1HD2      LEU  44   2.186  -3.145   0.815
  384   HD22  LEU  44          2HD2      LEU  44   0.589  -2.895   1.533
  385   HD23  LEU  44          3HD2      LEU  44   1.809  -3.828   2.398
  386    H    GLU  45           H        GLU  45   5.641  -2.784   4.886
  387    HA   GLU  45           HA       GLU  45   8.158  -1.242   4.752
  388    HB2  GLU  45          2HB       GLU  45   7.267  -1.558   7.022
  389    HB3  GLU  45          3HB       GLU  45   7.159  -3.295   6.775
  390    HG2  GLU  45          2HG       GLU  45   9.587  -3.490   6.743
  391    HG3  GLU  45          3HG       GLU  45   9.760  -1.731   6.805
  392    H    LEU  46           H        LEU  46   9.188  -2.006   3.024
  393    HA   LEU  46           HA       LEU  46   8.926  -4.812   2.169
  394    HB2  LEU  46          2HB       LEU  46   8.261  -3.074   0.581
  395    HB3  LEU  46          3HB       LEU  46   9.809  -2.273   0.729
  396    HG   LEU  46           HG       LEU  46   9.753  -5.105  -0.348
  397   HD11  LEU  46          1HD1      LEU  46   9.097  -2.671  -2.037
  398   HD12  LEU  46          2HD1      LEU  46   7.981  -3.975  -1.621
  399   HD13  LEU  46          3HD1      LEU  46   9.384  -4.309  -2.637
  400   HD21  LEU  46          1HD2      LEU  46  11.677  -4.315  -1.699
  401   HD22  LEU  46          2HD2      LEU  46  11.955  -4.061   0.022
  402   HD23  LEU  46          3HD2      LEU  46  11.504  -2.698  -1.005
  403    H    ARG  47           H        ARG  47  10.516  -6.092   2.911
  404    HA   ARG  47           HA       ARG  47  13.171  -4.989   3.588
  405    HB2  ARG  47          2HB       ARG  47  11.742  -7.530   4.474
  406    HB3  ARG  47          3HB       ARG  47  13.419  -7.170   4.885
  407    HG2  ARG  47          2HG       ARG  47  12.677  -5.114   6.059
  408    HG3  ARG  47          3HG       ARG  47  10.999  -5.512   5.680
  409    HD2  ARG  47          2HD       ARG  47  11.074  -7.473   7.071
  410    HD3  ARG  47          3HD       ARG  47  12.824  -7.347   7.259
  411    HE   ARG  47           HE       ARG  47  12.456  -5.332   8.591
  412   HH11  ARG  47          1HH1      ARG  47   9.660  -7.423   8.183
  413   HH12  ARG  47          2HH1      ARG  47   8.880  -6.847   9.617
  414   HH21  ARG  47          1HH2      ARG  47  11.453  -4.625  10.482
  415   HH22  ARG  47          2HH2      ARG  47   9.902  -5.256  10.923
  416    H    THR  48           H        THR  48  14.850  -5.446   2.390
  417    HA   THR  48           HA       THR  48  15.125  -7.881   0.798
  418    HB   THR  48           HB       THR  48  15.305  -5.090  -0.448
  419    HG1  THR  48           HG1      THR  48  13.309  -6.982  -0.315
  420   HG21  THR  48          1HG2      THR  48  15.732  -7.811  -1.748
  421   HG22  THR  48          2HG2      THR  48  16.990  -6.609  -1.437
  422   HG23  THR  48          3HG2      THR  48  15.699  -6.270  -2.595
  423    H    ASN  49           H        ASN  49  17.161  -8.616   1.072
  424    HA   ASN  49           HA       ASN  49  19.398  -8.827   1.398
  425    HB2  ASN  49          2HB       ASN  49  19.511  -5.913   0.510
  426    HB3  ASN  49          3HB       ASN  49  20.898  -6.992   0.599
  427   HD21  ASN  49          1HD2      ASN  49  19.747  -5.523  -1.686
  428   HD22  ASN  49          2HD2      ASN  49  19.420  -6.714  -2.896
  429    H    GLY  50           H        GLY  50  17.618  -7.789   3.614
  430    HA2  GLY  50          2HA       GLY  50  18.099  -7.531   5.901
  431    HA3  GLY  50          3HA       GLY  50  19.721  -6.989   5.508
  432    H    LYS  51           H        LYS  51  18.457  -5.117   3.437
  433    HA   LYS  51           HA       LYS  51  17.970  -2.790   5.070
  434    HB2  LYS  51          2HB       LYS  51  17.808  -3.328   2.067
  435    HB3  LYS  51          3HB       LYS  51  17.474  -1.749   2.770
  436    HG2  LYS  51          2HG       LYS  51  19.751  -1.529   3.546
  437    HG3  LYS  51          3HG       LYS  51  20.117  -3.198   3.099
  438    HD2  LYS  51          2HD       LYS  51  21.020  -1.516   1.478
  439    HD3  LYS  51          3HD       LYS  51  19.926  -2.685   0.740
  440    HE2  LYS  51          2HE       LYS  51  19.498  -0.437  -0.136
  441    HE3  LYS  51          3HE       LYS  51  18.103  -0.993   0.787
  442    HZ1  LYS  51          1HZ       LYS  51  18.613   1.294   1.284
  443    HZ2  LYS  51          2HZ       LYS  51  20.190   0.894   1.726
  444    HZ3  LYS  51          3HZ       LYS  51  18.894   0.347   2.657
  445    H    LYS  52           H        LYS  52  15.982  -1.455   4.773
  446    HA   LYS  52           HA       LYS  52  13.576  -2.795   3.786
  447    HB2  LYS  52          2HB       LYS  52  12.233  -2.313   5.744
  448    HB3  LYS  52          3HB       LYS  52  13.629  -3.253   6.255
  449    HG2  LYS  52          2HG       LYS  52  14.694  -1.293   7.204
  450    HG3  LYS  52          3HG       LYS  52  13.458  -0.233   6.520
  451    HD2  LYS  52          2HD       LYS  52  11.752  -1.458   7.958
  452    HD3  LYS  52          3HD       LYS  52  13.106  -2.270   8.753
  453    HE2  LYS  52          2HE       LYS  52  13.968  -0.136   9.544
  454    HE3  LYS  52          3HE       LYS  52  12.744   0.744   8.633
  455    HZ1  LYS  52          1HZ       LYS  52  12.032   0.659  10.862
  456    HZ2  LYS  52          2HZ       LYS  52  12.328  -0.997  10.988
  457    HZ3  LYS  52          3HZ       LYS  52  11.062  -0.445  10.019
  458    H    GLU  53           H        GLU  53  12.120  -1.409   2.930
  459    HA   GLU  53           HA       GLU  53  12.608   1.505   2.991
  460    HB2  GLU  53          2HB       GLU  53  11.822  -0.202   0.576
  461    HB3  GLU  53          3HB       GLU  53  11.908   1.554   0.575
  462    HG2  GLU  53          2HG       GLU  53  14.258  -0.326   0.988
  463    HG3  GLU  53          3HG       GLU  53  13.868   0.497  -0.519
  464    H    ASN  54           H        ASN  54  10.849   2.456   3.873
  465    HA   ASN  54           HA       ASN  54   8.269   1.113   3.977
  466    HB2  ASN  54          2HB       ASN  54   9.148   2.525   5.909
  467    HB3  ASN  54          3HB       ASN  54   8.943   3.935   4.879
  468   HD21  ASN  54          1HD2      ASN  54   6.836   1.095   5.351
  469   HD22  ASN  54          2HD2      ASN  54   5.465   1.996   5.881
  470    H    TYR  55           H        TYR  55   6.905   1.285   2.321
  471    HA   TYR  55           HA       TYR  55   6.925   3.597   0.481
  472    HB2  TYR  55          2HB       TYR  55   5.841   0.765   0.135
  473    HB3  TYR  55          3HB       TYR  55   5.629   2.053  -1.044
  474    HD1  TYR  55           HD1      TYR  55   7.495   2.772  -2.469
  475    HD2  TYR  55           HD2      TYR  55   8.074  -0.300   0.440
  476    HE1  TYR  55           HE1      TYR  55   9.600   2.137  -3.561
  477    HE2  TYR  55           HE2      TYR  55  10.185  -0.926  -0.652
  478    HH   TYR  55           HH       TYR  55  11.274  -0.740  -2.840
  479    H    THR  56           H        THR  56   5.422   5.030   1.057
  480    HA   THR  56           HA       THR  56   2.834   4.349   2.167
  481    HB   THR  56           HB       THR  56   3.914   7.000   1.100
  482    HG1  THR  56           HG1      THR  56   4.303   5.632   3.452
  483   HG21  THR  56          1HG2      THR  56   1.486   6.471   2.872
  484   HG22  THR  56          2HG2      THR  56   1.431   6.989   1.183
  485   HG23  THR  56          3HG2      THR  56   2.101   8.060   2.417
  486    H    VAL  57           H        VAL  57   1.692   3.182   0.702
  487    HA   VAL  57           HA       VAL  57   1.563   3.926  -2.122
  488    HB   VAL  57           HB       VAL  57   0.293   1.556  -0.659
  489   HG11  VAL  57          1HG1      VAL  57  -0.935   2.120  -2.722
  490   HG12  VAL  57          2HG1      VAL  57  -0.057   0.602  -2.928
  491   HG13  VAL  57          3HG1      VAL  57   0.571   2.088  -3.643
  492   HG21  VAL  57          1HG2      VAL  57   2.813   1.636  -2.367
  493   HG22  VAL  57          2HG2      VAL  57   2.097   0.187  -1.655
  494   HG23  VAL  57          3HG2      VAL  57   2.766   1.444  -0.611
  495    H    GLU  58           H        GLU  58   0.297   5.591  -2.412
  496    HA   GLU  58           HA       GLU  58  -2.038   6.260  -0.847
  497    HB2  GLU  58          2HB       GLU  58  -0.990   7.523  -3.426
  498    HB3  GLU  58          3HB       GLU  58  -2.129   8.250  -2.290
  499    HG2  GLU  58          2HG       GLU  58  -0.409   8.435  -0.588
  500    HG3  GLU  58          3HG       GLU  58   0.732   7.527  -1.583
  501    H    VAL  59           H        VAL  59  -3.672   4.862  -1.191
  502    HA   VAL  59           HA       VAL  59  -4.541   4.112  -3.920
  503    HB   VAL  59           HB       VAL  59  -5.353   2.940  -1.216
  504   HG11  VAL  59          1HG1      VAL  59  -7.093   2.608  -2.931
  505   HG12  VAL  59          2HG1      VAL  59  -6.331   1.073  -2.507
  506   HG13  VAL  59          3HG1      VAL  59  -5.898   1.887  -4.013
  507   HG21  VAL  59          1HG2      VAL  59  -2.965   2.504  -1.660
  508   HG22  VAL  59          2HG2      VAL  59  -3.373   1.828  -3.240
  509   HG23  VAL  59          3HG2      VAL  59  -3.903   1.009  -1.769
  510    H    GLU  60           H        GLU  60  -6.695   4.636  -4.579
  511    HA   GLU  60           HA       GLU  60  -8.382   6.229  -2.774
  512    HB2  GLU  60          2HB       GLU  60  -7.002   7.739  -4.229
  513    HB3  GLU  60          3HB       GLU  60  -7.715   6.983  -5.651
  514    HG2  GLU  60          2HG       GLU  60  -9.976   7.746  -4.836
  515    HG3  GLU  60          3HG       GLU  60  -9.159   8.626  -3.541
  516    H    ARG  61           H        ARG  61 -10.589   6.068  -3.188
  517    HA   ARG  61           HA       ARG  61 -11.562   3.708  -4.525
  518    HB2  ARG  61          2HB       ARG  61 -12.551   4.601  -2.400
  519    HB3  ARG  61          3HB       ARG  61 -13.096   6.030  -3.265
  520    HG2  ARG  61          2HG       ARG  61 -15.044   4.751  -3.209
  521    HG3  ARG  61          3HG       ARG  61 -14.388   4.312  -4.786
  522    HD2  ARG  61          2HD       ARG  61 -15.048   2.263  -3.817
  523    HD3  ARG  61          3HD       ARG  61 -13.300   2.301  -3.578
  524    HE   ARG  61           HE       ARG  61 -14.170   3.369  -1.290
  525   HH11  ARG  61          1HH1      ARG  61 -15.221   0.424  -2.928
  526   HH12  ARG  61          2HH1      ARG  61 -15.665  -0.361  -1.448
  527   HH21  ARG  61          1HH2      ARG  61 -14.703   2.286   0.614
  528   HH22  ARG  61          2HH2      ARG  61 -15.372   0.688   0.542
  529    H    GLN  62           H        GLN  62 -11.805   3.693  -6.709
  530    HA   GLN  62           HA       GLN  62 -13.238   5.946  -8.032
  531    HB2  GLN  62          2HB       GLN  62 -11.248   3.954  -9.224
  532    HB3  GLN  62          3HB       GLN  62 -12.282   4.984 -10.206
  533    HG2  GLN  62          2HG       GLN  62 -11.228   6.980  -9.165
  534    HG3  GLN  62          3HG       GLN  62 -10.135   5.915  -8.281
  535   HE21  GLN  62          1HE2      GLN  62  -9.797   4.056 -10.546
  536   HE22  GLN  62          2HE2      GLN  62  -8.795   4.880 -11.680
  537    H    GLY  63           H        GLY  63 -15.221   5.437  -8.768
  538    HA2  GLY  63          2HA       GLY  63 -17.174   4.303  -9.097
  539    HA3  GLY  63          3HA       GLY  63 -16.212   2.894  -9.531
  540    H    ASN  64           H        ASN  64 -16.131   1.230  -8.122
  541    HA   ASN  64           HA       ASN  64 -16.869   1.614  -5.267
  542    HB2  ASN  64          2HB       ASN  64 -17.580  -0.817  -6.981
  543    HB3  ASN  64          3HB       ASN  64 -17.960  -0.602  -5.277
  544   HD21  ASN  64          1HD2      ASN  64 -18.759   0.386  -8.541
  545   HD22  ASN  64          2HD2      ASN  64 -20.270   1.128  -8.147
  546    H    THR  65           H        THR  65 -14.454   0.824  -7.410
  547    HA   THR  65           HA       THR  65 -13.180  -1.260  -5.736
  548    HB   THR  65           HB       THR  65 -11.652  -1.601  -7.693
  549    HG1  THR  65           HG1      THR  65 -13.183   0.543  -8.739
  550   HG21  THR  65          1HG2      THR  65 -13.696  -2.984  -7.532
  551   HG22  THR  65          2HG2      THR  65 -13.289  -2.649  -9.216
  552   HG23  THR  65          3HG2      THR  65 -14.597  -1.760  -8.435
  553    H    TRP  66           H        TRP  66 -10.670  -1.067  -5.850
  554    HA   TRP  66           HA       TRP  66  -9.843   1.650  -5.000
  555    HB2  TRP  66          2HB       TRP  66  -8.868  -1.107  -4.106
  556    HB3  TRP  66          3HB       TRP  66  -8.131   0.415  -3.606
  557    HD1  TRP  66           HD1      TRP  66 -10.941  -1.913  -2.666
  558    HE1  TRP  66           HE1      TRP  66 -12.306  -0.884  -0.744
  559    HE3  TRP  66           HE3      TRP  66  -9.011   2.833  -2.721
  560    HZ2  TRP  66           HZ2      TRP  66 -12.551   1.604   0.545
  561    HZ3  TRP  66           HZ3      TRP  66  -9.883   4.473  -1.115
  562    HH2  TRP  66           HH2      TRP  66 -11.625   3.871   0.485
  563    H    THR  67           H        THR  67  -8.149   2.575  -6.001
  564    HA   THR  67           HA       THR  67  -6.375   1.012  -7.797
  565    HB   THR  67           HB       THR  67  -8.037   2.397  -9.125
  566    HG1  THR  67           HG1      THR  67  -5.434   3.502  -9.425
  567   HG21  THR  67          1HG2      THR  67  -7.777   4.859  -9.184
  568   HG22  THR  67          2HG2      THR  67  -6.628   4.780  -7.853
  569   HG23  THR  67          3HG2      THR  67  -8.309   4.319  -7.586
  570    H    VAL  68           H        VAL  68  -4.194   1.821  -7.867
  571    HA   VAL  68           HA       VAL  68  -3.409   3.483  -5.586
  572    HB   VAL  68           HB       VAL  68  -1.743   1.822  -7.519
  573   HG11  VAL  68          1HG1      VAL  68  -0.802   3.422  -5.099
  574   HG12  VAL  68          2HG1      VAL  68  -0.411   3.771  -6.784
  575   HG13  VAL  68          3HG1      VAL  68   0.191   2.296  -6.026
  576   HG21  VAL  68          1HG2      VAL  68  -2.553   1.417  -4.613
  577   HG22  VAL  68          2HG2      VAL  68  -1.357   0.435  -5.445
  578   HG23  VAL  68          3HG2      VAL  68  -3.030   0.428  -5.998
  579    H    LYS  69           H        LYS  69  -3.244   5.548  -5.833
  580    HA   LYS  69           HA       LYS  69  -3.046   6.967  -8.284
  581    HB2  LYS  69          2HB       LYS  69  -2.665   7.897  -5.402
  582    HB3  LYS  69          3HB       LYS  69  -2.710   8.972  -6.796
  583    HG2  LYS  69          2HG       LYS  69  -4.981   7.234  -5.785
  584    HG3  LYS  69          3HG       LYS  69  -4.870   8.994  -5.690
  585    HD2  LYS  69          2HD       LYS  69  -5.122   7.334  -8.233
  586    HD3  LYS  69          3HD       LYS  69  -6.382   8.331  -7.508
  587    HE2  LYS  69          2HE       LYS  69  -5.139  10.361  -8.010
  588    HE3  LYS  69          3HE       LYS  69  -3.750   9.426  -8.564
  589    HZ1  LYS  69          1HZ       LYS  69  -6.423   9.440  -9.833
  590    HZ2  LYS  69          2HZ       LYS  69  -5.074   8.580 -10.373
  591    HZ3  LYS  69          3HZ       LYS  69  -5.064  10.270 -10.392
  592    H    ARG  70           H        ARG  70  -0.740   6.582  -5.569
  593    HA   ARG  70           HA       ARG  70   1.495   6.225  -7.359
  594    HB2  ARG  70          2HB       ARG  70   1.311   8.717  -7.380
  595    HB3  ARG  70          3HB       ARG  70   1.415   8.747  -5.625
  596    HG2  ARG  70          2HG       ARG  70   3.560   9.375  -6.649
  597    HG3  ARG  70          3HG       ARG  70   3.720   7.877  -5.728
  598    HD2  ARG  70          2HD       ARG  70   3.533   6.587  -7.859
  599    HD3  ARG  70          3HD       ARG  70   3.473   8.111  -8.752
  600    HE   ARG  70           HE       ARG  70   5.774   8.387  -7.407
  601   HH11  ARG  70          1HH1      ARG  70   4.575   5.647  -9.265
  602   HH12  ARG  70          2HH1      ARG  70   6.162   5.113  -9.718
  603   HH21  ARG  70          1HH2      ARG  70   7.839   7.700  -8.062
  604   HH22  ARG  70          2HH2      ARG  70   8.005   6.275  -9.037
  605    H    ILE  71           H        ILE  71   3.032   5.045  -6.369
  606    HA   ILE  71           HA       ILE  71   2.970   4.552  -3.485
  607    HB   ILE  71           HB       ILE  71   4.820   3.446  -5.656
  608   HG12  ILE  71          2HG1      ILE  71   2.368   2.190  -4.341
  609   HG13  ILE  71          3HG1      ILE  71   2.457   2.765  -6.002
  610   HG21  ILE  71          1HG2      ILE  71   4.442   2.544  -2.777
  611   HG22  ILE  71          2HG2      ILE  71   5.865   3.363  -3.424
  612   HG23  ILE  71          3HG2      ILE  71   5.455   1.738  -3.977
  613   HD11  ILE  71          1HD1      ILE  71   3.942   0.436  -4.811
  614   HD12  ILE  71          2HD1      ILE  71   4.172   1.046  -6.452
  615   HD13  ILE  71          3HD1      ILE  71   2.613   0.398  -5.962
  616    H    THR  72           H        THR  72   3.770   6.301  -2.434
  617    HA   THR  72           HA       THR  72   6.263   7.601  -3.268
  618    HB   THR  72           HB       THR  72   4.281   8.305  -1.054
  619    HG1  THR  72           HG1      THR  72   3.312   8.926  -2.885
  620   HG21  THR  72          1HG2      THR  72   6.724   9.842  -2.034
  621   HG22  THR  72          2HG2      THR  72   6.547   9.090  -0.447
  622   HG23  THR  72          3HG2      THR  72   5.524  10.455  -0.894
  623    H    ARG  73           H        ARG  73   7.960   6.341  -2.696
  624    HA   ARG  73           HA       ARG  73   8.247   4.902  -0.241
  625    HB2  ARG  73          2HB       ARG  73   9.490   4.385  -2.356
  626    HB3  ARG  73          3HB       ARG  73  10.354   5.910  -2.208
  627    HG2  ARG  73          2HG       ARG  73  11.358   5.084  -0.067
  628    HG3  ARG  73          3HG       ARG  73  10.542   3.536  -0.322
  629    HD2  ARG  73          2HD       ARG  73  12.871   3.410  -1.060
  630    HD3  ARG  73          3HD       ARG  73  11.778   3.231  -2.431
  631    HE   ARG  73           HE       ARG  73  12.223   5.706  -2.809
  632   HH11  ARG  73          1HH1      ARG  73  14.670   3.573  -1.453
  633   HH12  ARG  73          2HH1      ARG  73  15.992   4.534  -2.038
  634   HH21  ARG  73          1HH2      ARG  73  13.953   6.960  -3.521
  635   HH22  ARG  73          2HH2      ARG  73  15.583   6.451  -3.208
  636    H    THR  74           H        THR  74   9.477   5.537   1.612
  637    HA   THR  74           HA       THR  74   9.524   8.294   2.331
  638    HB   THR  74           HB       THR  74   9.250   6.506   4.038
  639    HG1  THR  74           HG1      THR  74   9.959   8.287   5.001
  640   HG21  THR  74          1HG2      THR  74  10.793   4.782   3.144
  641   HG22  THR  74          2HG2      THR  74  11.180   5.162   4.822
  642   HG23  THR  74          3HG2      THR  74  12.178   5.810   3.519
  643    H    VAL  75           H        VAL  75  11.423   9.563   2.777
  644    HA   VAL  75           HA       VAL  75  13.729   8.957   1.031
  645    HB   VAL  75           HB       VAL  75  12.546  11.015   0.429
  646   HG11  VAL  75          1HG1      VAL  75  11.508  11.611   2.568
  647   HG12  VAL  75          2HG1      VAL  75  12.402  12.984   1.915
  648   HG13  VAL  75          3HG1      VAL  75  13.084  12.041   3.240
  649   HG21  VAL  75          1HG2      VAL  75  15.243  11.666   1.684
  650   HG22  VAL  75          2HG2      VAL  75  14.427  12.619   0.442
  651   HG23  VAL  75          3HG2      VAL  75  14.983  10.985   0.075
  652    H    GLY  76           H        GLY  76  15.805   9.095   1.847
  653    HA2  GLY  76          2HA       GLY  76  16.308   9.862   4.637
  654    HA3  GLY  76          3HA       GLY  76  16.712   8.208   4.166
  655    H    SER  77           H        SER  77  18.364  10.703   4.889
  656    HA   SER  77           HA       SER  77  19.719  11.556   2.522
  657    HB2  SER  77          2HB       SER  77  21.279  12.695   4.129
  658    HB3  SER  77          3HB       SER  77  19.588  13.044   4.482
  659    HG   SER  77           HG       SER  77  21.447  11.509   5.894
  660    H    LEU  78           H        LEU  78  21.080  10.348   1.420
  661    HA   LEU  78           HA       LEU  78  22.803   8.317   2.721
  662    HB2  LEU  78          2HB       LEU  78  21.069   7.883   0.669
  663    HB3  LEU  78          3HB       LEU  78  22.435   8.423  -0.282
  664    HG   LEU  78           HG       LEU  78  22.495   6.034   1.627
  665   HD11  LEU  78          1HD1      LEU  78  21.010   5.577  -0.252
  666   HD12  LEU  78          2HD1      LEU  78  22.482   4.615  -0.377
  667   HD13  LEU  78          3HD1      LEU  78  22.272   6.043  -1.397
  668   HD21  LEU  78          1HD2      LEU  78  24.728   7.008   1.356
  669   HD22  LEU  78          2HD2      LEU  78  24.573   6.946  -0.399
  670   HD23  LEU  78          3HD2      LEU  78  24.642   5.447   0.535
  671    H    GLU  79           H        GLU  79  23.513  10.796   3.210
  672    HA   GLU  79           HA       GLU  79  25.125  12.154   1.317
  673    HB2  GLU  79          2HB       GLU  79  25.800  13.600   3.111
  674    HB3  GLU  79          3HB       GLU  79  24.135  13.166   3.456
  675    HG2  GLU  79          2HG       GLU  79  26.609  12.040   4.818
  676    HG3  GLU  79          3HG       GLU  79  25.489  13.216   5.498
  677    H    HIS  80           H        HIS  80  27.426  12.323   1.249
  678    HA   HIS  80           HA       HIS  80  28.919  10.028   2.391
  679    HB2  HIS  80          2HB       HIS  80  29.337  11.337  -0.344
  680    HB3  HIS  80          3HB       HIS  80  30.358  10.072   0.348
  681    HD1  HIS  80           HD1      HIS  80  27.454  10.523  -1.755
  682    HD2  HIS  80           HD2      HIS  80  28.791   7.568   0.842
  683    HE1  HIS  80           HE1      HIS  80  26.139   8.466  -2.331
  684    HE2  HIS  80           HE2      HIS  80  27.061   6.667  -0.836
  685    H    HIS  81           H        HIS  81  30.477  10.624   3.714
  686    HA   HIS  81           HA       HIS  81  31.377  13.420   3.814
  687    HB2  HIS  81          2HB       HIS  81  31.984  11.087   5.686
  688    HB3  HIS  81          3HB       HIS  81  32.447  12.766   5.949
  689    HD1  HIS  81           HD1      HIS  81  29.544  10.427   6.182
  690    HD2  HIS  81           HD2      HIS  81  30.331  14.463   6.775
  691    HE1  HIS  81           HE1      HIS  81  27.564  11.333   7.434
  692    HE2  HIS  81           HE2      HIS  81  28.104  13.750   7.837
  693    H    HIS  82           H        HIS  82  33.146  13.955   2.678
  694    HA   HIS  82           HA       HIS  82  35.070  11.863   1.866
  695    HB2  HIS  82          2HB       HIS  82  35.756  13.323   0.045
  696    HB3  HIS  82          3HB       HIS  82  34.015  13.143   0.010
  697    HD1  HIS  82           HD1      HIS  82  36.368  15.579  -0.688
  698    HD2  HIS  82           HD2      HIS  82  32.869  15.640   1.548
  699    HE1  HIS  82           HE1      HIS  82  35.678  17.987  -0.572
  700    HE2  HIS  82           HE2      HIS  82  33.631  18.010   0.883
  701    H    HIS  83           H        HIS  83  36.997  11.792   2.760
  702    HA   HIS  83           HA       HIS  83  37.840  13.829   4.683
  703    HB2  HIS  83          2HB       HIS  83  39.471  12.207   5.461
  704    HB3  HIS  83          3HB       HIS  83  37.925  11.392   5.276
  705    HD1  HIS  83           HD1      HIS  83  41.446  11.280   4.190
  706    HD2  HIS  83           HD2      HIS  83  37.849   9.562   3.011
  707    HE1  HIS  83           HE1      HIS  83  42.063   9.353   2.706
  708    HE2  HIS  83           HE2      HIS  83  39.873   8.265   2.103
  709    H    HIS  84           H        HIS  84  38.181  13.556   1.442
  710    HA   HIS  84           HA       HIS  84  40.893  14.728   1.304
  711    HB2  HIS  84          2HB       HIS  84  40.440  12.858  -0.254
  712    HB3  HIS  84          3HB       HIS  84  39.027  13.690  -0.887
  713    HD1  HIS  84           HD1      HIS  84  42.784  13.734  -0.987
  714    HD2  HIS  84           HD2      HIS  84  39.593  15.690  -2.807
  715    HE1  HIS  84           HE1      HIS  84  43.768  14.992  -2.920
  716    HE2  HIS  84           HE2      HIS  84  41.812  16.078  -4.062
  717    H    HIS  85           H        HIS  85  40.863  16.915   1.516
  718    HA   HIS  85           HA       HIS  85  38.671  18.627   0.975
  719    HB2  HIS  85          2HB       HIS  85  40.506  19.231   2.543
  720    HB3  HIS  85          3HB       HIS  85  41.647  19.294   1.202
  721    HD1  HIS  85           HD1      HIS  85  41.207  21.261  -0.588
  722    HD2  HIS  85           HD2      HIS  85  39.076  21.574   2.965
  723    HE1  HIS  85           HE1      HIS  85  40.337  23.619  -0.522
  724    HE2  HIS  85           HE2      HIS  85  38.896  23.710   1.534
  Start of MODEL    6
    1    H1   MET   1          1H        MET   1 -19.482  -7.492   3.276
    2    H2   MET   1          2H        MET   1 -18.643  -7.594   1.821
    3    H3   MET   1          3H        MET   1 -20.068  -8.471   2.032
    4    HA   MET   1           HA       MET   1 -20.448  -6.545   0.645
    5    HB2  MET   1          2HB       MET   1 -21.707  -6.359   3.423
    6    HB3  MET   1          3HB       MET   1 -22.312  -5.507   2.005
    7    HG2  MET   1          2HG       MET   1 -23.670  -7.457   2.381
    8    HG3  MET   1          3HG       MET   1 -22.733  -7.704   0.907
    9    HE1  MET   1          1HE       MET   1 -23.075 -11.317   2.494
   10    HE2  MET   1          2HE       MET   1 -23.407 -10.327   1.072
   11    HE3  MET   1          3HE       MET   1 -24.272 -10.026   2.583
   12    HA   PRO   2           HA       PRO   2 -18.098  -2.772   1.010
   13    HB2  PRO   2          2HB       PRO   2 -20.275  -0.879   0.878
   14    HB3  PRO   2          3HB       PRO   2 -19.277  -1.469  -0.466
   15    HG2  PRO   2          2HG       PRO   2 -21.948  -2.434   0.479
   16    HG3  PRO   2          3HG       PRO   2 -21.313  -2.318  -1.179
   17    HD2  PRO   2          2HD       PRO   2 -21.459  -4.695  -0.015
   18    HD3  PRO   2          3HD       PRO   2 -20.000  -4.286  -0.953
   19    H    SER   3           H        SER   3 -17.194  -2.466   2.885
   20    HA   SER   3           HA       SER   3 -18.374  -0.882   5.006
   21    HB2  SER   3          2HB       SER   3 -19.062  -3.095   5.821
   22    HB3  SER   3          3HB       SER   3 -17.476  -3.783   5.473
   23    HG   SER   3           HG       SER   3 -17.118  -3.313   7.489
   24    H    GLU   4           H        GLU   4 -16.706   0.308   6.016
   25    HA   GLU   4           HA       GLU   4 -14.384   0.625   4.460
   26    HB2  GLU   4          2HB       GLU   4 -15.525   2.405   5.880
   27    HB3  GLU   4          3HB       GLU   4 -14.713   1.698   7.272
   28    HG2  GLU   4          2HG       GLU   4 -12.505   2.099   5.996
   29    HG3  GLU   4          3HG       GLU   4 -13.457   3.085   4.885
   30    H    GLU   5           H        GLU   5 -14.916  -1.225   7.386
   31    HA   GLU   5           HA       GLU   5 -12.248  -1.861   8.076
   32    HB2  GLU   5          2HB       GLU   5 -14.843  -3.417   8.461
   33    HB3  GLU   5          3HB       GLU   5 -13.323  -3.816   9.264
   34    HG2  GLU   5          2HG       GLU   5 -13.356  -1.754  10.517
   35    HG3  GLU   5          3HG       GLU   5 -14.708  -1.134   9.574
   36    H    GLU   6           H        GLU   6 -14.627  -3.487   5.998
   37    HA   GLU   6           HA       GLU   6 -13.033  -5.676   5.129
   38    HB2  GLU   6          2HB       GLU   6 -15.533  -5.616   5.079
   39    HB3  GLU   6          3HB       GLU   6 -15.478  -4.405   3.804
   40    HG2  GLU   6          2HG       GLU   6 -14.547  -5.987   2.239
   41    HG3  GLU   6          3HG       GLU   6 -14.276  -7.173   3.515
   42    H    GLU   7           H        GLU   7 -13.320  -2.370   4.121
   43    HA   GLU   7           HA       GLU   7 -12.220  -2.587   1.545
   44    HB2  GLU   7          2HB       GLU   7 -12.137  -0.201   3.419
   45    HB3  GLU   7          3HB       GLU   7 -11.774  -0.167   1.698
   46    HG2  GLU   7          2HG       GLU   7 -14.443  -0.558   3.054
   47    HG3  GLU   7          3HG       GLU   7 -13.969   0.678   1.895
   48    H    LYS   8           H        LYS   8 -10.620  -2.143   4.766
   49    HA   LYS   8           HA       LYS   8  -7.993  -1.761   3.787
   50    HB2  LYS   8          2HB       LYS   8  -8.956  -2.952   6.407
   51    HB3  LYS   8          3HB       LYS   8  -7.246  -2.863   6.025
   52    HG2  LYS   8          2HG       LYS   8  -7.552  -0.971   7.325
   53    HG3  LYS   8          3HG       LYS   8  -7.653  -0.314   5.688
   54    HD2  LYS   8          2HD       LYS   8 -10.114  -0.317   5.831
   55    HD3  LYS   8          3HD       LYS   8 -10.034  -1.032   7.442
   56    HE2  LYS   8          2HE       LYS   8  -8.819   1.026   8.223
   57    HE3  LYS   8          3HE       LYS   8  -9.085   1.736   6.626
   58    HZ1  LYS   8          1HZ       LYS   8 -10.793   2.495   8.089
   59    HZ2  LYS   8          2HZ       LYS   8 -11.153   0.924   8.599
   60    HZ3  LYS   8          3HZ       LYS   8 -11.505   1.394   7.018
   61    H    ARG   9           H        ARG   9  -9.855  -4.725   4.338
   62    HA   ARG   9           HA       ARG   9  -7.862  -6.670   3.908
   63    HB2  ARG   9          2HB       ARG   9 -10.813  -6.857   3.135
   64    HB3  ARG   9          3HB       ARG   9  -9.710  -8.221   3.350
   65    HG2  ARG   9          2HG       ARG   9  -9.480  -7.636   5.750
   66    HG3  ARG   9          3HG       ARG   9 -10.610  -6.294   5.524
   67    HD2  ARG   9          2HD       ARG   9 -12.394  -7.888   4.909
   68    HD3  ARG   9          3HD       ARG   9 -11.255  -9.234   5.065
   69    HE   ARG   9           HE       ARG   9 -11.582  -7.589   7.426
   70   HH11  ARG   9          1HH1      ARG   9 -12.663 -10.510   5.767
   71   HH12  ARG   9          2HH1      ARG   9 -13.299 -11.229   7.213
   72   HH21  ARG   9          1HH2      ARG   9 -12.437  -8.529   9.291
   73   HH22  ARG   9          2HH2      ARG   9 -13.168 -10.104   9.215
   74    H    GLN  10           H        GLN  10  -9.785  -4.742   1.677
   75    HA   GLN  10           HA       GLN  10  -8.732  -5.976  -0.730
   76    HB2  GLN  10          2HB       GLN  10 -10.257  -3.356  -0.409
   77    HB3  GLN  10          3HB       GLN  10  -9.973  -4.219  -1.921
   78    HG2  GLN  10          2HG       GLN  10 -11.291  -6.151  -0.945
   79    HG3  GLN  10          3HG       GLN  10 -11.714  -5.093   0.404
   80   HE21  GLN  10          1HE2      GLN  10 -13.121  -3.329   0.013
   81   HE22  GLN  10          2HE2      GLN  10 -14.103  -3.255  -1.403
   82    H    VAL  11           H        VAL  11  -8.034  -2.955   1.083
   83    HA   VAL  11           HA       VAL  11  -6.626  -1.713  -1.079
   84    HB   VAL  11           HB       VAL  11  -6.834  -0.864   1.851
   85   HG11  VAL  11          1HG1      VAL  11  -6.163   1.393   1.070
   86   HG12  VAL  11          2HG1      VAL  11  -5.917   0.753  -0.557
   87   HG13  VAL  11          3HG1      VAL  11  -4.890   0.206   0.766
   88   HG21  VAL  11          1HG2      VAL  11  -9.014  -0.950   0.695
   89   HG22  VAL  11          2HG2      VAL  11  -8.386   0.098  -0.572
   90   HG23  VAL  11          3HG2      VAL  11  -8.552   0.706   1.074
   91    H    LYS  12           H        LYS  12  -5.591  -3.151   2.043
   92    HA   LYS  12           HA       LYS  12  -2.810  -2.582   1.677
   93    HB2  LYS  12          2HB       LYS  12  -3.906  -4.814   3.430
   94    HB3  LYS  12          3HB       LYS  12  -2.385  -3.943   3.610
   95    HG2  LYS  12          2HG       LYS  12  -3.669  -1.889   4.195
   96    HG3  LYS  12          3HG       LYS  12  -5.171  -2.816   4.080
   97    HD2  LYS  12          2HD       LYS  12  -2.922  -3.147   6.090
   98    HD3  LYS  12          3HD       LYS  12  -4.584  -2.670   6.407
   99    HE2  LYS  12          2HE       LYS  12  -3.664  -5.418   5.489
  100    HE3  LYS  12          3HE       LYS  12  -4.148  -4.978   7.127
  101    HZ1  LYS  12          1HZ       LYS  12  -6.365  -4.490   6.291
  102    HZ2  LYS  12          2HZ       LYS  12  -5.915  -6.085   5.963
  103    HZ3  LYS  12          3HZ       LYS  12  -5.895  -4.937   4.726
  104    H    GLN  13           H        GLN  13  -4.973  -5.109   0.645
  105    HA   GLN  13           HA       GLN  13  -3.058  -7.078  -0.140
  106    HB2  GLN  13          2HB       GLN  13  -5.345  -7.726   0.309
  107    HB3  GLN  13          3HB       GLN  13  -5.977  -6.548  -0.830
  108    HG2  GLN  13          2HG       GLN  13  -4.943  -7.884  -2.693
  109    HG3  GLN  13          3HG       GLN  13  -4.475  -9.089  -1.490
  110   HE21  GLN  13          1HE2      GLN  13  -7.195  -7.498  -3.004
  111   HE22  GLN  13          2HE2      GLN  13  -8.353  -8.743  -2.686
  112    H    VAL  14           H        VAL  14  -4.848  -4.507  -1.897
  113    HA   VAL  14           HA       VAL  14  -3.687  -4.868  -4.448
  114    HB   VAL  14           HB       VAL  14  -4.781  -2.321  -3.136
  115   HG11  VAL  14          1HG1      VAL  14  -3.315  -1.692  -5.011
  116   HG12  VAL  14          2HG1      VAL  14  -5.005  -1.389  -5.424
  117   HG13  VAL  14          3HG1      VAL  14  -4.177  -2.804  -6.081
  118   HG21  VAL  14          1HG2      VAL  14  -6.475  -4.103  -3.363
  119   HG22  VAL  14          2HG2      VAL  14  -6.119  -4.241  -5.083
  120   HG23  VAL  14          3HG2      VAL  14  -6.836  -2.757  -4.446
  121    H    ALA  15           H        ALA  15  -2.798  -2.877  -1.665
  122    HA   ALA  15           HA       ALA  15  -0.689  -1.418  -2.784
  123    HB1  ALA  15          1HB       ALA  15  -0.162  -0.783  -0.478
  124    HB2  ALA  15          2HB       ALA  15  -1.190  -2.086   0.132
  125    HB3  ALA  15          3HB       ALA  15  -1.906  -0.739  -0.756
  126    H    LYS  16           H        LYS  16  -0.696  -4.525  -1.006
  127    HA   LYS  16           HA       LYS  16   2.143  -4.713  -0.812
  128    HB2  LYS  16          2HB       LYS  16   1.854  -6.926   0.041
  129    HB3  LYS  16          3HB       LYS  16   0.551  -5.954   0.700
  130    HG2  LYS  16          2HG       LYS  16  -1.042  -6.956  -0.824
  131    HG3  LYS  16          3HG       LYS  16   0.231  -7.803  -1.692
  132    HD2  LYS  16          2HD       LYS  16  -0.563  -8.308   1.206
  133    HD3  LYS  16          3HD       LYS  16  -1.038  -9.295  -0.179
  134    HE2  LYS  16          2HE       LYS  16   1.407  -9.741  -0.616
  135    HE3  LYS  16          3HE       LYS  16   1.780  -8.900   0.893
  136    HZ1  LYS  16          1HZ       LYS  16   0.357 -10.543   2.042
  137    HZ2  LYS  16          2HZ       LYS  16   1.705 -11.234   1.297
  138    HZ3  LYS  16          3HZ       LYS  16   0.177 -11.388   0.586
  139    H    GLU  17           H        GLU  17  -0.256  -5.884  -3.171
  140    HA   GLU  17           HA       GLU  17   1.549  -7.421  -4.751
  141    HB2  GLU  17          2HB       GLU  17  -1.093  -6.110  -5.511
  142    HB3  GLU  17          3HB       GLU  17  -0.223  -7.271  -6.514
  143    HG2  GLU  17          2HG       GLU  17  -1.448  -7.808  -3.793
  144    HG3  GLU  17          3HG       GLU  17  -2.080  -8.333  -5.349
  145    H    LYS  18           H        LYS  18   0.567  -4.022  -4.764
  146    HA   LYS  18           HA       LYS  18   1.819  -3.218  -7.163
  147    HB2  LYS  18          2HB       LYS  18   1.184  -1.642  -4.637
  148    HB3  LYS  18          3HB       LYS  18   1.747  -0.907  -6.133
  149    HG2  LYS  18          2HG       LYS  18  -0.865  -2.370  -5.690
  150    HG3  LYS  18          3HG       LYS  18  -0.644  -0.643  -5.964
  151    HD2  LYS  18          2HD       LYS  18  -0.066  -2.853  -7.988
  152    HD3  LYS  18          3HD       LYS  18  -1.493  -1.814  -7.975
  153    HE2  LYS  18          2HE       LYS  18  -0.085   0.158  -8.368
  154    HE3  LYS  18          3HE       LYS  18   1.366  -0.851  -8.336
  155    HZ1  LYS  18          1HZ       LYS  18  -0.853  -1.011 -10.298
  156    HZ2  LYS  18          2HZ       LYS  18   0.465  -2.064 -10.250
  157    HZ3  LYS  18          3HZ       LYS  18   0.706  -0.427 -10.588
  158    H    LEU  19           H        LEU  19   3.003  -3.633  -3.880
  159    HA   LEU  19           HA       LEU  19   5.647  -2.630  -4.380
  160    HB2  LEU  19          2HB       LEU  19   4.502  -4.296  -2.112
  161    HB3  LEU  19          3HB       LEU  19   6.159  -3.715  -2.151
  162    HG   LEU  19           HG       LEU  19   3.629  -2.057  -1.913
  163   HD11  LEU  19          1HD1      LEU  19   6.047  -2.306  -0.106
  164   HD12  LEU  19          2HD1      LEU  19   4.448  -3.004   0.173
  165   HD13  LEU  19          3HD1      LEU  19   4.651  -1.254   0.159
  166   HD21  LEU  19          1HD2      LEU  19   6.438  -1.020  -2.399
  167   HD22  LEU  19          2HD2      LEU  19   5.029  -0.040  -1.979
  168   HD23  LEU  19          3HD2      LEU  19   5.068  -0.906  -3.509
  169    H    LEU  20           H        LEU  20   4.120  -5.811  -4.454
  170    HA   LEU  20           HA       LEU  20   6.548  -7.301  -4.794
  171    HB2  LEU  20          2HB       LEU  20   3.632  -8.041  -5.187
  172    HB3  LEU  20          3HB       LEU  20   4.950  -9.189  -5.375
  173    HG   LEU  20           HG       LEU  20   4.293  -7.696  -2.795
  174   HD11  LEU  20          1HD1      LEU  20   2.546  -9.317  -3.325
  175   HD12  LEU  20          2HD1      LEU  20   3.475  -9.817  -1.916
  176   HD13  LEU  20          3HD1      LEU  20   3.757 -10.597  -3.477
  177   HD21  LEU  20          1HD2      LEU  20   5.903  -9.209  -1.716
  178   HD22  LEU  20          2HD2      LEU  20   6.675  -8.207  -2.940
  179   HD23  LEU  20          3HD2      LEU  20   6.321  -9.902  -3.287
  180    H    GLU  21           H        GLU  21   4.508  -5.534  -6.961
  181    HA   GLU  21           HA       GLU  21   5.326  -6.557  -9.460
  182    HB2  GLU  21          2HB       GLU  21   4.610  -3.744  -8.535
  183    HB3  GLU  21          3HB       GLU  21   5.005  -4.100 -10.212
  184    HG2  GLU  21          2HG       GLU  21   2.700  -5.291  -8.646
  185    HG3  GLU  21          3HG       GLU  21   2.582  -4.005  -9.845
  186    H    GLN  22           H        GLN  22   6.830  -4.374  -7.182
  187    HA   GLN  22           HA       GLN  22   9.052  -3.616  -8.892
  188    HB2  GLN  22          2HB       GLN  22   8.391  -2.961  -5.980
  189    HB3  GLN  22          3HB       GLN  22   9.663  -2.192  -6.932
  190    HG2  GLN  22          2HG       GLN  22   8.055  -1.156  -8.397
  191    HG3  GLN  22          3HG       GLN  22   6.729  -2.097  -7.716
  192   HE21  GLN  22          1HE2      GLN  22   5.910  -1.528  -5.707
  193   HE22  GLN  22          2HE2      GLN  22   6.224  -0.008  -4.977
  194    H    SER  23           H        SER  23   8.429  -5.788  -6.160
  195    HA   SER  23           HA       SER  23  10.984  -7.113  -6.510
  196    HB2  SER  23          2HB       SER  23  11.479  -5.193  -4.935
  197    HB3  SER  23          3HB       SER  23  10.339  -5.888  -3.791
  198    HG   SER  23           HG       SER  23  12.889  -6.462  -4.075
  199    HA   PRO  24           HA       PRO  24   7.366  -9.940  -5.756
  200    HB2  PRO  24          2HB       PRO  24   9.176 -11.867  -7.195
  201    HB3  PRO  24          3HB       PRO  24   7.485 -11.433  -7.532
  202    HG2  PRO  24          2HG       PRO  24   9.441 -10.551  -9.120
  203    HG3  PRO  24          3HG       PRO  24   8.053  -9.514  -8.713
  204    HD2  PRO  24          2HD       PRO  24  10.840  -9.457  -7.560
  205    HD3  PRO  24          3HD       PRO  24   9.797  -8.109  -8.062
  206    H    ASN  25           H        ASN  25  10.791 -10.884  -5.321
  207    HA   ASN  25           HA       ASN  25  10.111 -13.131  -3.588
  208    HB2  ASN  25          2HB       ASN  25  12.824 -12.068  -4.500
  209    HB3  ASN  25          3HB       ASN  25  12.580 -13.551  -3.580
  210   HD21  ASN  25          1HD2      ASN  25  11.591 -15.352  -4.620
  211   HD22  ASN  25          2HD2      ASN  25  11.486 -15.447  -6.343
  212    H    SER  26           H        SER  26  10.428  -9.867  -3.029
  213    HA   SER  26           HA       SER  26  11.766  -9.989  -0.449
  214    HB2  SER  26          2HB       SER  26  12.008  -7.975  -1.852
  215    HB3  SER  26          3HB       SER  26  10.269  -7.700  -1.796
  216    HG   SER  26           HG       SER  26  12.202  -7.329   0.172
  217    H    LYS  27           H        LYS  27  10.722  -9.288   1.542
  218    HA   LYS  27           HA       LYS  27   7.990 -10.329   1.845
  219    HB2  LYS  27          2HB       LYS  27   9.721 -11.154   3.398
  220    HB3  LYS  27          3HB       LYS  27  10.085  -9.512   3.913
  221    HG2  LYS  27          2HG       LYS  27   8.735 -10.652   5.599
  222    HG3  LYS  27          3HG       LYS  27   7.837  -9.306   4.902
  223    HD2  LYS  27          2HD       LYS  27   6.251 -11.043   5.073
  224    HD3  LYS  27          3HD       LYS  27   6.704 -11.051   3.373
  225    HE2  LYS  27          2HE       LYS  27   7.843 -12.948   5.460
  226    HE3  LYS  27          3HE       LYS  27   6.485 -13.325   4.405
  227    HZ1  LYS  27          1HZ       LYS  27   8.552 -14.235   3.566
  228    HZ2  LYS  27          2HZ       LYS  27   9.239 -12.698   3.489
  229    HZ3  LYS  27          3HZ       LYS  27   7.935 -13.087   2.492
  230    H    VAL  28           H        VAL  28   6.266  -9.040   2.258
  231    HA   VAL  28           HA       VAL  28   6.682  -6.150   2.763
  232    HB   VAL  28           HB       VAL  28   4.362  -7.483   1.281
  233   HG11  VAL  28          1HG1      VAL  28   3.594  -5.175   0.799
  234   HG12  VAL  28          2HG1      VAL  28   4.895  -4.531   1.802
  235   HG13  VAL  28          3HG1      VAL  28   3.613  -5.498   2.535
  236   HG21  VAL  28          1HG2      VAL  28   6.418  -7.447  -0.094
  237   HG22  VAL  28          2HG2      VAL  28   6.589  -5.712   0.182
  238   HG23  VAL  28          3HG2      VAL  28   5.214  -6.328  -0.740
  239    H    GLN  29           H        GLN  29   6.278  -5.770   4.861
  240    HA   GLN  29           HA       GLN  29   3.916  -6.946   6.223
  241    HB2  GLN  29          2HB       GLN  29   6.506  -5.707   7.269
  242    HB3  GLN  29          3HB       GLN  29   5.109  -5.947   8.316
  243    HG2  GLN  29          2HG       GLN  29   6.577  -8.162   6.834
  244    HG3  GLN  29          3HG       GLN  29   6.808  -7.743   8.533
  245   HE21  GLN  29          1HE2      GLN  29   5.115  -8.185  10.021
  246   HE22  GLN  29          2HE2      GLN  29   3.848  -9.300   9.651
  247    H    VAL  30           H        VAL  30   2.156  -5.583   6.341
  248    HA   VAL  30           HA       VAL  30   2.257  -2.833   5.603
  249    HB   VAL  30           HB       VAL  30   0.075  -4.260   7.195
  250   HG11  VAL  30          1HG1      VAL  30  -0.032  -1.653   5.623
  251   HG12  VAL  30          2HG1      VAL  30  -0.049  -1.796   7.381
  252   HG13  VAL  30          3HG1      VAL  30  -1.392  -2.425   6.437
  253   HG21  VAL  30          1HG2      VAL  30  -1.087  -4.548   5.035
  254   HG22  VAL  30          2HG2      VAL  30   0.478  -5.363   5.010
  255   HG23  VAL  30          3HG2      VAL  30   0.277  -3.815   4.185
  256    H    ARG  31           H        ARG  31   3.057  -1.218   6.794
  257    HA   ARG  31           HA       ARG  31   3.831  -1.627   9.567
  258    HB2  ARG  31          2HB       ARG  31   5.241  -0.499   7.660
  259    HB3  ARG  31          3HB       ARG  31   4.270   0.934   7.969
  260    HG2  ARG  31          2HG       ARG  31   6.347   1.128   9.192
  261    HG3  ARG  31          3HG       ARG  31   5.048   0.885  10.365
  262    HD2  ARG  31          2HD       ARG  31   5.653  -1.588  10.382
  263    HD3  ARG  31          3HD       ARG  31   7.055  -1.183   9.380
  264    HE   ARG  31           HE       ARG  31   7.081   0.415  11.704
  265   HH11  ARG  31          1HH1      ARG  31   7.567  -2.956  10.777
  266   HH12  ARG  31          2HH1      ARG  31   8.628  -3.291  12.109
  267   HH21  ARG  31          1HH2      ARG  31   8.504  -0.056  13.428
  268   HH22  ARG  31          2HH2      ARG  31   9.155  -1.656  13.602
  269    H    ARG  32           H        ARG  32   1.868   0.712   7.738
  270    HA   ARG  32           HA       ARG  32   0.121   1.255  10.018
  271    HB2  ARG  32          2HB       ARG  32   1.761   3.397   8.578
  272    HB3  ARG  32          3HB       ARG  32   0.330   3.771   9.532
  273    HG2  ARG  32          2HG       ARG  32   1.402   3.012  11.568
  274    HG3  ARG  32          3HG       ARG  32   2.801   2.419  10.670
  275    HD2  ARG  32          2HD       ARG  32   3.234   4.588  11.801
  276    HD3  ARG  32          3HD       ARG  32   3.424   4.686  10.051
  277    HE   ARG  32           HE       ARG  32   1.281   5.807   9.936
  278   HH11  ARG  32          1HH1      ARG  32   2.768   5.729  13.136
  279   HH12  ARG  32          2HH1      ARG  32   1.865   7.092  13.715
  280   HH21  ARG  32          1HH2      ARG  32   0.077   7.541  10.721
  281   HH22  ARG  32          2HH2      ARG  32   0.339   8.120  12.338
  282    H    VAL  33           H        VAL  33  -1.900   2.244   9.359
  283    HA   VAL  33           HA       VAL  33  -2.456   2.445   6.448
  284    HB   VAL  33           HB       VAL  33  -4.351   1.163   8.498
  285   HG11  VAL  33          1HG1      VAL  33  -5.604   2.421   6.790
  286   HG12  VAL  33          2HG1      VAL  33  -5.828   0.688   6.551
  287   HG13  VAL  33          3HG1      VAL  33  -4.730   1.587   5.501
  288   HG21  VAL  33          1HG2      VAL  33  -4.063  -0.933   7.240
  289   HG22  VAL  33          2HG2      VAL  33  -2.521  -0.375   7.892
  290   HG23  VAL  33          3HG2      VAL  33  -2.886  -0.149   6.180
  291    H    GLN  34           H        GLN  34  -3.093   4.511   6.056
  292    HA   GLN  34           HA       GLN  34  -4.499   6.043   8.175
  293    HB2  GLN  34          2HB       GLN  34  -2.517   6.968   6.057
  294    HB3  GLN  34          3HB       GLN  34  -3.613   8.102   6.835
  295    HG2  GLN  34          2HG       GLN  34  -1.517   8.228   7.977
  296    HG3  GLN  34          3HG       GLN  34  -2.665   7.438   9.056
  297   HE21  GLN  34          1HE2      GLN  34  -0.907   5.923   6.358
  298   HE22  GLN  34          2HE2      GLN  34   0.044   4.881   7.350
  299    H    LYS  35           H        LYS  35  -6.485   6.739   7.753
  300    HA   LYS  35           HA       LYS  35  -7.630   6.436   5.036
  301    HB2  LYS  35          2HB       LYS  35  -8.675   4.940   6.637
  302    HB3  LYS  35          3HB       LYS  35  -8.844   6.216   7.830
  303    HG2  LYS  35          2HG       LYS  35 -11.001   5.622   6.813
  304    HG3  LYS  35          3HG       LYS  35 -10.573   7.305   6.484
  305    HD2  LYS  35          2HD       LYS  35  -9.804   6.651   4.214
  306    HD3  LYS  35          3HD       LYS  35 -10.252   4.975   4.553
  307    HE2  LYS  35          2HE       LYS  35 -11.944   6.227   3.202
  308    HE3  LYS  35          3HE       LYS  35 -12.590   5.571   4.709
  309    HZ1  LYS  35          1HZ       LYS  35 -12.369   7.748   5.720
  310    HZ2  LYS  35          2HZ       LYS  35 -13.313   7.842   4.327
  311    HZ3  LYS  35          3HZ       LYS  35 -11.719   8.383   4.295
  312    H    GLN  36           H        GLN  36  -7.680   8.380   4.048
  313    HA   GLN  36           HA       GLN  36  -8.615  10.776   5.520
  314    HB2  GLN  36          2HB       GLN  36  -6.209  10.606   3.643
  315    HB3  GLN  36          3HB       GLN  36  -6.927  12.126   4.162
  316    HG2  GLN  36          2HG       GLN  36  -5.699  10.059   6.021
  317    HG3  GLN  36          3HG       GLN  36  -4.890  11.524   5.460
  318   HE21  GLN  36          1HE2      GLN  36  -5.672  10.617   8.184
  319   HE22  GLN  36          2HE2      GLN  36  -6.593  11.915   8.850
  320    H    GLY  37           H        GLY  37 -10.589  11.035   4.647
  321    HA2  GLY  37          2HA       GLY  37 -12.226  11.595   3.154
  322    HA3  GLY  37          3HA       GLY  37 -10.971  11.909   1.969
  323    H    ASN  38           H        ASN  38 -10.689  10.458   0.340
  324    HA   ASN  38           HA       ASN  38 -12.044   7.815   0.472
  325    HB2  ASN  38          2HB       ASN  38 -11.445   9.585  -1.947
  326    HB3  ASN  38          3HB       ASN  38 -11.926   7.896  -2.084
  327   HD21  ASN  38          1HD2      ASN  38 -13.805   8.405  -3.202
  328   HD22  ASN  38          2HD2      ASN  38 -15.162   9.164  -2.454
  329    H    THR  39           H        THR  39  -9.063   9.509   0.175
  330    HA   THR  39           HA       THR  39  -7.567   7.335  -1.052
  331    HB   THR  39           HB       THR  39  -6.503   9.926   0.144
  332    HG1  THR  39           HG1      THR  39  -7.788   9.440  -2.303
  333   HG21  THR  39          1HG2      THR  39  -4.619   9.589  -1.437
  334   HG22  THR  39          2HG2      THR  39  -5.318   8.047  -1.941
  335   HG23  THR  39          3HG2      THR  39  -4.742   8.256  -0.284
  336    H    ILE  40           H        ILE  40  -7.391   5.631   0.346
  337    HA   ILE  40           HA       ILE  40  -6.376   5.939   3.052
  338    HB   ILE  40           HB       ILE  40  -6.728   3.401   1.382
  339   HG12  ILE  40          2HG1      ILE  40  -8.557   4.717   3.439
  340   HG13  ILE  40          3HG1      ILE  40  -8.895   4.476   1.730
  341   HG21  ILE  40          1HG2      ILE  40  -6.541   2.192   3.521
  342   HG22  ILE  40          2HG2      ILE  40  -6.266   3.711   4.378
  343   HG23  ILE  40          3HG2      ILE  40  -5.080   3.129   3.208
  344   HD11  ILE  40          1HD1      ILE  40  -8.655   2.295   3.814
  345   HD12  ILE  40          2HD1      ILE  40  -9.006   2.059   2.101
  346   HD13  ILE  40          3HD1      ILE  40 -10.143   2.933   3.119
  347    H    ARG  41           H        ARG  41  -4.311   6.638   3.181
  348    HA   ARG  41           HA       ARG  41  -2.211   5.766   1.340
  349    HB2  ARG  41          2HB       ARG  41  -2.129   7.643   3.757
  350    HB3  ARG  41          3HB       ARG  41  -0.760   7.305   2.698
  351    HG2  ARG  41          2HG       ARG  41  -2.099   8.250   0.783
  352    HG3  ARG  41          3HG       ARG  41  -3.340   8.720   1.951
  353    HD2  ARG  41          2HD       ARG  41  -0.446   9.655   2.079
  354    HD3  ARG  41          3HD       ARG  41  -1.741  10.554   1.288
  355    HE   ARG  41           HE       ARG  41  -1.838   9.879   4.175
  356   HH11  ARG  41          1HH1      ARG  41  -2.006  12.309   1.622
  357   HH12  ARG  41          2HH1      ARG  41  -2.482  13.582   2.701
  358   HH21  ARG  41          1HH2      ARG  41  -2.493  11.592   5.563
  359   HH22  ARG  41          2HH2      ARG  41  -2.751  13.177   4.919
  360    H    VAL  42           H        VAL  42  -1.916   3.612   1.747
  361    HA   VAL  42           HA       VAL  42  -1.512   2.598   4.462
  362    HB   VAL  42           HB       VAL  42  -1.253   1.080   1.812
  363   HG11  VAL  42          1HG1      VAL  42  -1.553  -0.951   3.191
  364   HG12  VAL  42          2HG1      VAL  42  -1.635   0.040   4.652
  365   HG13  VAL  42          3HG1      VAL  42  -0.136  -0.039   3.725
  366   HG21  VAL  42          1HG2      VAL  42  -3.664   1.304   3.648
  367   HG22  VAL  42          2HG2      VAL  42  -3.533   0.226   2.252
  368   HG23  VAL  42          3HG2      VAL  42  -3.524   1.978   2.018
  369    H    GLU  43           H        GLU  43   0.448   2.811   5.350
  370    HA   GLU  43           HA       GLU  43   2.906   2.945   3.761
  371    HB2  GLU  43          2HB       GLU  43   2.429   3.137   6.774
  372    HB3  GLU  43          3HB       GLU  43   3.980   3.409   5.974
  373    HG2  GLU  43          2HG       GLU  43   2.999   5.339   4.752
  374    HG3  GLU  43          3HG       GLU  43   1.453   5.064   5.552
  375    H    LEU  44           H        LEU  44   3.977   1.088   3.284
  376    HA   LEU  44           HA       LEU  44   3.710  -1.264   5.071
  377    HB2  LEU  44          2HB       LEU  44   4.177  -1.538   2.089
  378    HB3  LEU  44          3HB       LEU  44   3.753  -2.781   3.249
  379    HG   LEU  44           HG       LEU  44   1.479  -1.398   3.450
  380   HD11  LEU  44          1HD1      LEU  44   2.415  -0.575   0.687
  381   HD12  LEU  44          2HD1      LEU  44   2.169   0.498   2.069
  382   HD13  LEU  44          3HD1      LEU  44   0.793  -0.336   1.350
  383   HD21  LEU  44          1HD2      LEU  44   1.601  -3.708   2.652
  384   HD22  LEU  44          2HD2      LEU  44   2.066  -3.149   1.044
  385   HD23  LEU  44          3HD2      LEU  44   0.463  -2.771   1.686
  386    H    GLU  45           H        GLU  45   5.521  -2.851   4.595
  387    HA   GLU  45           HA       GLU  45   8.131  -1.449   4.533
  388    HB2  GLU  45          2HB       GLU  45   7.478  -2.058   6.824
  389    HB3  GLU  45          3HB       GLU  45   7.087  -3.698   6.321
  390    HG2  GLU  45          2HG       GLU  45   9.543  -4.022   5.777
  391    HG3  GLU  45          3HG       GLU  45   9.846  -2.448   6.514
  392    H    LEU  46           H        LEU  46   8.857  -2.043   2.517
  393    HA   LEU  46           HA       LEU  46   8.977  -4.932   1.820
  394    HB2  LEU  46          2HB       LEU  46   7.907  -3.415   0.142
  395    HB3  LEU  46          3HB       LEU  46   9.379  -2.477   0.048
  396    HG   LEU  46           HG       LEU  46   9.264  -5.415  -0.785
  397   HD11  LEU  46          1HD1      LEU  46   9.060  -4.643  -3.110
  398   HD12  LEU  46          2HD1      LEU  46   8.890  -2.977  -2.546
  399   HD13  LEU  46          3HD1      LEU  46   7.665  -4.179  -2.143
  400   HD21  LEU  46          1HD2      LEU  46  11.257  -4.877  -2.148
  401   HD22  LEU  46          2HD2      LEU  46  11.550  -4.600  -0.437
  402   HD23  LEU  46          3HD2      LEU  46  11.252  -3.229  -1.505
  403    H    ARG  47           H        ARG  47  10.991  -5.880   1.735
  404    HA   ARG  47           HA       ARG  47  13.172  -4.236   2.870
  405    HB2  ARG  47          2HB       ARG  47  12.769  -7.260   2.853
  406    HB3  ARG  47          3HB       ARG  47  14.118  -6.412   3.619
  407    HG2  ARG  47          2HG       ARG  47  12.567  -5.278   5.161
  408    HG3  ARG  47          3HG       ARG  47  11.186  -6.040   4.367
  409    HD2  ARG  47          2HD       ARG  47  11.997  -8.254   5.095
  410    HD3  ARG  47          3HD       ARG  47  13.384  -7.488   5.878
  411    HE   ARG  47           HE       ARG  47  10.791  -6.529   6.762
  412   HH11  ARG  47          1HH1      ARG  47  13.332  -8.891   7.378
  413   HH12  ARG  47          2HH1      ARG  47  12.854  -9.157   9.023
  414   HH21  ARG  47          1HH2      ARG  47  10.185  -6.867   8.915
  415   HH22  ARG  47          2HH2      ARG  47  11.062  -8.003   9.897
  416    H    THR  48           H        THR  48  14.161  -3.332   1.210
  417    HA   THR  48           HA       THR  48  14.746  -4.740  -1.290
  418    HB   THR  48           HB       THR  48  15.328  -1.840  -0.512
  419    HG1  THR  48           HG1      THR  48  13.023  -2.602  -0.593
  420   HG21  THR  48          1HG2      THR  48  15.216  -3.182  -3.244
  421   HG22  THR  48          2HG2      THR  48  16.684  -2.620  -2.435
  422   HG23  THR  48          3HG2      THR  48  15.457  -1.461  -2.959
  423    H    ASN  49           H        ASN  49  16.605  -5.856  -1.435
  424    HA   ASN  49           HA       ASN  49  18.712  -6.627  -1.219
  425    HB2  ASN  49          2HB       ASN  49  19.344  -3.728  -0.477
  426    HB3  ASN  49          3HB       ASN  49  20.567  -4.955  -0.801
  427   HD21  ASN  49          1HD2      ASN  49  21.386  -3.681  -2.501
  428   HD22  ASN  49          2HD2      ASN  49  20.591  -3.593  -4.031
  429    H    GLY  50           H        GLY  50  16.795  -6.449   1.128
  430    HA2  GLY  50          2HA       GLY  50  16.941  -7.543   3.206
  431    HA3  GLY  50          3HA       GLY  50  18.662  -7.206   3.281
  432    H    LYS  51           H        LYS  51  17.789  -4.318   2.410
  433    HA   LYS  51           HA       LYS  51  17.678  -3.176   5.067
  434    HB2  LYS  51          2HB       LYS  51  17.532  -1.906   2.297
  435    HB3  LYS  51          3HB       LYS  51  17.627  -1.000   3.806
  436    HG2  LYS  51          2HG       LYS  51  19.856  -1.753   4.230
  437    HG3  LYS  51          3HG       LYS  51  19.773  -2.953   2.931
  438    HD2  LYS  51          2HD       LYS  51  21.069  -0.926   2.267
  439    HD3  LYS  51          3HD       LYS  51  19.666  -1.195   1.239
  440    HE2  LYS  51          2HE       LYS  51  18.427   0.548   2.556
  441    HE3  LYS  51          3HE       LYS  51  19.896   0.842   3.488
  442    HZ1  LYS  51          1HZ       LYS  51  21.000   1.611   1.535
  443    HZ2  LYS  51          2HZ       LYS  51  19.508   2.414   1.621
  444    HZ3  LYS  51          3HZ       LYS  51  19.717   1.127   0.540
  445    H    LYS  52           H        LYS  52  15.945  -2.051   5.981
  446    HA   LYS  52           HA       LYS  52  13.273  -2.585   5.021
  447    HB2  LYS  52          2HB       LYS  52  13.656  -2.623   7.423
  448    HB3  LYS  52          3HB       LYS  52  14.329  -0.994   7.398
  449    HG2  LYS  52          2HG       LYS  52  12.074  -0.130   6.703
  450    HG3  LYS  52          3HG       LYS  52  11.436  -1.768   6.884
  451    HD2  LYS  52          2HD       LYS  52  12.067  -1.738   9.282
  452    HD3  LYS  52          3HD       LYS  52  12.708  -0.102   9.093
  453    HE2  LYS  52          2HE       LYS  52  10.458   0.718   8.531
  454    HE3  LYS  52          3HE       LYS  52   9.813  -0.921   8.687
  455    HZ1  LYS  52          1HZ       LYS  52  11.112   0.624  10.857
  456    HZ2  LYS  52          2HZ       LYS  52  10.438  -0.920  11.002
  457    HZ3  LYS  52          3HZ       LYS  52   9.446   0.410  10.673
  458    H    GLU  53           H        GLU  53  12.671  -1.467   3.267
  459    HA   GLU  53           HA       GLU  53  12.870   1.501   3.249
  460    HB2  GLU  53          2HB       GLU  53  12.340  -0.418   0.923
  461    HB3  GLU  53          3HB       GLU  53  12.421   1.339   0.804
  462    HG2  GLU  53          2HG       GLU  53  14.709  -0.511   1.550
  463    HG3  GLU  53          3HG       GLU  53  14.470   0.244  -0.023
  464    H    ASN  54           H        ASN  54  11.018   2.438   3.901
  465    HA   ASN  54           HA       ASN  54   8.472   0.986   3.880
  466    HB2  ASN  54          2HB       ASN  54   9.158   3.763   4.946
  467    HB3  ASN  54          3HB       ASN  54   7.585   2.982   5.099
  468   HD21  ASN  54          1HD2      ASN  54  10.891   2.997   6.214
  469   HD22  ASN  54          2HD2      ASN  54  10.646   1.960   7.564
  470    H    TYR  55           H        TYR  55   6.854   1.341   2.441
  471    HA   TYR  55           HA       TYR  55   7.052   3.614   0.529
  472    HB2  TYR  55          2HB       TYR  55   6.022   0.796  -0.061
  473    HB3  TYR  55          3HB       TYR  55   6.035   2.141  -1.192
  474    HD1  TYR  55           HD1      TYR  55   8.034   2.626  -2.496
  475    HD2  TYR  55           HD2      TYR  55   8.222  -0.215   0.688
  476    HE1  TYR  55           HE1      TYR  55  10.261   1.894  -3.255
  477    HE2  TYR  55           HE2      TYR  55  10.428  -0.927  -0.073
  478    HH   TYR  55           HH       TYR  55  11.838  -0.911  -1.937
  479    H    THR  56           H        THR  56   5.389   4.958   0.886
  480    HA   THR  56           HA       THR  56   2.855   4.090   2.009
  481    HB   THR  56           HB       THR  56   3.686   6.858   1.013
  482    HG1  THR  56           HG1      THR  56   4.272   5.474   3.355
  483   HG21  THR  56          1HG2      THR  56   1.884   7.684   2.501
  484   HG22  THR  56          2HG2      THR  56   1.443   6.023   2.900
  485   HG23  THR  56          3HG2      THR  56   1.233   6.616   1.251
  486    H    VAL  57           H        VAL  57   1.757   2.900   0.512
  487    HA   VAL  57           HA       VAL  57   1.478   3.779  -2.269
  488    HB   VAL  57           HB       VAL  57   0.268   1.311  -0.919
  489   HG11  VAL  57          1HG1      VAL  57  -0.053   0.469  -3.231
  490   HG12  VAL  57          2HG1      VAL  57   0.580   1.987  -3.876
  491   HG13  VAL  57          3HG1      VAL  57  -0.936   1.976  -2.970
  492   HG21  VAL  57          1HG2      VAL  57   2.809   1.492  -2.584
  493   HG22  VAL  57          2HG2      VAL  57   2.076   0.004  -1.975
  494   HG23  VAL  57          3HG2      VAL  57   2.730   1.191  -0.845
  495    H    GLU  58           H        GLU  58   0.131   5.396  -2.424
  496    HA   GLU  58           HA       GLU  58  -2.185   5.855  -0.758
  497    HB2  GLU  58          2HB       GLU  58  -1.272   7.343  -3.271
  498    HB3  GLU  58          3HB       GLU  58  -2.394   7.937  -2.044
  499    HG2  GLU  58          2HG       GLU  58  -0.535   7.934  -0.378
  500    HG3  GLU  58          3HG       GLU  58   0.568   7.373  -1.634
  501    H    VAL  59           H        VAL  59  -3.856   4.478  -1.169
  502    HA   VAL  59           HA       VAL  59  -4.781   4.047  -3.965
  503    HB   VAL  59           HB       VAL  59  -5.500   2.352  -1.524
  504   HG11  VAL  59          1HG1      VAL  59  -7.088   2.209  -3.397
  505   HG12  VAL  59          2HG1      VAL  59  -6.234   0.679  -3.177
  506   HG13  VAL  59          3HG1      VAL  59  -5.774   1.768  -4.490
  507   HG21  VAL  59          1HG2      VAL  59  -3.866   0.654  -2.292
  508   HG22  VAL  59          2HG2      VAL  59  -3.062   2.165  -1.857
  509   HG23  VAL  59          3HG2      VAL  59  -3.313   1.756  -3.559
  510    H    GLU  60           H        GLU  60  -6.921   4.707  -4.449
  511    HA   GLU  60           HA       GLU  60  -8.444   6.076  -2.308
  512    HB2  GLU  60          2HB       GLU  60  -7.331   7.701  -3.797
  513    HB3  GLU  60          3HB       GLU  60  -8.077   6.946  -5.209
  514    HG2  GLU  60          2HG       GLU  60 -10.332   7.558  -4.294
  515    HG3  GLU  60          3HG       GLU  60  -9.533   8.385  -2.956
  516    H    ARG  61           H        ARG  61 -10.640   5.818  -2.301
  517    HA   ARG  61           HA       ARG  61 -11.881   3.717  -3.854
  518    HB2  ARG  61          2HB       ARG  61 -12.391   4.146  -1.430
  519    HB3  ARG  61          3HB       ARG  61 -13.124   5.682  -1.862
  520    HG2  ARG  61          2HG       ARG  61 -14.852   4.024  -1.471
  521    HG3  ARG  61          3HG       ARG  61 -14.849   4.469  -3.177
  522    HD2  ARG  61          2HD       ARG  61 -14.592   2.287  -3.769
  523    HD3  ARG  61          3HD       ARG  61 -13.102   2.171  -2.846
  524    HE   ARG  61           HE       ARG  61 -14.213   0.950  -1.292
  525   HH11  ARG  61          1HH1      ARG  61 -16.667   2.786  -3.017
  526   HH12  ARG  61          2HH1      ARG  61 -17.988   2.019  -2.203
  527   HH21  ARG  61          1HH2      ARG  61 -16.003  -0.068  -0.253
  528   HH22  ARG  61          2HH2      ARG  61 -17.620   0.417  -0.653
  529    H    GLN  62           H        GLN  62 -12.497   4.163  -5.888
  530    HA   GLN  62           HA       GLN  62 -14.021   6.642  -6.490
  531    HB2  GLN  62          2HB       GLN  62 -12.265   4.988  -8.385
  532    HB3  GLN  62          3HB       GLN  62 -13.281   6.336  -8.883
  533    HG2  GLN  62          2HG       GLN  62 -11.955   7.841  -7.383
  534    HG3  GLN  62          3HG       GLN  62 -10.885   6.489  -7.016
  535   HE21  GLN  62          1HE2      GLN  62 -10.125   8.982  -8.155
  536   HE22  GLN  62          2HE2      GLN  62  -9.477   8.671  -9.728
  537    H    GLY  63           H        GLY  63 -16.104   5.996  -6.313
  538    HA2  GLY  63          2HA       GLY  63 -18.060   4.839  -6.653
  539    HA3  GLY  63          3HA       GLY  63 -17.244   3.884  -7.884
  540    H    ASN  64           H        ASN  64 -16.575   1.856  -7.372
  541    HA   ASN  64           HA       ASN  64 -16.349   1.038  -4.524
  542    HB2  ASN  64          2HB       ASN  64 -17.229  -0.681  -6.893
  543    HB3  ASN  64          3HB       ASN  64 -16.900  -1.299  -5.278
  544   HD21  ASN  64          1HD2      ASN  64 -18.176   0.961  -3.885
  545   HD22  ASN  64          2HD2      ASN  64 -19.871   0.766  -4.122
  546    H    THR  65           H        THR  65 -14.803   1.402  -7.580
  547    HA   THR  65           HA       THR  65 -12.852  -0.709  -7.292
  548    HB   THR  65           HB       THR  65 -11.762   0.340  -9.304
  549    HG1  THR  65           HG1      THR  65 -12.940   2.524  -8.579
  550   HG21  THR  65          1HG2      THR  65 -14.767  -0.044  -9.602
  551   HG22  THR  65          2HG2      THR  65 -13.557  -1.332  -9.635
  552   HG23  THR  65          3HG2      THR  65 -13.587  -0.105 -10.906
  553    H    TRP  66           H        TRP  66 -10.805  -0.591  -6.510
  554    HA   TRP  66           HA       TRP  66  -9.892   1.856  -5.151
  555    HB2  TRP  66          2HB       TRP  66  -9.081  -1.081  -4.938
  556    HB3  TRP  66          3HB       TRP  66  -8.187   0.213  -4.141
  557    HD1  TRP  66           HD1      TRP  66 -11.236  -1.953  -3.650
  558    HE1  TRP  66           HE1      TRP  66 -12.476  -1.222  -1.509
  559    HE3  TRP  66           HE3      TRP  66  -8.774   2.443  -2.726
  560    HZ2  TRP  66           HZ2      TRP  66 -12.423   0.943   0.303
  561    HZ3  TRP  66           HZ3      TRP  66  -9.436   3.786  -0.772
  562    HH2  TRP  66           HH2      TRP  66 -11.234   3.046   0.714
  563    H    THR  67           H        THR  67  -8.664   3.163  -6.316
  564    HA   THR  67           HA       THR  67  -6.923   2.116  -8.466
  565    HB   THR  67           HB       THR  67  -8.773   3.827  -9.006
  566    HG1  THR  67           HG1      THR  67  -7.185   3.579 -10.500
  567   HG21  THR  67          1HG2      THR  67  -8.284   6.216  -8.588
  568   HG22  THR  67          2HG2      THR  67  -6.877   5.775  -7.624
  569   HG23  THR  67          3HG2      THR  67  -8.490   5.343  -7.060
  570    H    VAL  68           H        VAL  68  -4.698   2.514  -8.395
  571    HA   VAL  68           HA       VAL  68  -3.609   3.638  -5.914
  572    HB   VAL  68           HB       VAL  68  -2.128   2.301  -8.223
  573   HG11  VAL  68          1HG1      VAL  68  -0.231   2.108  -6.633
  574   HG12  VAL  68          2HG1      VAL  68  -1.147   3.008  -5.420
  575   HG13  VAL  68          3HG1      VAL  68  -0.648   3.801  -6.916
  576   HG21  VAL  68          1HG2      VAL  68  -3.701   0.757  -7.116
  577   HG22  VAL  68          2HG2      VAL  68  -3.006   1.156  -5.541
  578   HG23  VAL  68          3HG2      VAL  68  -2.031   0.320  -6.751
  579    H    LYS  69           H        LYS  69  -3.236   5.709  -5.806
  580    HA   LYS  69           HA       LYS  69  -2.926   7.548  -7.959
  581    HB2  LYS  69          2HB       LYS  69  -2.400   7.799  -4.962
  582    HB3  LYS  69          3HB       LYS  69  -2.329   9.160  -6.080
  583    HG2  LYS  69          2HG       LYS  69  -4.798   7.468  -5.567
  584    HG3  LYS  69          3HG       LYS  69  -4.454   9.023  -4.793
  585    HD2  LYS  69          2HD       LYS  69  -4.438  10.107  -7.059
  586    HD3  LYS  69          3HD       LYS  69  -4.865   8.551  -7.783
  587    HE2  LYS  69          2HE       LYS  69  -6.982   8.534  -6.599
  588    HE3  LYS  69          3HE       LYS  69  -6.542   9.988  -5.707
  589    HZ1  LYS  69          1HZ       LYS  69  -8.022  10.546  -7.460
  590    HZ2  LYS  69          2HZ       LYS  69  -7.057   9.787  -8.612
  591    HZ3  LYS  69          3HZ       LYS  69  -6.502  11.180  -7.844
  592    H    ARG  70           H        ARG  70  -0.657   6.387  -5.453
  593    HA   ARG  70           HA       ARG  70   1.651   6.516  -7.158
  594    HB2  ARG  70          2HB       ARG  70   0.925   8.930  -5.661
  595    HB3  ARG  70          3HB       ARG  70   2.436   8.318  -5.016
  596    HG2  ARG  70          2HG       ARG  70   1.911   9.012  -7.926
  597    HG3  ARG  70          3HG       ARG  70   2.785  10.013  -6.761
  598    HD2  ARG  70          2HD       ARG  70   4.480   8.187  -6.529
  599    HD3  ARG  70          3HD       ARG  70   3.627   7.267  -7.778
  600    HE   ARG  70           HE       ARG  70   4.288   9.895  -8.685
  601   HH11  ARG  70          1HH1      ARG  70   5.751   6.727  -8.183
  602   HH12  ARG  70          2HH1      ARG  70   6.980   6.975  -9.374
  603   HH21  ARG  70          1HH2      ARG  70   5.902  10.191 -10.239
  604   HH22  ARG  70          2HH2      ARG  70   7.062   8.943 -10.542
  605    H    ILE  71           H        ILE  71   3.046   5.005  -6.449
  606    HA   ILE  71           HA       ILE  71   3.109   4.190  -3.632
  607    HB   ILE  71           HB       ILE  71   4.910   3.280  -5.937
  608   HG12  ILE  71          2HG1      ILE  71   2.499   1.780  -4.807
  609   HG13  ILE  71          3HG1      ILE  71   2.442   2.732  -6.288
  610   HG21  ILE  71          1HG2      ILE  71   5.934   2.899  -3.761
  611   HG22  ILE  71          2HG2      ILE  71   5.392   1.356  -4.404
  612   HG23  ILE  71          3HG2      ILE  71   4.458   2.155  -3.149
  613   HD11  ILE  71          1HD1      ILE  71   2.694   0.442  -6.862
  614   HD12  ILE  71          2HD1      ILE  71   4.074   0.246  -5.785
  615   HD13  ILE  71          3HD1      ILE  71   4.214   1.250  -7.233
  616    H    THR  72           H        THR  72   4.099   5.713  -2.432
  617    HA   THR  72           HA       THR  72   6.361   7.268  -3.489
  618    HB   THR  72           HB       THR  72   4.669   7.773  -0.990
  619    HG1  THR  72           HG1      THR  72   3.267   8.670  -2.281
  620   HG21  THR  72          1HG2      THR  72   5.603  10.062  -1.116
  621   HG22  THR  72          2HG2      THR  72   6.591   9.597  -2.503
  622   HG23  THR  72          3HG2      THR  72   6.893   8.874  -0.919
  623    H    ARG  73           H        ARG  73   8.223   6.159  -3.087
  624    HA   ARG  73           HA       ARG  73   8.811   4.638  -0.747
  625    HB2  ARG  73          2HB       ARG  73  10.103   4.389  -2.860
  626    HB3  ARG  73          3HB       ARG  73  10.681   6.046  -2.713
  627    HG2  ARG  73          2HG       ARG  73  11.861   5.394  -0.584
  628    HG3  ARG  73          3HG       ARG  73  11.361   3.724  -0.861
  629    HD2  ARG  73          2HD       ARG  73  12.674   3.628  -2.903
  630    HD3  ARG  73          3HD       ARG  73  13.049   5.351  -2.789
  631    HE   ARG  73           HE       ARG  73  13.916   3.916  -0.466
  632   HH11  ARG  73          1HH1      ARG  73  14.845   4.582  -3.796
  633   HH12  ARG  73          2HH1      ARG  73  16.532   4.334  -3.501
  634   HH21  ARG  73          1HH2      ARG  73  16.135   3.602  -0.094
  635   HH22  ARG  73          2HH2      ARG  73  17.267   3.776  -1.398
  636    H    THR  74           H        THR  74   9.656   5.306   1.189
  637    HA   THR  74           HA       THR  74   9.488   7.942   2.131
  638    HB   THR  74           HB       THR  74   9.431   5.966   3.635
  639    HG1  THR  74           HG1      THR  74  10.486   6.970   5.298
  640   HG21  THR  74          1HG2      THR  74  11.198   4.575   2.623
  641   HG22  THR  74          2HG2      THR  74  11.522   4.842   4.339
  642   HG23  THR  74          3HG2      THR  74  12.420   5.749   3.119
  643    H    VAL  75           H        VAL  75  11.233   9.378   2.842
  644    HA   VAL  75           HA       VAL  75  13.231   9.860   0.907
  645    HB   VAL  75           HB       VAL  75  13.104  10.881   3.790
  646   HG11  VAL  75          1HG1      VAL  75  15.365  11.173   2.848
  647   HG12  VAL  75          2HG1      VAL  75  14.560  12.733   3.015
  648   HG13  VAL  75          3HG1      VAL  75  14.689  11.975   1.425
  649   HG21  VAL  75          1HG2      VAL  75  12.068  12.168   1.229
  650   HG22  VAL  75          2HG2      VAL  75  12.052  12.900   2.836
  651   HG23  VAL  75          3HG2      VAL  75  11.075  11.467   2.513
  652    H    GLY  76           H        GLY  76  14.602   8.225   0.546
  653    HA2  GLY  76          2HA       GLY  76  15.998   6.829   2.741
  654    HA3  GLY  76          3HA       GLY  76  15.936   6.351   1.042
  655    H    SER  77           H        SER  77  18.102   6.235   0.641
  656    HA   SER  77           HA       SER  77  19.479   8.751   0.176
  657    HB2  SER  77          2HB       SER  77  20.150   8.152   2.531
  658    HB3  SER  77          3HB       SER  77  20.758   6.603   1.952
  659    HG   SER  77           HG       SER  77  21.670   9.086   0.932
  660    H    LEU  78           H        LEU  78  21.387   8.390  -1.218
  661    HA   LEU  78           HA       LEU  78  21.065   6.479  -3.226
  662    HB2  LEU  78          2HB       LEU  78  23.391   7.127  -3.934
  663    HB3  LEU  78          3HB       LEU  78  22.275   8.458  -3.732
  664    HG   LEU  78           HG       LEU  78  23.439   8.753  -1.360
  665   HD11  LEU  78          1HD1      LEU  78  25.638   7.263  -2.820
  666   HD12  LEU  78          2HD1      LEU  78  24.803   6.731  -1.362
  667   HD13  LEU  78          3HD1      LEU  78  25.827   8.162  -1.310
  668   HD21  LEU  78          1HD2      LEU  78  23.555  10.435  -3.130
  669   HD22  LEU  78          2HD2      LEU  78  24.877   9.560  -3.906
  670   HD23  LEU  78          3HD2      LEU  78  25.108  10.283  -2.310
  671    H    GLU  79           H        GLU  79  21.952   4.446  -3.562
  672    HA   GLU  79           HA       GLU  79  22.558   2.953  -1.155
  673    HB2  GLU  79          2HB       GLU  79  21.032   2.119  -3.001
  674    HB3  GLU  79          3HB       GLU  79  22.435   1.968  -4.049
  675    HG2  GLU  79          2HG       GLU  79  21.859  -0.211  -3.147
  676    HG3  GLU  79          3HG       GLU  79  23.411   0.299  -2.476
  677    H    HIS  80           H        HIS  80  24.487   1.788  -0.743
  678    HA   HIS  80           HA       HIS  80  26.978   2.869  -1.628
  679    HB2  HIS  80          2HB       HIS  80  26.445   0.162  -0.291
  680    HB3  HIS  80          3HB       HIS  80  28.023   0.930  -0.434
  681    HD1  HIS  80           HD1      HIS  80  28.540   2.887   1.156
  682    HD2  HIS  80           HD2      HIS  80  24.763   1.248   1.706
  683    HE1  HIS  80           HE1      HIS  80  27.728   3.781   3.353
  684    HE2  HIS  80           HE2      HIS  80  25.394   2.890   3.579
  685    H    HIS  81           H        HIS  81  27.624   2.696  -3.696
  686    HA   HIS  81           HA       HIS  81  26.284   1.082  -5.553
  687    HB2  HIS  81          2HB       HIS  81  27.923   1.955  -7.237
  688    HB3  HIS  81          3HB       HIS  81  27.134   3.201  -6.287
  689    HD1  HIS  81           HD1      HIS  81  28.600   4.584  -4.679
  690    HD2  HIS  81           HD2      HIS  81  30.740   1.845  -6.944
  691    HE1  HIS  81           HE1      HIS  81  30.997   5.243  -4.437
  692    HE2  HIS  81           HE2      HIS  81  32.280   3.468  -5.668
  693    H    HIS  82           H        HIS  82  26.462  -0.996  -5.890
  694    HA   HIS  82           HA       HIS  82  28.845  -2.550  -5.350
  695    HB2  HIS  82          2HB       HIS  82  27.553  -4.479  -6.155
  696    HB3  HIS  82          3HB       HIS  82  26.626  -3.561  -4.986
  697    HD1  HIS  82           HD1      HIS  82  24.435  -2.531  -5.763
  698    HD2  HIS  82           HD2      HIS  82  26.497  -4.451  -8.817
  699    HE1  HIS  82           HE1      HIS  82  22.805  -2.722  -7.660
  700    HE2  HIS  82           HE2      HIS  82  24.025  -4.043  -9.421
  701    H    HIS  83           H        HIS  83  27.736  -0.641  -7.922
  702    HA   HIS  83           HA       HIS  83  29.018  -1.642 -10.183
  703    HB2  HIS  83          2HB       HIS  83  27.559   0.308 -10.352
  704    HB3  HIS  83          3HB       HIS  83  28.573   1.229  -9.249
  705    HD1  HIS  83           HD1      HIS  83  28.777  -0.296 -12.729
  706    HD2  HIS  83           HD2      HIS  83  30.419   2.803 -10.515
  707    HE1  HIS  83           HE1      HIS  83  30.256   0.955 -14.316
  708    HE2  HIS  83           HE2      HIS  83  31.123   2.902 -12.984
  709    H    HIS  84           H        HIS  84  31.048  -2.332 -10.237
  710    HA   HIS  84           HA       HIS  84  33.228  -0.727  -9.064
  711    HB2  HIS  84          2HB       HIS  84  32.748  -3.714  -8.650
  712    HB3  HIS  84          3HB       HIS  84  34.298  -2.941  -8.337
  713    HD1  HIS  84           HD1      HIS  84  31.528  -4.046  -6.501
  714    HD2  HIS  84           HD2      HIS  84  33.712  -0.515  -6.476
  715    HE1  HIS  84           HE1      HIS  84  31.069  -2.984  -4.274
  716    HE2  HIS  84           HE2      HIS  84  32.525  -0.929  -4.236
  717    H    HIS  85           H        HIS  85  34.143  -0.018 -10.854
  718    HA   HIS  85           HA       HIS  85  35.639  -1.842 -12.513
  719    HB2  HIS  85          2HB       HIS  85  33.444  -1.706 -13.755
  720    HB3  HIS  85          3HB       HIS  85  33.615   0.041 -13.860
  721    HD1  HIS  85           HD1      HIS  85  34.859  -3.161 -15.343
  722    HD2  HIS  85           HD2      HIS  85  35.481   0.918 -15.828
  723    HE1  HIS  85           HE1      HIS  85  36.132  -2.921 -17.488
  724    HE2  HIS  85           HE2      HIS  85  36.671  -0.471 -17.633
  Start of MODEL    7
    1    H1   MET   1          1H        MET   1 -21.467  -7.210   6.784
    2    H2   MET   1          2H        MET   1 -21.220  -6.140   5.502
    3    H3   MET   1          3H        MET   1 -22.212  -5.695   6.793
    4    HA   MET   1           HA       MET   1 -20.359  -5.736   8.302
    5    HB2  MET   1          2HB       MET   1 -18.066  -6.041   7.505
    6    HB3  MET   1          3HB       MET   1 -19.017  -7.454   7.084
    7    HG2  MET   1          2HG       MET   1 -18.180  -5.239   5.188
    8    HG3  MET   1          3HG       MET   1 -17.491  -6.861   5.274
    9    HE1  MET   1          1HE       MET   1 -17.855  -7.143   2.645
   10    HE2  MET   1          2HE       MET   1 -18.556  -5.525   2.558
   11    HE3  MET   1          3HE       MET   1 -19.408  -6.893   1.845
   12    HA   PRO   2           HA       PRO   2 -20.067  -1.302   7.205
   13    HB2  PRO   2          2HB       PRO   2 -17.568  -1.446   8.922
   14    HB3  PRO   2          3HB       PRO   2 -18.903  -0.272   8.974
   15    HG2  PRO   2          2HG       PRO   2 -18.748  -2.149  10.831
   16    HG3  PRO   2          3HG       PRO   2 -20.330  -1.734  10.126
   17    HD2  PRO   2          2HD       PRO   2 -18.572  -4.117   9.539
   18    HD3  PRO   2          3HD       PRO   2 -20.342  -4.034   9.703
   19    H    SER   3           H        SER   3 -19.293  -0.753   5.229
   20    HA   SER   3           HA       SER   3 -17.214  -2.043   3.856
   21    HB2  SER   3          2HB       SER   3 -19.089  -0.794   2.763
   22    HB3  SER   3          3HB       SER   3 -18.360   0.729   3.278
   23    HG   SER   3           HG       SER   3 -17.102   0.588   1.601
   24    H    GLU   4           H        GLU   4 -17.211   0.655   6.067
   25    HA   GLU   4           HA       GLU   4 -14.803   1.934   5.720
   26    HB2  GLU   4          2HB       GLU   4 -16.506   2.534   7.413
   27    HB3  GLU   4          3HB       GLU   4 -16.151   1.073   8.321
   28    HG2  GLU   4          2HG       GLU   4 -15.121   2.898   9.476
   29    HG3  GLU   4          3HG       GLU   4 -13.834   1.958   8.724
   30    H    GLU   5           H        GLU   5 -15.373  -1.104   7.522
   31    HA   GLU   5           HA       GLU   5 -12.596  -1.605   8.123
   32    HB2  GLU   5          2HB       GLU   5 -15.050  -3.417   8.237
   33    HB3  GLU   5          3HB       GLU   5 -13.456  -3.860   8.851
   34    HG2  GLU   5          2HG       GLU   5 -13.562  -2.046  10.502
   35    HG3  GLU   5          3HG       GLU   5 -15.126  -1.538   9.858
   36    H    GLU   6           H        GLU   6 -14.919  -2.664   5.701
   37    HA   GLU   6           HA       GLU   6 -13.407  -4.772   4.581
   38    HB2  GLU   6          2HB       GLU   6 -15.925  -4.399   4.402
   39    HB3  GLU   6          3HB       GLU   6 -15.593  -3.158   3.199
   40    HG2  GLU   6          2HG       GLU   6 -16.223  -5.319   2.184
   41    HG3  GLU   6          3HG       GLU   6 -14.609  -4.793   1.704
   42    H    GLU   7           H        GLU   7 -13.328  -1.309   4.139
   43    HA   GLU   7           HA       GLU   7 -12.109  -0.889   1.701
   44    HB2  GLU   7          2HB       GLU   7 -11.508   0.458   4.368
   45    HB3  GLU   7          3HB       GLU   7 -10.870   1.026   2.833
   46    HG2  GLU   7          2HG       GLU   7 -13.141   1.510   2.048
   47    HG3  GLU   7          3HG       GLU   7 -13.798   0.910   3.564
   48    H    LYS   8           H        LYS   8 -10.376  -1.343   4.807
   49    HA   LYS   8           HA       LYS   8  -7.822  -1.307   3.579
   50    HB2  LYS   8          2HB       LYS   8  -8.598  -2.195   6.392
   51    HB3  LYS   8          3HB       LYS   8  -6.947  -1.954   5.837
   52    HG2  LYS   8          2HG       LYS   8  -7.439  -0.006   7.044
   53    HG3  LYS   8          3HG       LYS   8  -7.619   0.484   5.359
   54    HD2  LYS   8          2HD       LYS   8 -10.080   0.296   5.566
   55    HD3  LYS   8          3HD       LYS   8  -9.906  -0.254   7.234
   56    HE2  LYS   8          2HE       LYS   8  -8.869   1.934   7.814
   57    HE3  LYS   8          3HE       LYS   8  -9.133   2.476   6.155
   58    HZ1  LYS   8          1HZ       LYS   8 -10.885   3.277   7.565
   59    HZ2  LYS   8          2HZ       LYS   8 -11.233   1.719   8.114
   60    HZ3  LYS   8          3HZ       LYS   8 -11.528   2.125   6.505
   61    H    ARG   9           H        ARG   9 -10.029  -3.902   4.390
   62    HA   ARG   9           HA       ARG   9  -8.306  -6.130   4.273
   63    HB2  ARG   9          2HB       ARG   9 -11.233  -5.935   3.433
   64    HB3  ARG   9          3HB       ARG   9 -10.359  -7.442   3.712
   65    HG2  ARG   9          2HG       ARG   9 -10.064  -6.882   6.074
   66    HG3  ARG   9          3HG       ARG   9 -10.835  -5.313   5.827
   67    HD2  ARG   9          2HD       ARG   9 -12.945  -6.483   5.194
   68    HD3  ARG   9          3HD       ARG   9 -12.166  -8.033   5.536
   69    HE   ARG   9           HE       ARG   9 -11.811  -6.803   7.864
   70   HH11  ARG   9          1HH1      ARG   9 -14.760  -6.928   5.914
   71   HH12  ARG   9          2HH1      ARG   9 -15.796  -6.810   7.303
   72   HH21  ARG   9          1HH2      ARG   9 -13.182  -6.699   9.642
   73   HH22  ARG   9          2HH2      ARG   9 -14.901  -6.681   9.414
   74    H    GLN  10           H        GLN  10 -10.047  -4.380   1.727
   75    HA   GLN  10           HA       GLN  10  -8.936  -5.876  -0.480
   76    HB2  GLN  10          2HB       GLN  10 -10.299  -3.147  -0.415
   77    HB3  GLN  10          3HB       GLN  10  -9.954  -4.077  -1.872
   78    HG2  GLN  10          2HG       GLN  10 -11.560  -5.772  -1.269
   79    HG3  GLN  10          3HG       GLN  10 -11.765  -5.084   0.345
   80   HE21  GLN  10          1HE2      GLN  10 -12.888  -3.126   0.573
   81   HE22  GLN  10          2HE2      GLN  10 -13.963  -2.548  -0.643
   82    H    VAL  11           H        VAL  11  -8.245  -2.683   1.029
   83    HA   VAL  11           HA       VAL  11  -6.670  -1.720  -1.117
   84    HB   VAL  11           HB       VAL  11  -6.809  -0.643   1.742
   85   HG11  VAL  11          1HG1      VAL  11  -6.070   1.508   0.770
   86   HG12  VAL  11          2HG1      VAL  11  -5.897   0.738  -0.809
   87   HG13  VAL  11          3HG1      VAL  11  -4.856   0.249   0.525
   88   HG21  VAL  11          1HG2      VAL  11  -8.491   0.926   0.893
   89   HG22  VAL  11          2HG2      VAL  11  -9.015  -0.737   0.642
   90   HG23  VAL  11          3HG2      VAL  11  -8.384   0.190  -0.710
   91    H    LYS  12           H        LYS  12  -5.715  -3.065   2.093
   92    HA   LYS  12           HA       LYS  12  -2.923  -2.587   1.796
   93    HB2  LYS  12          2HB       LYS  12  -4.190  -4.796   3.468
   94    HB3  LYS  12          3HB       LYS  12  -2.578  -4.111   3.664
   95    HG2  LYS  12          2HG       LYS  12  -3.657  -1.923   4.271
   96    HG3  LYS  12          3HG       LYS  12  -5.223  -2.734   4.227
   97    HD2  LYS  12          2HD       LYS  12  -2.907  -3.252   6.116
   98    HD3  LYS  12          3HD       LYS  12  -4.517  -2.664   6.523
   99    HE2  LYS  12          2HE       LYS  12  -3.836  -5.456   5.527
  100    HE3  LYS  12          3HE       LYS  12  -4.232  -5.013   7.183
  101    HZ1  LYS  12          1HZ       LYS  12  -6.431  -4.348   6.426
  102    HZ2  LYS  12          2HZ       LYS  12  -6.119  -5.971   6.094
  103    HZ3  LYS  12          3HZ       LYS  12  -6.056  -4.833   4.851
  104    H    GLN  13           H        GLN  13  -5.061  -5.171   0.818
  105    HA   GLN  13           HA       GLN  13  -3.080  -7.091   0.077
  106    HB2  GLN  13          2HB       GLN  13  -5.371  -7.781   0.599
  107    HB3  GLN  13          3HB       GLN  13  -6.018  -6.786  -0.697
  108    HG2  GLN  13          2HG       GLN  13  -4.854  -8.250  -2.348
  109    HG3  GLN  13          3HG       GLN  13  -4.296  -9.261  -1.017
  110   HE21  GLN  13          1HE2      GLN  13  -7.534  -7.824  -1.160
  111   HE22  GLN  13          2HE2      GLN  13  -8.369  -9.317  -1.373
  112    H    VAL  14           H        VAL  14  -4.950  -4.638  -1.741
  113    HA   VAL  14           HA       VAL  14  -3.820  -5.132  -4.303
  114    HB   VAL  14           HB       VAL  14  -5.028  -2.551  -3.173
  115   HG11  VAL  14          1HG1      VAL  14  -5.397  -1.848  -5.512
  116   HG12  VAL  14          2HG1      VAL  14  -4.536  -3.277  -6.088
  117   HG13  VAL  14          3HG1      VAL  14  -3.675  -2.042  -5.166
  118   HG21  VAL  14          1HG2      VAL  14  -7.111  -3.227  -4.320
  119   HG22  VAL  14          2HG2      VAL  14  -6.624  -4.426  -3.124
  120   HG23  VAL  14          3HG2      VAL  14  -6.345  -4.734  -4.838
  121    H    ALA  15           H        ALA  15  -2.900  -3.103  -1.580
  122    HA   ALA  15           HA       ALA  15  -0.906  -1.525  -2.818
  123    HB1  ALA  15          1HB       ALA  15  -2.092  -0.880  -0.755
  124    HB2  ALA  15          2HB       ALA  15  -0.341  -0.849  -0.532
  125    HB3  ALA  15          3HB       ALA  15  -1.297  -2.186   0.121
  126    H    LYS  16           H        LYS  16  -0.739  -4.514  -0.854
  127    HA   LYS  16           HA       LYS  16   2.100  -4.700  -0.829
  128    HB2  LYS  16          2HB       LYS  16   1.830  -6.940   0.083
  129    HB3  LYS  16          3HB       LYS  16   0.676  -5.867   0.853
  130    HG2  LYS  16          2HG       LYS  16  -1.127  -6.770  -0.500
  131    HG3  LYS  16          3HG       LYS  16  -0.003  -7.776  -1.404
  132    HD2  LYS  16          2HD       LYS  16  -0.582  -8.044   1.578
  133    HD3  LYS  16          3HD       LYS  16  -1.284  -9.046   0.307
  134    HE2  LYS  16          2HE       LYS  16   1.025  -9.802  -0.315
  135    HE3  LYS  16          3HE       LYS  16   1.656  -8.884   1.056
  136    HZ1  LYS  16          1HZ       LYS  16   1.354 -11.216   1.612
  137    HZ2  LYS  16          2HZ       LYS  16  -0.290 -11.128   1.235
  138    HZ3  LYS  16          3HZ       LYS  16   0.324 -10.249   2.538
  139    H    GLU  17           H        GLU  17  -0.422  -5.915  -3.005
  140    HA   GLU  17           HA       GLU  17   1.139  -7.637  -4.577
  141    HB2  GLU  17          2HB       GLU  17  -1.355  -6.024  -5.230
  142    HB3  GLU  17          3HB       GLU  17  -0.602  -7.088  -6.415
  143    HG2  GLU  17          2HG       GLU  17  -1.698  -7.938  -3.726
  144    HG3  GLU  17          3HG       GLU  17  -2.494  -8.162  -5.278
  145    H    LYS  18           H        LYS  18   0.490  -4.141  -4.928
  146    HA   LYS  18           HA       LYS  18   1.915  -3.813  -7.370
  147    HB2  LYS  18          2HB       LYS  18   1.312  -1.696  -5.267
  148    HB3  LYS  18          3HB       LYS  18   1.727  -1.405  -6.952
  149    HG2  LYS  18          2HG       LYS  18  -0.817  -2.600  -5.852
  150    HG3  LYS  18          3HG       LYS  18  -0.623  -1.073  -6.706
  151    HD2  LYS  18          2HD       LYS  18  -0.049  -2.331  -8.783
  152    HD3  LYS  18          3HD       LYS  18  -0.277  -3.853  -7.912
  153    HE2  LYS  18          2HE       LYS  18  -2.656  -3.193  -7.483
  154    HE3  LYS  18          3HE       LYS  18  -2.403  -1.752  -8.472
  155    HZ1  LYS  18          1HZ       LYS  18  -1.783  -3.305 -10.316
  156    HZ2  LYS  18          2HZ       LYS  18  -3.392  -3.389  -9.829
  157    HZ3  LYS  18          3HZ       LYS  18  -2.311  -4.585  -9.341
  158    H    LEU  19           H        LEU  19   2.871  -3.697  -3.987
  159    HA   LEU  19           HA       LEU  19   5.530  -2.730  -4.353
  160    HB2  LEU  19          2HB       LEU  19   4.169  -4.285  -2.127
  161    HB3  LEU  19          3HB       LEU  19   5.859  -3.817  -2.029
  162    HG   LEU  19           HG       LEU  19   3.475  -1.933  -2.182
  163   HD11  LEU  19          1HD1      LEU  19   3.804  -2.955   0.020
  164   HD12  LEU  19          2HD1      LEU  19   4.157  -1.230   0.053
  165   HD13  LEU  19          3HD1      LEU  19   5.481  -2.401   0.043
  166   HD21  LEU  19          1HD2      LEU  19   5.325  -1.005  -3.474
  167   HD22  LEU  19          2HD2      LEU  19   6.429  -1.251  -2.118
  168   HD23  LEU  19          3HD2      LEU  19   5.097  -0.101  -1.978
  169    H    LEU  20           H        LEU  20   4.091  -5.952  -4.361
  170    HA   LEU  20           HA       LEU  20   6.563  -7.400  -4.655
  171    HB2  LEU  20          2HB       LEU  20   3.645  -8.190  -5.038
  172    HB3  LEU  20          3HB       LEU  20   4.976  -9.330  -5.173
  173    HG   LEU  20           HG       LEU  20   4.499  -7.736  -2.619
  174   HD11  LEU  20          1HD1      LEU  20   2.439  -8.982  -3.059
  175   HD12  LEU  20          2HD1      LEU  20   3.296  -9.650  -1.673
  176   HD13  LEU  20          3HD1      LEU  20   3.356 -10.480  -3.231
  177   HD21  LEU  20          1HD2      LEU  20   6.007 -10.322  -3.130
  178   HD22  LEU  20          2HD2      LEU  20   5.811  -9.524  -1.565
  179   HD23  LEU  20          3HD2      LEU  20   6.720  -8.730  -2.848
  180    H    GLU  21           H        GLU  21   4.318  -5.808  -6.829
  181    HA   GLU  21           HA       GLU  21   5.222  -6.930  -9.296
  182    HB2  GLU  21          2HB       GLU  21   3.943  -4.222  -8.702
  183    HB3  GLU  21          3HB       GLU  21   4.248  -4.820 -10.329
  184    HG2  GLU  21          2HG       GLU  21   2.467  -6.223  -8.325
  185    HG3  GLU  21          3HG       GLU  21   1.878  -5.059  -9.500
  186    H    GLN  22           H        GLN  22   6.258  -4.209  -7.286
  187    HA   GLN  22           HA       GLN  22   8.323  -3.277  -9.062
  188    HB2  GLN  22          2HB       GLN  22   7.815  -2.730  -6.106
  189    HB3  GLN  22          3HB       GLN  22   9.065  -1.936  -7.058
  190    HG2  GLN  22          2HG       GLN  22   7.313  -0.988  -8.536
  191    HG3  GLN  22          3HG       GLN  22   6.077  -1.734  -7.524
  192   HE21  GLN  22          1HE2      GLN  22   7.452  -1.192  -4.997
  193   HE22  GLN  22          2HE2      GLN  22   7.314   0.505  -4.722
  194    H    SER  23           H        SER  23   8.193  -5.402  -6.214
  195    HA   SER  23           HA       SER  23  10.852  -6.457  -6.772
  196    HB2  SER  23          2HB       SER  23  11.272  -4.484  -5.288
  197    HB3  SER  23          3HB       SER  23  10.223  -5.196  -4.060
  198    HG   SER  23           HG       SER  23  11.904  -6.267  -3.430
  199    HA   PRO  24           HA       PRO  24   8.263  -9.919  -5.116
  200    HB2  PRO  24          2HB       PRO  24   8.957 -11.782  -6.950
  201    HB3  PRO  24          3HB       PRO  24   7.800 -10.494  -7.353
  202    HG2  PRO  24          2HG       PRO  24  10.721 -10.670  -8.031
  203    HG3  PRO  24          3HG       PRO  24   9.358 -10.174  -9.059
  204    HD2  PRO  24          2HD       PRO  24  11.027  -8.383  -7.757
  205    HD3  PRO  24          3HD       PRO  24   9.360  -8.013  -8.247
  206    H    ASN  25           H        ASN  25  11.503  -9.158  -5.287
  207    HA   ASN  25           HA       ASN  25  12.699 -11.590  -4.229
  208    HB2  ASN  25          2HB       ASN  25  13.771  -8.757  -4.637
  209    HB3  ASN  25          3HB       ASN  25  14.754 -10.113  -4.095
  210   HD21  ASN  25          1HD2      ASN  25  15.304 -11.735  -5.560
  211   HD22  ASN  25          2HD2      ASN  25  15.126 -11.538  -7.267
  212    H    SER  26           H        SER  26  10.738  -9.334  -2.855
  213    HA   SER  26           HA       SER  26  12.169  -9.221  -0.262
  214    HB2  SER  26          2HB       SER  26  11.211  -6.888  -0.067
  215    HB3  SER  26          3HB       SER  26  12.411  -7.078  -1.346
  216    HG   SER  26           HG       SER  26   9.641  -7.346  -1.872
  217    H    LYS  27           H        LYS  27  10.977  -9.570   1.541
  218    HA   LYS  27           HA       LYS  27   8.194 -10.295   1.437
  219    HB2  LYS  27          2HB       LYS  27   9.759 -11.333   3.049
  220    HB3  LYS  27          3HB       LYS  27  10.032  -9.773   3.811
  221    HG2  LYS  27          2HG       LYS  27   8.526 -11.035   5.203
  222    HG3  LYS  27          3HG       LYS  27   7.602  -9.726   4.462
  223    HD2  LYS  27          2HD       LYS  27   6.290 -11.787   4.418
  224    HD3  LYS  27          3HD       LYS  27   6.722 -11.339   2.766
  225    HE2  LYS  27          2HE       LYS  27   8.567 -13.005   2.819
  226    HE3  LYS  27          3HE       LYS  27   8.110 -13.451   4.462
  227    HZ1  LYS  27          1HZ       LYS  27   5.970 -14.175   3.613
  228    HZ2  LYS  27          2HZ       LYS  27   7.231 -15.005   2.863
  229    HZ3  LYS  27          3HZ       LYS  27   6.426 -13.772   2.041
  230    H    VAL  28           H        VAL  28   6.462  -9.035   1.903
  231    HA   VAL  28           HA       VAL  28   6.843  -6.190   2.665
  232    HB   VAL  28           HB       VAL  28   4.508  -7.475   1.151
  233   HG11  VAL  28          1HG1      VAL  28   5.081  -4.544   1.716
  234   HG12  VAL  28          2HG1      VAL  28   3.807  -5.516   2.456
  235   HG13  VAL  28          3HG1      VAL  28   3.754  -5.162   0.729
  236   HG21  VAL  28          1HG2      VAL  28   5.345  -6.301  -0.863
  237   HG22  VAL  28          2HG2      VAL  28   6.530  -7.460  -0.254
  238   HG23  VAL  28          3HG2      VAL  28   6.749  -5.734   0.047
  239    H    GLN  29           H        GLN  29   5.856  -5.516   4.540
  240    HA   GLN  29           HA       GLN  29   3.798  -7.219   5.855
  241    HB2  GLN  29          2HB       GLN  29   6.079  -5.704   7.226
  242    HB3  GLN  29          3HB       GLN  29   4.767  -6.527   8.061
  243    HG2  GLN  29          2HG       GLN  29   6.898  -7.851   6.361
  244    HG3  GLN  29          3HG       GLN  29   6.837  -7.836   8.121
  245   HE21  GLN  29          1HE2      GLN  29   3.917  -8.326   8.218
  246   HE22  GLN  29          2HE2      GLN  29   3.714  -9.981   7.777
  247    H    VAL  30           H        VAL  30   2.148  -6.022   6.980
  248    HA   VAL  30           HA       VAL  30   1.685  -3.323   6.048
  249    HB   VAL  30           HB       VAL  30   0.115  -4.970   8.089
  250   HG11  VAL  30          1HG1      VAL  30  -1.735  -3.382   7.700
  251   HG12  VAL  30          2HG1      VAL  30  -0.709  -2.422   6.634
  252   HG13  VAL  30          3HG1      VAL  30  -0.320  -2.551   8.351
  253   HG21  VAL  30          1HG2      VAL  30  -1.453  -5.434   6.231
  254   HG22  VAL  30          2HG2      VAL  30   0.159  -6.055   5.877
  255   HG23  VAL  30          3HG2      VAL  30  -0.398  -4.564   5.113
  256    H    ARG  31           H        ARG  31   2.788  -1.683   6.917
  257    HA   ARG  31           HA       ARG  31   3.890  -1.692   9.610
  258    HB2  ARG  31          2HB       ARG  31   5.209  -0.759   7.769
  259    HB3  ARG  31          3HB       ARG  31   3.920   0.362   7.353
  260    HG2  ARG  31          2HG       ARG  31   5.652   1.594   8.476
  261    HG3  ARG  31          3HG       ARG  31   4.267   1.504   9.567
  262    HD2  ARG  31          2HD       ARG  31   5.403  -0.412  10.740
  263    HD3  ARG  31          3HD       ARG  31   6.811  -0.157   9.701
  264    HE   ARG  31           HE       ARG  31   5.834   2.082  11.335
  265   HH11  ARG  31          1HH1      ARG  31   8.327  -0.353  10.819
  266   HH12  ARG  31          2HH1      ARG  31   9.456   0.403  11.896
  267   HH21  ARG  31          1HH2      ARG  31   7.316   3.052  12.747
  268   HH22  ARG  31          2HH2      ARG  31   8.877   2.336  12.989
  269    H    ARG  32           H        ARG  32   1.719   0.448   7.795
  270    HA   ARG  32           HA       ARG  32   0.036   1.039  10.100
  271    HB2  ARG  32          2HB       ARG  32   1.831   3.077   8.729
  272    HB3  ARG  32          3HB       ARG  32   0.302   3.594   9.415
  273    HG2  ARG  32          2HG       ARG  32   2.398   2.168  11.078
  274    HG3  ARG  32          3HG       ARG  32   2.401   3.919  10.843
  275    HD2  ARG  32          2HD       ARG  32   0.128   2.302  12.056
  276    HD3  ARG  32          3HD       ARG  32   1.279   3.304  12.949
  277    HE   ARG  32           HE       ARG  32   0.311   5.145  11.332
  278   HH11  ARG  32          1HH1      ARG  32  -1.520   2.676  13.058
  279   HH12  ARG  32          2HH1      ARG  32  -2.958   3.642  13.149
  280   HH21  ARG  32          1HH2      ARG  32  -1.599   6.386  11.439
  281   HH22  ARG  32          2HH2      ARG  32  -3.004   5.741  12.232
  282    H    VAL  33           H        VAL  33  -1.884   2.345   9.390
  283    HA   VAL  33           HA       VAL  33  -2.334   2.455   6.468
  284    HB   VAL  33           HB       VAL  33  -4.473   1.531   8.469
  285   HG11  VAL  33          1HG1      VAL  33  -4.615   1.834   5.441
  286   HG12  VAL  33          2HG1      VAL  33  -5.432   2.849   6.633
  287   HG13  VAL  33          3HG1      VAL  33  -5.879   1.156   6.467
  288   HG21  VAL  33          1HG2      VAL  33  -2.846  -0.279   8.067
  289   HG22  VAL  33          2HG2      VAL  33  -3.069  -0.111   6.324
  290   HG23  VAL  33          3HG2      VAL  33  -4.406  -0.665   7.335
  291    H    GLN  34           H        GLN  34  -3.352   4.329   5.809
  292    HA   GLN  34           HA       GLN  34  -4.282   6.256   7.877
  293    HB2  GLN  34          2HB       GLN  34  -2.028   6.814   6.823
  294    HB3  GLN  34          3HB       GLN  34  -2.829   6.918   5.261
  295    HG2  GLN  34          2HG       GLN  34  -2.534   9.148   6.095
  296    HG3  GLN  34          3HG       GLN  34  -4.254   8.773   6.181
  297   HE21  GLN  34          1HE2      GLN  34  -1.817   7.632   8.502
  298   HE22  GLN  34          2HE2      GLN  34  -2.409   8.561   9.832
  299    H    LYS  35           H        LYS  35  -6.521   6.232   7.591
  300    HA   LYS  35           HA       LYS  35  -7.648   6.152   4.855
  301    HB2  LYS  35          2HB       LYS  35  -8.577   4.612   6.640
  302    HB3  LYS  35          3HB       LYS  35  -9.101   6.015   7.554
  303    HG2  LYS  35          2HG       LYS  35 -10.096   5.543   4.727
  304    HG3  LYS  35          3HG       LYS  35 -10.837   4.722   6.100
  305    HD2  LYS  35          2HD       LYS  35 -11.503   6.828   7.091
  306    HD3  LYS  35          3HD       LYS  35 -10.590   7.746   5.894
  307    HE2  LYS  35          2HE       LYS  35 -12.983   7.786   5.395
  308    HE3  LYS  35          3HE       LYS  35 -12.089   6.960   4.121
  309    HZ1  LYS  35          1HZ       LYS  35 -13.551   5.590   6.309
  310    HZ2  LYS  35          2HZ       LYS  35 -12.811   4.859   4.984
  311    HZ3  LYS  35          3HZ       LYS  35 -14.168   5.830   4.757
  312    H    GLN  36           H        GLN  36  -7.782   8.120   3.930
  313    HA   GLN  36           HA       GLN  36  -8.943  10.361   5.488
  314    HB2  GLN  36          2HB       GLN  36  -6.621  10.549   3.510
  315    HB3  GLN  36          3HB       GLN  36  -7.468  11.941   4.181
  316    HG2  GLN  36          2HG       GLN  36  -5.893   9.895   5.780
  317    HG3  GLN  36          3HG       GLN  36  -5.329  11.508   5.340
  318   HE21  GLN  36          1HE2      GLN  36  -5.963  10.106   7.973
  319   HE22  GLN  36          2HE2      GLN  36  -6.947  11.242   8.822
  320    H    GLY  37           H        GLY  37 -10.945  10.222   4.682
  321    HA2  GLY  37          2HA       GLY  37 -12.715  10.507   3.283
  322    HA3  GLY  37          3HA       GLY  37 -11.603  11.302   2.182
  323    H    ASN  38           H        ASN  38 -11.051  10.281   0.350
  324    HA   ASN  38           HA       ASN  38 -12.008   7.539  -0.170
  325    HB2  ASN  38          2HB       ASN  38 -10.893   9.660  -2.068
  326    HB3  ASN  38          3HB       ASN  38 -11.474   8.067  -2.554
  327   HD21  ASN  38          1HD2      ASN  38 -13.716   7.651  -2.487
  328   HD22  ASN  38          2HD2      ASN  38 -14.874   8.926  -2.431
  329    H    THR  39           H        THR  39  -9.079   9.511  -0.001
  330    HA   THR  39           HA       THR  39  -7.372   7.493  -1.180
  331    HB   THR  39           HB       THR  39  -6.497  10.096   0.149
  332    HG1  THR  39           HG1      THR  39  -8.113  10.231  -1.673
  333   HG21  THR  39          1HG2      THR  39  -4.548   9.910  -1.361
  334   HG22  THR  39          2HG2      THR  39  -5.181   8.405  -2.028
  335   HG23  THR  39          3HG2      THR  39  -4.657   8.471  -0.343
  336    H    ILE  40           H        ILE  40  -7.441   5.743   0.239
  337    HA   ILE  40           HA       ILE  40  -6.335   6.004   2.920
  338    HB   ILE  40           HB       ILE  40  -6.964   3.489   1.310
  339   HG12  ILE  40          2HG1      ILE  40  -8.596   5.019   3.383
  340   HG13  ILE  40          3HG1      ILE  40  -9.008   4.750   1.693
  341   HG21  ILE  40          1HG2      ILE  40  -6.825   2.297   3.463
  342   HG22  ILE  40          2HG2      ILE  40  -6.393   3.797   4.284
  343   HG23  ILE  40          3HG2      ILE  40  -5.291   3.093   3.098
  344   HD11  ILE  40          1HD1      ILE  40  -8.888   2.659   3.856
  345   HD12  ILE  40          2HD1      ILE  40  -9.243   2.353   2.152
  346   HD13  ILE  40          3HD1      ILE  40 -10.327   3.353   3.115
  347    H    ARG  41           H        ARG  41  -4.230   6.551   2.939
  348    HA   ARG  41           HA       ARG  41  -2.288   5.405   1.081
  349    HB2  ARG  41          2HB       ARG  41  -1.711   7.180   3.498
  350    HB3  ARG  41          3HB       ARG  41  -0.672   6.873   2.114
  351    HG2  ARG  41          2HG       ARG  41  -2.384   8.096   0.693
  352    HG3  ARG  41          3HG       ARG  41  -3.187   8.554   2.198
  353    HD2  ARG  41          2HD       ARG  41  -0.366   9.283   1.328
  354    HD3  ARG  41          3HD       ARG  41  -1.741  10.375   1.480
  355    HE   ARG  41           HE       ARG  41  -1.606   9.643   3.973
  356   HH11  ARG  41          1HH1      ARG  41   1.191  10.221   1.896
  357   HH12  ARG  41          2HH1      ARG  41   2.207  10.698   3.216
  358   HH21  ARG  41          1HH2      ARG  41  -0.237  10.297   5.673
  359   HH22  ARG  41          2HH2      ARG  41   1.407  10.743   5.338
  360    H    VAL  42           H        VAL  42  -2.203   3.191   1.613
  361    HA   VAL  42           HA       VAL  42  -1.829   2.349   4.377
  362    HB   VAL  42           HB       VAL  42  -1.602   0.638   1.854
  363   HG11  VAL  42          1HG1      VAL  42  -1.894  -1.283   3.392
  364   HG12  VAL  42          2HG1      VAL  42  -1.897  -0.181   4.774
  365   HG13  VAL  42          3HG1      VAL  42  -0.442  -0.360   3.792
  366   HG21  VAL  42          1HG2      VAL  42  -3.850   1.564   2.018
  367   HG22  VAL  42          2HG2      VAL  42  -3.972   1.050   3.708
  368   HG23  VAL  42          3HG2      VAL  42  -3.881  -0.157   2.421
  369    H    GLU  43           H        GLU  43   0.046   2.398   5.324
  370    HA   GLU  43           HA       GLU  43   2.576   2.608   3.877
  371    HB2  GLU  43          2HB       GLU  43   2.009   2.630   6.873
  372    HB3  GLU  43          3HB       GLU  43   3.526   3.072   6.096
  373    HG2  GLU  43          2HG       GLU  43   2.467   5.029   5.063
  374    HG3  GLU  43          3HG       GLU  43   0.903   4.555   5.724
  375    H    LEU  44           H        LEU  44   3.608   0.761   3.321
  376    HA   LEU  44           HA       LEU  44   3.513  -1.572   5.163
  377    HB2  LEU  44          2HB       LEU  44   3.881  -1.903   2.162
  378    HB3  LEU  44          3HB       LEU  44   3.549  -3.126   3.367
  379    HG   LEU  44           HG       LEU  44   1.243  -1.768   3.641
  380   HD11  LEU  44          1HD1      LEU  44   1.820   0.028   2.096
  381   HD12  LEU  44          2HD1      LEU  44   0.422  -0.872   1.514
  382   HD13  LEU  44          3HD1      LEU  44   2.007  -1.132   0.778
  383   HD21  LEU  44          1HD2      LEU  44   0.154  -3.290   2.054
  384   HD22  LEU  44          2HD2      LEU  44   1.366  -4.131   3.019
  385   HD23  LEU  44          3HD2      LEU  44   1.724  -3.692   1.348
  386    H    GLU  45           H        GLU  45   5.493  -3.018   4.766
  387    HA   GLU  45           HA       GLU  45   7.890  -1.299   4.620
  388    HB2  GLU  45          2HB       GLU  45   7.027  -1.646   6.965
  389    HB3  GLU  45          3HB       GLU  45   7.262  -3.378   6.771
  390    HG2  GLU  45          2HG       GLU  45   9.681  -3.078   6.594
  391    HG3  GLU  45          3HG       GLU  45   9.498  -1.325   6.596
  392    H    LEU  46           H        LEU  46   9.150  -2.062   3.109
  393    HA   LEU  46           HA       LEU  46   9.166  -4.920   2.316
  394    HB2  LEU  46          2HB       LEU  46   7.891  -3.441   0.786
  395    HB3  LEU  46          3HB       LEU  46   9.260  -2.390   0.625
  396    HG   LEU  46           HG       LEU  46   9.439  -5.261  -0.349
  397   HD11  LEU  46          1HD1      LEU  46   8.353  -2.910  -1.937
  398   HD12  LEU  46          2HD1      LEU  46   7.438  -4.324  -1.407
  399   HD13  LEU  46          3HD1      LEU  46   8.734  -4.512  -2.583
  400   HD21  LEU  46          1HD2      LEU  46  11.551  -4.001  -0.276
  401   HD22  LEU  46          2HD2      LEU  46  10.839  -2.711  -1.244
  402   HD23  LEU  46          3HD2      LEU  46  11.074  -4.316  -1.944
  403    H    ARG  47           H        ARG  47  11.241  -5.809   2.002
  404    HA   ARG  47           HA       ARG  47  13.529  -4.077   2.777
  405    HB2  ARG  47          2HB       ARG  47  13.500  -7.126   2.622
  406    HB3  ARG  47          3HB       ARG  47  14.700  -6.105   3.407
  407    HG2  ARG  47          2HG       ARG  47  13.093  -5.493   5.142
  408    HG3  ARG  47          3HG       ARG  47  11.820  -6.403   4.321
  409    HD2  ARG  47          2HD       ARG  47  14.320  -7.520   5.642
  410    HD3  ARG  47          3HD       ARG  47  12.645  -7.738   6.157
  411    HE   ARG  47           HE       ARG  47  13.683  -8.820   3.597
  412   HH11  ARG  47          1HH1      ARG  47  11.868  -9.347   6.583
  413   HH12  ARG  47          2HH1      ARG  47  11.408 -10.961   6.144
  414   HH21  ARG  47          1HH2      ARG  47  13.089 -10.941   3.075
  415   HH22  ARG  47          2HH2      ARG  47  12.098 -11.857   4.168
  416    H    THR  48           H        THR  48  14.149  -3.127   0.849
  417    HA   THR  48           HA       THR  48  14.403  -4.614  -1.629
  418    HB   THR  48           HB       THR  48  15.405  -1.781  -1.084
  419    HG1  THR  48           HG1      THR  48  13.421  -1.087  -1.169
  420   HG21  THR  48          1HG2      THR  48  14.488  -3.154  -3.647
  421   HG22  THR  48          2HG2      THR  48  16.158  -2.756  -3.232
  422   HG23  THR  48          3HG2      THR  48  14.987  -1.466  -3.508
  423    H    ASN  49           H        ASN  49  16.032  -6.053  -1.671
  424    HA   ASN  49           HA       ASN  49  18.074  -7.025  -1.704
  425    HB2  ASN  49          2HB       ASN  49  19.123  -4.177  -1.997
  426    HB3  ASN  49          3HB       ASN  49  19.993  -5.644  -2.424
  427   HD21  ASN  49          1HD2      ASN  49  19.370  -3.406  -4.138
  428   HD22  ASN  49          2HD2      ASN  49  18.396  -4.016  -5.428
  429    H    GLY  50           H        GLY  50  16.982  -6.483   0.867
  430    HA2  GLY  50          2HA       GLY  50  17.816  -7.153   2.970
  431    HA3  GLY  50          3HA       GLY  50  19.419  -6.592   2.525
  432    H    LYS  51           H        LYS  51  17.899  -4.005   1.539
  433    HA   LYS  51           HA       LYS  51  18.107  -2.588   4.081
  434    HB2  LYS  51          2HB       LYS  51  17.505  -1.581   1.253
  435    HB3  LYS  51          3HB       LYS  51  17.704  -0.540   2.661
  436    HG2  LYS  51          2HG       LYS  51  19.830  -2.327   1.434
  437    HG3  LYS  51          3HG       LYS  51  19.741  -0.571   1.314
  438    HD2  LYS  51          2HD       LYS  51  20.199  -2.168   3.867
  439    HD3  LYS  51          3HD       LYS  51  21.421  -1.258   2.980
  440    HE2  LYS  51          2HE       LYS  51  20.267   0.843   3.487
  441    HE3  LYS  51          3HE       LYS  51  18.965  -0.032   4.291
  442    HZ1  LYS  51          1HZ       LYS  51  20.538  -0.787   5.948
  443    HZ2  LYS  51          2HZ       LYS  51  20.549   0.898   5.865
  444    HZ3  LYS  51          3HZ       LYS  51  21.803   0.011   5.164
  445    H    LYS  52           H        LYS  52  16.384  -2.247   5.375
  446    HA   LYS  52           HA       LYS  52  13.718  -3.028   4.477
  447    HB2  LYS  52          2HB       LYS  52  14.741  -3.762   6.698
  448    HB3  LYS  52          3HB       LYS  52  14.572  -2.100   7.257
  449    HG2  LYS  52          2HG       LYS  52  12.077  -2.303   6.807
  450    HG3  LYS  52          3HG       LYS  52  12.351  -4.014   6.470
  451    HD2  LYS  52          2HD       LYS  52  11.576  -3.787   8.759
  452    HD3  LYS  52          3HD       LYS  52  13.268  -4.290   8.787
  453    HE2  LYS  52          2HE       LYS  52  13.969  -1.997   9.291
  454    HE3  LYS  52          3HE       LYS  52  12.304  -1.427   9.149
  455    HZ1  LYS  52          1HZ       LYS  52  13.268  -3.377  11.177
  456    HZ2  LYS  52          2HZ       LYS  52  11.704  -2.748  11.057
  457    HZ3  LYS  52          3HZ       LYS  52  12.996  -1.737  11.454
  458    H    GLU  53           H        GLU  53  12.864  -1.453   3.262
  459    HA   GLU  53           HA       GLU  53  12.943   1.372   4.139
  460    HB2  GLU  53          2HB       GLU  53  12.465   0.216   1.357
  461    HB3  GLU  53          3HB       GLU  53  12.536   1.931   1.763
  462    HG2  GLU  53          2HG       GLU  53  14.908   1.574   2.543
  463    HG3  GLU  53          3HG       GLU  53  14.807  -0.078   1.939
  464    H    ASN  54           H        ASN  54  11.104   2.422   4.541
  465    HA   ASN  54           HA       ASN  54   8.582   0.966   4.607
  466    HB2  ASN  54          2HB       ASN  54   9.437   3.679   5.706
  467    HB3  ASN  54          3HB       ASN  54   7.800   3.044   5.868
  468   HD21  ASN  54          1HD2      ASN  54   7.454   1.211   7.189
  469   HD22  ASN  54          2HD2      ASN  54   8.603   0.725   8.388
  470    H    TYR  55           H        TYR  55   7.198   1.089   2.985
  471    HA   TYR  55           HA       TYR  55   7.161   3.372   1.109
  472    HB2  TYR  55          2HB       TYR  55   5.999   0.550   0.878
  473    HB3  TYR  55          3HB       TYR  55   5.780   1.809  -0.329
  474    HD1  TYR  55           HD1      TYR  55   7.272   1.870  -2.162
  475    HD2  TYR  55           HD2      TYR  55   8.540  -0.038   1.444
  476    HE1  TYR  55           HE1      TYR  55   9.317   1.092  -3.286
  477    HE2  TYR  55           HE2      TYR  55  10.566  -0.825   0.320
  478    HH   TYR  55           HH       TYR  55  11.417  -1.246  -1.928
  479    H    THR  56           H        THR  56   5.121   4.238   0.494
  480    HA   THR  56           HA       THR  56   2.755   3.611   2.129
  481    HB   THR  56           HB       THR  56   3.748   6.413   1.389
  482    HG1  THR  56           HG1      THR  56   3.919   4.861   3.717
  483   HG21  THR  56          1HG2      THR  56   1.843   7.226   2.769
  484   HG22  THR  56          2HG2      THR  56   1.258   5.566   2.919
  485   HG23  THR  56          3HG2      THR  56   1.298   6.349   1.337
  486    H    VAL  57           H        VAL  57   1.582   2.603   0.571
  487    HA   VAL  57           HA       VAL  57   1.540   3.573  -2.191
  488    HB   VAL  57           HB       VAL  57   0.100   1.166  -0.956
  489   HG11  VAL  57          1HG1      VAL  57   0.598   1.844  -3.881
  490   HG12  VAL  57          2HG1      VAL  57  -0.954   1.950  -3.046
  491   HG13  VAL  57          3HG1      VAL  57  -0.182   0.380  -3.277
  492   HG21  VAL  57          1HG2      VAL  57   2.548   0.911  -0.770
  493   HG22  VAL  57          2HG2      VAL  57   2.718   1.203  -2.503
  494   HG23  VAL  57          3HG2      VAL  57   1.871  -0.238  -1.930
  495    H    GLU  58           H        GLU  58   0.310   5.307  -2.383
  496    HA   GLU  58           HA       GLU  58  -2.028   5.890  -0.817
  497    HB2  GLU  58          2HB       GLU  58  -0.926   7.289  -3.299
  498    HB3  GLU  58          3HB       GLU  58  -2.169   7.922  -2.221
  499    HG2  GLU  58          2HG       GLU  58  -0.408   7.835  -0.360
  500    HG3  GLU  58          3HG       GLU  58   0.768   7.496  -1.627
  501    H    VAL  59           H        VAL  59  -3.882   4.830  -1.210
  502    HA   VAL  59           HA       VAL  59  -4.706   4.205  -4.002
  503    HB   VAL  59           HB       VAL  59  -5.428   2.566  -1.523
  504   HG11  VAL  59          1HG1      VAL  59  -5.769   1.941  -4.477
  505   HG12  VAL  59          2HG1      VAL  59  -7.055   2.399  -3.357
  506   HG13  VAL  59          3HG1      VAL  59  -6.199   0.872  -3.137
  507   HG21  VAL  59          1HG2      VAL  59  -3.282   1.911  -3.578
  508   HG22  VAL  59          2HG2      VAL  59  -3.829   0.846  -2.276
  509   HG23  VAL  59          3HG2      VAL  59  -3.007   2.358  -1.888
  510    H    GLU  60           H        GLU  60  -6.558   5.196  -4.553
  511    HA   GLU  60           HA       GLU  60  -8.258   6.504  -2.508
  512    HB2  GLU  60          2HB       GLU  60  -7.151   8.006  -4.076
  513    HB3  GLU  60          3HB       GLU  60  -7.733   7.080  -5.453
  514    HG2  GLU  60          2HG       GLU  60 -10.107   7.739  -4.703
  515    HG3  GLU  60          3HG       GLU  60  -9.331   8.879  -3.601
  516    H    ARG  61           H        ARG  61 -10.505   6.161  -2.512
  517    HA   ARG  61           HA       ARG  61 -11.641   3.953  -3.976
  518    HB2  ARG  61          2HB       ARG  61 -12.491   4.542  -1.734
  519    HB3  ARG  61          3HB       ARG  61 -12.989   6.129  -2.307
  520    HG2  ARG  61          2HG       ARG  61 -14.989   4.869  -2.225
  521    HG3  ARG  61          3HG       ARG  61 -14.559   4.882  -3.934
  522    HD2  ARG  61          2HD       ARG  61 -15.121   2.651  -3.629
  523    HD3  ARG  61          3HD       ARG  61 -13.386   2.568  -3.337
  524    HE   ARG  61           HE       ARG  61 -14.538   3.026  -0.876
  525   HH11  ARG  61          1HH1      ARG  61 -14.811   0.475  -3.291
  526   HH12  ARG  61          2HH1      ARG  61 -15.206  -0.746  -2.129
  527   HH21  ARG  61          1HH2      ARG  61 -15.071   1.412   0.632
  528   HH22  ARG  61          2HH2      ARG  61 -15.356  -0.214   0.099
  529    H    GLN  62           H        GLN  62 -12.176   4.089  -6.067
  530    HA   GLN  62           HA       GLN  62 -13.585   6.513  -7.041
  531    HB2  GLN  62          2HB       GLN  62 -11.874   4.508  -8.578
  532    HB3  GLN  62          3HB       GLN  62 -12.994   5.603  -9.378
  533    HG2  GLN  62          2HG       GLN  62 -11.767   7.531  -8.316
  534    HG3  GLN  62          3HG       GLN  62 -10.567   6.382  -7.730
  535   HE21  GLN  62          1HE2      GLN  62 -10.201   8.634  -9.531
  536   HE22  GLN  62          2HE2      GLN  62  -9.555   7.983 -10.997
  537    H    GLY  63           H        GLY  63 -15.670   6.066  -6.631
  538    HA2  GLY  63          2HA       GLY  63 -17.755   5.135  -6.868
  539    HA3  GLY  63          3HA       GLY  63 -17.082   4.079  -8.104
  540    H    ASN  64           H        ASN  64 -16.822   1.971  -7.614
  541    HA   ASN  64           HA       ASN  64 -17.164   1.076  -4.804
  542    HB2  ASN  64          2HB       ASN  64 -18.902   0.313  -6.449
  543    HB3  ASN  64          3HB       ASN  64 -17.643  -0.488  -7.381
  544   HD21  ASN  64          1HD2      ASN  64 -17.874  -0.446  -3.822
  545   HD22  ASN  64          2HD2      ASN  64 -18.154  -2.139  -3.661
  546    H    THR  65           H        THR  65 -14.968   1.259  -7.435
  547    HA   THR  65           HA       THR  65 -13.262  -0.939  -6.485
  548    HB   THR  65           HB       THR  65 -11.870  -0.308  -8.545
  549    HG1  THR  65           HG1      THR  65 -12.485   1.321  -9.729
  550   HG21  THR  65          1HG2      THR  65 -13.382  -1.389 -10.148
  551   HG22  THR  65          2HG2      THR  65 -14.751  -1.127  -9.065
  552   HG23  THR  65          3HG2      THR  65 -13.446  -2.219  -8.590
  553    H    TRP  66           H        TRP  66 -10.864  -0.429  -6.627
  554    HA   TRP  66           HA       TRP  66 -10.193   2.117  -5.267
  555    HB2  TRP  66          2HB       TRP  66  -9.004  -0.690  -4.956
  556    HB3  TRP  66          3HB       TRP  66  -8.297   0.760  -4.242
  557    HD1  TRP  66           HD1      TRP  66 -11.054  -1.782  -3.638
  558    HE1  TRP  66           HE1      TRP  66 -12.301  -1.190  -1.468
  559    HE3  TRP  66           HE3      TRP  66  -9.033   2.835  -2.769
  560    HZ2  TRP  66           HZ2      TRP  66 -12.422   0.956   0.357
  561    HZ3  TRP  66           HZ3      TRP  66  -9.770   4.099  -0.791
  562    HH2  TRP  66           HH2      TRP  66 -11.441   3.174   0.737
  563    H    THR  67           H        THR  67  -8.200   3.110  -5.875
  564    HA   THR  67           HA       THR  67  -6.899   2.121  -8.337
  565    HB   THR  67           HB       THR  67  -8.580   3.824  -9.022
  566    HG1  THR  67           HG1      THR  67  -6.209   3.651  -9.829
  567   HG21  THR  67          1HG2      THR  67  -8.638   5.243  -6.987
  568   HG22  THR  67          2HG2      THR  67  -8.319   6.207  -8.429
  569   HG23  THR  67          3HG2      THR  67  -6.997   5.805  -7.335
  570    H    VAL  68           H        VAL  68  -4.757   1.978  -7.998
  571    HA   VAL  68           HA       VAL  68  -3.474   3.214  -5.736
  572    HB   VAL  68           HB       VAL  68  -2.287   1.656  -8.078
  573   HG11  VAL  68          1HG1      VAL  68  -0.236   1.428  -6.697
  574   HG12  VAL  68          2HG1      VAL  68  -0.922   2.520  -5.492
  575   HG13  VAL  68          3HG1      VAL  68  -0.551   3.116  -7.111
  576   HG21  VAL  68          1HG2      VAL  68  -2.908   0.793  -5.225
  577   HG22  VAL  68          2HG2      VAL  68  -2.169  -0.211  -6.473
  578   HG23  VAL  68          3HG2      VAL  68  -3.829   0.344  -6.665
  579    H    LYS  69           H        LYS  69  -3.343   5.347  -5.799
  580    HA   LYS  69           HA       LYS  69  -3.111   7.014  -8.058
  581    HB2  LYS  69          2HB       LYS  69  -2.443   7.569  -5.130
  582    HB3  LYS  69          3HB       LYS  69  -2.618   8.808  -6.369
  583    HG2  LYS  69          2HG       LYS  69  -4.808   6.936  -5.421
  584    HG3  LYS  69          3HG       LYS  69  -4.614   8.614  -4.921
  585    HD2  LYS  69          2HD       LYS  69  -5.062   7.796  -7.815
  586    HD3  LYS  69          3HD       LYS  69  -6.383   8.137  -6.702
  587    HE2  LYS  69          2HE       LYS  69  -5.985  10.105  -8.030
  588    HE3  LYS  69          3HE       LYS  69  -5.469  10.448  -6.387
  589    HZ1  LYS  69          1HZ       LYS  69  -3.938  11.300  -8.087
  590    HZ2  LYS  69          2HZ       LYS  69  -3.641   9.723  -8.615
  591    HZ3  LYS  69          3HZ       LYS  69  -3.187  10.187  -7.058
  592    H    ARG  70           H        ARG  70  -0.720   6.094  -5.577
  593    HA   ARG  70           HA       ARG  70   1.432   5.879  -7.449
  594    HB2  ARG  70          2HB       ARG  70   2.896   7.646  -6.480
  595    HB3  ARG  70          3HB       ARG  70   1.469   8.326  -7.249
  596    HG2  ARG  70          2HG       ARG  70   0.417   8.599  -5.004
  597    HG3  ARG  70          3HG       ARG  70   1.900   7.994  -4.259
  598    HD2  ARG  70          2HD       ARG  70   1.740  10.469  -6.013
  599    HD3  ARG  70          3HD       ARG  70   1.707  10.486  -4.251
  600    HE   ARG  70           HE       ARG  70   4.019   9.706  -5.935
  601   HH11  ARG  70          1HH1      ARG  70   2.759  10.755  -2.811
  602   HH12  ARG  70          2HH1      ARG  70   4.333  11.011  -2.131
  603   HH21  ARG  70          1HH2      ARG  70   6.084  10.062  -5.006
  604   HH22  ARG  70          2HH2      ARG  70   6.210  10.620  -3.371
  605    H    ILE  71           H        ILE  71   3.237   4.854  -6.550
  606    HA   ILE  71           HA       ILE  71   2.996   3.883  -3.771
  607    HB   ILE  71           HB       ILE  71   4.883   2.974  -5.989
  608   HG12  ILE  71          2HG1      ILE  71   2.446   1.506  -4.886
  609   HG13  ILE  71          3HG1      ILE  71   2.436   2.434  -6.381
  610   HG21  ILE  71          1HG2      ILE  71   4.401   1.796  -3.228
  611   HG22  ILE  71          2HG2      ILE  71   5.862   2.632  -3.764
  612   HG23  ILE  71          3HG2      ILE  71   5.419   1.081  -4.479
  613   HD11  ILE  71          1HD1      ILE  71   4.020  -0.059  -5.805
  614   HD12  ILE  71          2HD1      ILE  71   4.207   0.928  -7.259
  615   HD13  ILE  71          3HD1      ILE  71   2.668   0.143  -6.918
  616    H    THR  72           H        THR  72   3.914   5.278  -2.424
  617    HA   THR  72           HA       THR  72   6.260   6.886  -3.102
  618    HB   THR  72           HB       THR  72   4.650   6.771  -0.494
  619    HG1  THR  72           HG1      THR  72   3.195   8.020  -1.398
  620   HG21  THR  72          1HG2      THR  72   5.474   9.060  -0.121
  621   HG22  THR  72          2HG2      THR  72   6.382   9.003  -1.633
  622   HG23  THR  72          3HG2      THR  72   6.834   7.945  -0.292
  623    H    ARG  73           H        ARG  73   8.287   6.469  -2.210
  624    HA   ARG  73           HA       ARG  73   8.557   4.380  -0.101
  625    HB2  ARG  73          2HB       ARG  73   9.699   3.704  -2.204
  626    HB3  ARG  73          3HB       ARG  73  10.600   5.216  -2.226
  627    HG2  ARG  73          2HG       ARG  73  11.798   4.572  -0.183
  628    HG3  ARG  73          3HG       ARG  73  10.835   3.097  -0.054
  629    HD2  ARG  73          2HD       ARG  73  13.058   2.624  -0.957
  630    HD3  ARG  73          3HD       ARG  73  11.814   2.260  -2.149
  631    HE   ARG  73           HE       ARG  73  12.496   4.723  -2.890
  632   HH11  ARG  73          1HH1      ARG  73  14.619   2.038  -2.047
  633   HH12  ARG  73          2HH1      ARG  73  15.892   2.574  -3.100
  634   HH21  ARG  73          1HH2      ARG  73  14.155   5.377  -4.276
  635   HH22  ARG  73          2HH2      ARG  73  15.629   4.461  -4.360
  636    H    THR  74           H        THR  74   9.767   4.982   1.712
  637    HA   THR  74           HA       THR  74   9.918   7.671   2.483
  638    HB   THR  74           HB       THR  74   9.872   5.793   4.117
  639    HG1  THR  74           HG1      THR  74  10.781   7.922   4.647
  640   HG21  THR  74          1HG2      THR  74  11.426   4.211   3.011
  641   HG22  THR  74          2HG2      THR  74  11.917   4.516   4.676
  642   HG23  THR  74          3HG2      THR  74  12.781   5.296   3.348
  643    H    VAL  75           H        VAL  75  11.664   9.154   2.584
  644    HA   VAL  75           HA       VAL  75  13.482   9.151   0.436
  645    HB   VAL  75           HB       VAL  75  13.646  10.814   2.998
  646   HG11  VAL  75          1HG1      VAL  75  14.971  12.429   1.671
  647   HG12  VAL  75          2HG1      VAL  75  14.922  11.341   0.281
  648   HG13  VAL  75          3HG1      VAL  75  15.772  10.858   1.749
  649   HG21  VAL  75          1HG2      VAL  75  12.291  11.494   0.360
  650   HG22  VAL  75          2HG2      VAL  75  12.449  12.575   1.749
  651   HG23  VAL  75          3HG2      VAL  75  11.478  11.108   1.879
  652    H    GLY  76           H        GLY  76  14.765   7.431   0.369
  653    HA2  GLY  76          2HA       GLY  76  16.963   7.177   2.336
  654    HA3  GLY  76          3HA       GLY  76  16.076   5.750   1.788
  655    H    SER  77           H        SER  77  16.128   7.986  -0.662
  656    HA   SER  77           HA       SER  77  17.865   6.528  -2.354
  657    HB2  SER  77          2HB       SER  77  16.727   9.342  -2.726
  658    HB3  SER  77          3HB       SER  77  17.325   8.274  -4.000
  659    HG   SER  77           HG       SER  77  15.442   7.347  -4.038
  660    H    LEU  78           H        LEU  78  19.824   6.476  -1.169
  661    HA   LEU  78           HA       LEU  78  21.287   8.843  -0.493
  662    HB2  LEU  78          2HB       LEU  78  23.241   7.077  -0.224
  663    HB3  LEU  78          3HB       LEU  78  21.936   7.176   0.936
  664    HG   LEU  78           HG       LEU  78  20.858   5.169  -0.091
  665   HD11  LEU  78          1HD1      LEU  78  21.696   5.311  -2.385
  666   HD12  LEU  78          2HD1      LEU  78  22.053   3.740  -1.671
  667   HD13  LEU  78          3HD1      LEU  78  23.332   4.950  -1.829
  668   HD21  LEU  78          1HD2      LEU  78  22.337   4.941   1.838
  669   HD22  LEU  78          2HD2      LEU  78  23.731   4.751   0.773
  670   HD23  LEU  78          3HD2      LEU  78  22.456   3.530   0.786
  671    H    GLU  79           H        GLU  79  23.344   9.482  -1.375
  672    HA   GLU  79           HA       GLU  79  23.138   9.855  -4.165
  673    HB2  GLU  79          2HB       GLU  79  25.211  11.155  -4.010
  674    HB3  GLU  79          3HB       GLU  79  24.072  11.603  -2.746
  675    HG2  GLU  79          2HG       GLU  79  25.351  10.483  -1.058
  676    HG3  GLU  79          3HG       GLU  79  26.377   9.698  -2.259
  677    H    HIS  80           H        HIS  80  24.210   9.009  -5.838
  678    HA   HIS  80           HA       HIS  80  26.425   7.117  -5.433
  679    HB2  HIS  80          2HB       HIS  80  25.465   5.569  -7.122
  680    HB3  HIS  80          3HB       HIS  80  24.437   5.700  -5.703
  681    HD1  HIS  80           HD1      HIS  80  22.134   6.877  -6.004
  682    HD2  HIS  80           HD2      HIS  80  24.291   6.410  -9.532
  683    HE1  HIS  80           HE1      HIS  80  20.498   7.280  -7.861
  684    HE2  HIS  80           HE2      HIS  80  21.788   6.845  -9.967
  685    H    HIS  81           H        HIS  81  27.864   7.038  -7.185
  686    HA   HIS  81           HA       HIS  81  28.227   9.552  -8.492
  687    HB2  HIS  81          2HB       HIS  81  29.809   6.953  -8.713
  688    HB3  HIS  81          3HB       HIS  81  30.328   8.501  -9.378
  689    HD1  HIS  81           HD1      HIS  81  30.639   6.455  -6.407
  690    HD2  HIS  81           HD2      HIS  81  30.680  10.537  -7.220
  691    HE1  HIS  81           HE1      HIS  81  31.677   7.540  -4.395
  692    HE2  HIS  81           HE2      HIS  81  31.818   9.979  -4.971
  693    H    HIS  82           H        HIS  82  28.302  10.025 -10.671
  694    HA   HIS  82           HA       HIS  82  26.637   8.669 -12.527
  695    HB2  HIS  82          2HB       HIS  82  27.051  11.079 -12.719
  696    HB3  HIS  82          3HB       HIS  82  28.775  10.811 -12.918
  697    HD1  HIS  82           HD1      HIS  82  25.586  10.945 -14.792
  698    HD2  HIS  82           HD2      HIS  82  29.526   9.856 -15.529
  699    HE1  HIS  82           HE1      HIS  82  25.802  10.831 -17.286
  700    HE2  HIS  82           HE2      HIS  82  28.145  10.040 -17.699
  701    H    HIS  83           H        HIS  83  27.197   6.595 -12.915
  702    HA   HIS  83           HA       HIS  83  29.738   5.457 -13.190
  703    HB2  HIS  83          2HB       HIS  83  27.066   4.588 -14.381
  704    HB3  HIS  83          3HB       HIS  83  28.518   3.585 -14.390
  705    HD1  HIS  83           HD1      HIS  83  25.988   5.072 -11.998
  706    HD2  HIS  83           HD2      HIS  83  29.017   2.227 -12.004
  707    HE1  HIS  83           HE1      HIS  83  25.773   3.856  -9.819
  708    HE2  HIS  83           HE2      HIS  83  27.478   2.010  -9.952
  709    H    HIS  84           H        HIS  84  30.990   4.927 -15.007
  710    HA   HIS  84           HA       HIS  84  32.196   5.414 -16.846
  711    HB2  HIS  84          2HB       HIS  84  30.250   4.634 -18.147
  712    HB3  HIS  84          3HB       HIS  84  29.508   6.221 -18.047
  713    HD1  HIS  84           HD1      HIS  84  29.961   7.761 -19.950
  714    HD2  HIS  84           HD2      HIS  84  32.706   4.650 -19.791
  715    HE1  HIS  84           HE1      HIS  84  31.320   7.952 -22.051
  716    HE2  HIS  84           HE2      HIS  84  32.818   5.945 -22.017
  717    H    HIS  85           H        HIS  85  33.413   6.973 -15.860
  718    HA   HIS  85           HA       HIS  85  32.794   9.800 -16.369
  719    HB2  HIS  85          2HB       HIS  85  33.322  10.373 -13.949
  720    HB3  HIS  85          3HB       HIS  85  31.795   9.535 -14.202
  721    HD1  HIS  85           HD1      HIS  85  35.047   9.252 -12.456
  722    HD2  HIS  85           HD2      HIS  85  31.765   6.815 -13.205
  723    HE1  HIS  85           HE1      HIS  85  35.272   7.311 -10.885
  724    HE2  HIS  85           HE2      HIS  85  33.409   5.758 -11.528
  Start of MODEL    8
    1    H1   MET   1          1H        MET   1 -24.290  -8.116   4.422
    2    H2   MET   1          2H        MET   1 -22.696  -8.543   4.062
    3    H3   MET   1          3H        MET   1 -23.453  -7.318   3.187
    4    HA   MET   1           HA       MET   1 -23.578  -5.933   5.122
    5    HB2  MET   1          2HB       MET   1 -23.755  -7.802   6.778
    6    HB3  MET   1          3HB       MET   1 -22.067  -8.201   6.506
    7    HG2  MET   1          2HG       MET   1 -21.414  -6.001   7.423
    8    HG3  MET   1          3HG       MET   1 -23.112  -5.628   7.714
    9    HE1  MET   1          1HE       MET   1 -24.028  -8.319  10.478
   10    HE2  MET   1          2HE       MET   1 -24.214  -8.527   8.737
   11    HE3  MET   1          3HE       MET   1 -24.645  -6.992   9.491
   12    HA   PRO   2           HA       PRO   2 -19.477  -5.272   3.056
   13    HB2  PRO   2          2HB       PRO   2 -19.990  -2.863   1.921
   14    HB3  PRO   2          3HB       PRO   2 -20.636  -4.366   1.232
   15    HG2  PRO   2          2HG       PRO   2 -22.030  -2.324   2.924
   16    HG3  PRO   2          3HG       PRO   2 -22.621  -3.192   1.489
   17    HD2  PRO   2          2HD       PRO   2 -23.215  -3.920   4.104
   18    HD3  PRO   2          3HD       PRO   2 -23.277  -5.025   2.715
   19    H    SER   3           H        SER   3 -18.738  -5.215   5.306
   20    HA   SER   3           HA       SER   3 -18.761  -2.854   6.888
   21    HB2  SER   3          2HB       SER   3 -18.292  -5.086   7.859
   22    HB3  SER   3          3HB       SER   3 -16.786  -5.182   6.940
   23    HG   SER   3           HG       SER   3 -16.313  -4.459   8.993
   24    H    GLU   4           H        GLU   4 -17.377  -1.151   6.936
   25    HA   GLU   4           HA       GLU   4 -15.779  -0.551   4.672
   26    HB2  GLU   4          2HB       GLU   4 -15.236   1.561   5.890
   27    HB3  GLU   4          3HB       GLU   4 -16.956   1.237   5.801
   28    HG2  GLU   4          2HG       GLU   4 -16.589   2.096   7.966
   29    HG3  GLU   4          3HG       GLU   4 -16.802   0.361   8.187
   30    H    GLU   5           H        GLU   5 -15.087  -2.116   7.685
   31    HA   GLU   5           HA       GLU   5 -12.264  -1.833   7.799
   32    HB2  GLU   5          2HB       GLU   5 -13.608  -2.671   9.703
   33    HB3  GLU   5          3HB       GLU   5 -14.038  -4.117   8.793
   34    HG2  GLU   5          2HG       GLU   5 -11.620  -4.746   8.742
   35    HG3  GLU   5          3HG       GLU   5 -11.257  -3.340   9.737
   36    H    GLU   6           H        GLU   6 -14.404  -4.076   6.078
   37    HA   GLU   6           HA       GLU   6 -12.529  -5.939   5.101
   38    HB2  GLU   6          2HB       GLU   6 -15.144  -5.011   3.816
   39    HB3  GLU   6          3HB       GLU   6 -14.213  -6.412   3.289
   40    HG2  GLU   6          2HG       GLU   6 -14.539  -7.441   5.520
   41    HG3  GLU   6          3HG       GLU   6 -15.509  -6.051   5.997
   42    H    GLU   7           H        GLU   7 -13.456  -2.740   4.000
   43    HA   GLU   7           HA       GLU   7 -12.233  -2.741   1.467
   44    HB2  GLU   7          2HB       GLU   7 -12.682  -0.351   3.312
   45    HB3  GLU   7          3HB       GLU   7 -12.373  -0.277   1.577
   46    HG2  GLU   7          2HG       GLU   7 -14.809  -1.378   2.980
   47    HG3  GLU   7          3HG       GLU   7 -14.726   0.035   1.931
   48    H    LYS   8           H        LYS   8 -10.972  -1.900   4.681
   49    HA   LYS   8           HA       LYS   8  -8.461  -0.862   3.893
   50    HB2  LYS   8          2HB       LYS   8  -9.475  -2.067   6.491
   51    HB3  LYS   8          3HB       LYS   8  -7.775  -1.657   6.319
   52    HG2  LYS   8          2HG       LYS   8  -9.074   0.106   7.466
   53    HG3  LYS   8          3HG       LYS   8  -8.294   0.686   5.991
   54    HD2  LYS   8          2HD       LYS   8 -10.400   0.625   4.784
   55    HD3  LYS   8          3HD       LYS   8 -11.215  -0.153   6.145
   56    HE2  LYS   8          2HE       LYS   8  -9.983   2.620   6.280
   57    HE3  LYS   8          3HE       LYS   8 -11.678   2.309   5.906
   58    HZ1  LYS   8          1HZ       LYS   8 -11.278   2.830   8.252
   59    HZ2  LYS   8          2HZ       LYS   8 -10.339   1.432   8.397
   60    HZ3  LYS   8          3HZ       LYS   8 -11.983   1.315   8.033
   61    H    ARG   9           H        ARG   9  -9.520  -4.136   4.739
   62    HA   ARG   9           HA       ARG   9  -7.112  -5.563   4.507
   63    HB2  ARG   9          2HB       ARG   9  -9.179  -6.536   5.438
   64    HB3  ARG   9          3HB       ARG   9  -9.971  -6.415   3.873
   65    HG2  ARG   9          2HG       ARG   9  -8.268  -8.073   2.983
   66    HG3  ARG   9          3HG       ARG   9  -7.698  -8.274   4.644
   67    HD2  ARG   9          2HD       ARG   9  -9.976  -8.997   5.317
   68    HD3  ARG   9          3HD       ARG   9 -10.508  -8.830   3.638
   69    HE   ARG   9           HE       ARG   9  -8.254 -10.570   3.838
   70   HH11  ARG   9          1HH1      ARG   9 -11.729 -10.494   4.407
   71   HH12  ARG   9          2HH1      ARG   9 -11.915 -12.209   4.199
   72   HH21  ARG   9          1HH2      ARG   9  -8.510 -12.812   3.577
   73   HH22  ARG   9          2HH2      ARG   9 -10.089 -13.520   3.728
   74    H    GLN  10           H        GLN  10  -9.561  -4.744   2.084
   75    HA   GLN  10           HA       GLN  10  -8.468  -6.055  -0.164
   76    HB2  GLN  10          2HB       GLN  10 -10.239  -3.574  -0.027
   77    HB3  GLN  10          3HB       GLN  10  -9.923  -4.497  -1.492
   78    HG2  GLN  10          2HG       GLN  10 -11.128  -6.398  -0.671
   79    HG3  GLN  10          3HG       GLN  10 -11.226  -5.716   0.954
   80   HE21  GLN  10          1HE2      GLN  10 -13.469  -5.681   1.097
   81   HE22  GLN  10          2HE2      GLN  10 -14.463  -4.654   0.124
   82    H    VAL  11           H        VAL  11  -8.068  -2.742   1.062
   83    HA   VAL  11           HA       VAL  11  -6.594  -1.704  -1.129
   84    HB   VAL  11           HB       VAL  11  -6.824  -0.707   1.757
   85   HG11  VAL  11          1HG1      VAL  11  -6.001   1.466   0.920
   86   HG12  VAL  11          2HG1      VAL  11  -5.714   0.751  -0.663
   87   HG13  VAL  11          3HG1      VAL  11  -4.785   0.207   0.726
   88   HG21  VAL  11          1HG2      VAL  11  -8.220   0.235  -0.777
   89   HG22  VAL  11          2HG2      VAL  11  -8.436   0.903   0.843
   90   HG23  VAL  11          3HG2      VAL  11  -8.952  -0.744   0.491
   91    H    LYS  12           H        LYS  12  -5.587  -3.008   2.042
   92    HA   LYS  12           HA       LYS  12  -2.804  -2.626   1.790
   93    HB2  LYS  12          2HB       LYS  12  -4.368  -4.755   3.309
   94    HB3  LYS  12          3HB       LYS  12  -2.627  -4.534   3.460
   95    HG2  LYS  12          2HG       LYS  12  -2.976  -2.263   4.336
   96    HG3  LYS  12          3HG       LYS  12  -4.724  -2.460   4.179
   97    HD2  LYS  12          2HD       LYS  12  -2.933  -4.212   5.911
   98    HD3  LYS  12          3HD       LYS  12  -3.875  -2.851   6.507
   99    HE2  LYS  12          2HE       LYS  12  -5.959  -3.975   5.858
  100    HE3  LYS  12          3HE       LYS  12  -5.037  -5.326   5.190
  101    HZ1  LYS  12          1HZ       LYS  12  -4.131  -5.684   7.460
  102    HZ2  LYS  12          2HZ       LYS  12  -5.797  -5.923   7.350
  103    HZ3  LYS  12          3HZ       LYS  12  -5.193  -4.498   8.036
  104    H    GLN  13           H        GLN  13  -4.962  -5.205   0.730
  105    HA   GLN  13           HA       GLN  13  -3.002  -7.055  -0.146
  106    HB2  GLN  13          2HB       GLN  13  -5.380  -7.665   0.304
  107    HB3  GLN  13          3HB       GLN  13  -5.895  -6.720  -1.088
  108    HG2  GLN  13          2HG       GLN  13  -4.620  -8.246  -2.568
  109    HG3  GLN  13          3HG       GLN  13  -4.139  -9.188  -1.159
  110   HE21  GLN  13          1HE2      GLN  13  -7.368  -7.798  -1.690
  111   HE22  GLN  13          2HE2      GLN  13  -8.181  -9.312  -1.862
  112    H    VAL  14           H        VAL  14  -4.917  -4.601  -1.944
  113    HA   VAL  14           HA       VAL  14  -3.779  -4.936  -4.490
  114    HB   VAL  14           HB       VAL  14  -4.871  -2.362  -3.223
  115   HG11  VAL  14          1HG1      VAL  14  -4.402  -2.979  -6.168
  116   HG12  VAL  14          2HG1      VAL  14  -3.506  -1.813  -5.189
  117   HG13  VAL  14          3HG1      VAL  14  -5.216  -1.546  -5.535
  118   HG21  VAL  14          1HG2      VAL  14  -6.982  -2.895  -4.408
  119   HG22  VAL  14          2HG2      VAL  14  -6.549  -4.162  -3.263
  120   HG23  VAL  14          3HG2      VAL  14  -6.281  -4.411  -4.986
  121    H    ALA  15           H        ALA  15  -2.821  -2.920  -1.747
  122    HA   ALA  15           HA       ALA  15  -0.775  -1.420  -2.968
  123    HB1  ALA  15          1HB       ALA  15  -1.930  -0.736  -0.903
  124    HB2  ALA  15          2HB       ALA  15  -0.181  -0.776  -0.665
  125    HB3  ALA  15          3HB       ALA  15  -1.191  -2.077  -0.027
  126    H    LYS  16           H        LYS  16  -0.699  -4.469  -1.131
  127    HA   LYS  16           HA       LYS  16   2.163  -4.584  -0.981
  128    HB2  LYS  16          2HB       LYS  16   1.905  -6.718   0.098
  129    HB3  LYS  16          3HB       LYS  16   0.672  -5.645   0.731
  130    HG2  LYS  16          2HG       LYS  16  -1.018  -6.745  -0.661
  131    HG3  LYS  16          3HG       LYS  16   0.212  -7.798  -1.357
  132    HD2  LYS  16          2HD       LYS  16  -0.667  -7.739   1.563
  133    HD3  LYS  16          3HD       LYS  16  -1.055  -8.985   0.374
  134    HE2  LYS  16          2HE       LYS  16   1.400  -9.476   0.167
  135    HE3  LYS  16          3HE       LYS  16   1.698  -8.325   1.472
  136    HZ1  LYS  16          1HZ       LYS  16   1.617 -10.581   2.305
  137    HZ2  LYS  16          2HZ       LYS  16   0.063 -10.800   1.680
  138    HZ3  LYS  16          3HZ       LYS  16   0.322  -9.691   2.932
  139    H    GLU  17           H        GLU  17  -0.303  -5.963  -3.122
  140    HA   GLU  17           HA       GLU  17   1.399  -7.694  -4.591
  141    HB2  GLU  17          2HB       GLU  17  -1.170  -6.316  -5.475
  142    HB3  GLU  17          3HB       GLU  17  -0.359  -7.593  -6.376
  143    HG2  GLU  17          2HG       GLU  17  -1.704  -7.820  -3.682
  144    HG3  GLU  17          3HG       GLU  17  -2.229  -8.529  -5.201
  145    H    LYS  18           H        LYS  18   0.532  -4.285  -4.929
  146    HA   LYS  18           HA       LYS  18   1.834  -3.728  -7.369
  147    HB2  LYS  18          2HB       LYS  18   1.156  -1.944  -4.992
  148    HB3  LYS  18          3HB       LYS  18   1.825  -1.323  -6.496
  149    HG2  LYS  18          2HG       LYS  18  -0.812  -2.778  -6.197
  150    HG3  LYS  18          3HG       LYS  18  -0.616  -1.038  -6.417
  151    HD2  LYS  18          2HD       LYS  18   0.169  -1.318  -8.664
  152    HD3  LYS  18          3HD       LYS  18   0.418  -3.049  -8.442
  153    HE2  LYS  18          2HE       LYS  18  -2.083  -3.296  -8.188
  154    HE3  LYS  18          3HE       LYS  18  -2.235  -1.595  -8.657
  155    HZ1  LYS  18          1HZ       LYS  18  -1.252  -2.066 -10.762
  156    HZ2  LYS  18          2HZ       LYS  18  -2.465  -3.215 -10.516
  157    HZ3  LYS  18          3HZ       LYS  18  -0.843  -3.642 -10.301
  158    H    LEU  19           H        LEU  19   2.979  -3.764  -4.018
  159    HA   LEU  19           HA       LEU  19   5.641  -2.843  -4.563
  160    HB2  LEU  19          2HB       LEU  19   4.599  -4.432  -2.183
  161    HB3  LEU  19          3HB       LEU  19   6.179  -3.674  -2.284
  162    HG   LEU  19           HG       LEU  19   3.482  -2.325  -2.039
  163   HD11  LEU  19          1HD1      LEU  19   4.516  -1.276  -0.079
  164   HD12  LEU  19          2HD1      LEU  19   6.016  -2.154  -0.388
  165   HD13  LEU  19          3HD1      LEU  19   4.545  -3.034   0.034
  166   HD21  LEU  19          1HD2      LEU  19   4.623  -0.146  -2.301
  167   HD22  LEU  19          2HD2      LEU  19   4.643  -1.093  -3.784
  168   HD23  LEU  19          3HD2      LEU  19   6.100  -0.982  -2.790
  169    H    LEU  20           H        LEU  20   4.083  -5.975  -4.547
  170    HA   LEU  20           HA       LEU  20   6.490  -7.543  -4.757
  171    HB2  LEU  20          2HB       LEU  20   3.559  -8.210  -5.220
  172    HB3  LEU  20          3HB       LEU  20   4.848  -9.401  -5.354
  173    HG   LEU  20           HG       LEU  20   4.330  -7.819  -2.806
  174   HD11  LEU  20          1HD1      LEU  20   3.191  -9.776  -1.904
  175   HD12  LEU  20          2HD1      LEU  20   3.320 -10.597  -3.462
  176   HD13  LEU  20          3HD1      LEU  20   2.338  -9.138  -3.308
  177   HD21  LEU  20          1HD2      LEU  20   5.943 -10.347  -3.284
  178   HD22  LEU  20          2HD2      LEU  20   5.694  -9.544  -1.730
  179   HD23  LEU  20          3HD2      LEU  20   6.600  -8.731  -3.002
  180    H    GLU  21           H        GLU  21   4.480  -5.809  -6.993
  181    HA   GLU  21           HA       GLU  21   5.560  -7.001  -9.396
  182    HB2  GLU  21          2HB       GLU  21   4.039  -4.380  -8.989
  183    HB3  GLU  21          3HB       GLU  21   4.556  -4.990 -10.562
  184    HG2  GLU  21          2HG       GLU  21   3.200  -7.061 -10.141
  185    HG3  GLU  21          3HG       GLU  21   2.604  -6.310  -8.665
  186    H    GLN  22           H        GLN  22   6.598  -4.597  -7.145
  187    HA   GLN  22           HA       GLN  22   8.698  -3.523  -8.878
  188    HB2  GLN  22          2HB       GLN  22   8.201  -3.057  -5.900
  189    HB3  GLN  22          3HB       GLN  22   9.288  -2.134  -6.934
  190    HG2  GLN  22          2HG       GLN  22   7.381  -1.283  -8.217
  191    HG3  GLN  22          3HG       GLN  22   6.272  -2.244  -7.246
  192   HE21  GLN  22          1HE2      GLN  22   7.708  -1.664  -4.722
  193   HE22  GLN  22          2HE2      GLN  22   7.277  -0.044  -4.328
  194    H    SER  23           H        SER  23   8.319  -5.758  -6.166
  195    HA   SER  23           HA       SER  23  10.860  -7.042  -6.630
  196    HB2  SER  23          2HB       SER  23  11.483  -5.101  -5.144
  197    HB3  SER  23          3HB       SER  23  10.368  -5.707  -3.920
  198    HG   SER  23           HG       SER  23  12.811  -6.776  -4.806
  199    HA   PRO  24           HA       PRO  24   7.580  -9.966  -5.234
  200    HB2  PRO  24          2HB       PRO  24   8.457 -12.176  -6.564
  201    HB3  PRO  24          3HB       PRO  24   7.678 -10.822  -7.411
  202    HG2  PRO  24          2HG       PRO  24  10.605 -11.450  -7.170
  203    HG3  PRO  24          3HG       PRO  24   9.677 -10.951  -8.603
  204    HD2  PRO  24          2HD       PRO  24  11.177  -9.194  -7.107
  205    HD3  PRO  24          3HD       PRO  24   9.739  -8.705  -8.030
  206    H    ASN  25           H        ASN  25  11.043 -10.300  -4.898
  207    HA   ASN  25           HA       ASN  25  11.072 -12.709  -3.328
  208    HB2  ASN  25          2HB       ASN  25  13.267 -10.621  -3.746
  209    HB3  ASN  25          3HB       ASN  25  13.488 -12.243  -3.086
  210   HD21  ASN  25          1HD2      ASN  25  13.456 -14.013  -4.495
  211   HD22  ASN  25          2HD2      ASN  25  13.510 -13.840  -6.212
  212    H    SER  26           H        SER  26  10.816  -9.314  -2.656
  213    HA   SER  26           HA       SER  26  11.771  -9.442   0.062
  214    HB2  SER  26          2HB       SER  26  10.422  -7.201  -1.504
  215    HB3  SER  26          3HB       SER  26  11.159  -7.027   0.094
  216    HG   SER  26           HG       SER  26  12.353  -6.813  -2.226
  217    H    LYS  27           H        LYS  27  10.609  -9.808   1.836
  218    HA   LYS  27           HA       LYS  27   7.807 -10.399   1.791
  219    HB2  LYS  27          2HB       LYS  27   9.350 -11.592   3.292
  220    HB3  LYS  27          3HB       LYS  27   9.736 -10.095   4.132
  221    HG2  LYS  27          2HG       LYS  27   7.468  -9.947   5.012
  222    HG3  LYS  27          3HG       LYS  27   6.967 -11.357   4.074
  223    HD2  LYS  27          2HD       LYS  27   9.122 -11.421   6.227
  224    HD3  LYS  27          3HD       LYS  27   7.428 -11.814   6.525
  225    HE2  LYS  27          2HE       LYS  27   9.274 -13.284   4.607
  226    HE3  LYS  27          3HE       LYS  27   8.792 -13.847   6.209
  227    HZ1  LYS  27          1HZ       LYS  27   7.457 -14.905   4.530
  228    HZ2  LYS  27          2HZ       LYS  27   6.987 -13.415   3.885
  229    HZ3  LYS  27          3HZ       LYS  27   6.477 -13.865   5.432
  230    H    VAL  28           H        VAL  28   6.178  -9.020   2.018
  231    HA   VAL  28           HA       VAL  28   6.707  -6.200   2.708
  232    HB   VAL  28           HB       VAL  28   4.218  -7.421   1.395
  233   HG11  VAL  28          1HG1      VAL  28   5.140  -4.530   1.633
  234   HG12  VAL  28          2HG1      VAL  28   3.798  -5.270   2.507
  235   HG13  VAL  28          3HG1      VAL  28   3.711  -5.085   0.757
  236   HG21  VAL  28          1HG2      VAL  28   5.102  -6.571  -0.753
  237   HG22  VAL  28          2HG2      VAL  28   6.197  -7.760  -0.047
  238   HG23  VAL  28          3HG2      VAL  28   6.583  -6.042   0.053
  239    H    GLN  29           H        GLN  29   6.368  -5.765   4.809
  240    HA   GLN  29           HA       GLN  29   4.235  -7.060   6.369
  241    HB2  GLN  29          2HB       GLN  29   6.472  -6.886   7.402
  242    HB3  GLN  29          3HB       GLN  29   6.500  -5.149   7.138
  243    HG2  GLN  29          2HG       GLN  29   6.077  -5.776   9.496
  244    HG3  GLN  29          3HG       GLN  29   4.789  -4.797   8.806
  245   HE21  GLN  29          1HE2      GLN  29   5.144  -8.293   8.257
  246   HE22  GLN  29          2HE2      GLN  29   3.713  -8.740   9.110
  247    H    VAL  30           H        VAL  30   2.552  -5.803   7.340
  248    HA   VAL  30           HA       VAL  30   1.933  -3.230   6.097
  249    HB   VAL  30           HB       VAL  30   0.045  -4.719   6.276
  250   HG11  VAL  30          1HG1      VAL  30  -0.830  -5.654   8.378
  251   HG12  VAL  30          2HG1      VAL  30   0.529  -4.952   9.263
  252   HG13  VAL  30          3HG1      VAL  30   0.817  -6.208   8.059
  253   HG21  VAL  30          1HG2      VAL  30  -1.579  -3.371   7.575
  254   HG22  VAL  30          2HG2      VAL  30  -0.477  -2.347   6.654
  255   HG23  VAL  30          3HG2      VAL  30  -0.245  -2.548   8.392
  256    H    ARG  31           H        ARG  31   3.031  -1.551   6.901
  257    HA   ARG  31           HA       ARG  31   4.072  -1.461   9.599
  258    HB2  ARG  31          2HB       ARG  31   5.395  -0.549   7.720
  259    HB3  ARG  31          3HB       ARG  31   4.129   0.622   7.368
  260    HG2  ARG  31          2HG       ARG  31   5.980   1.698   8.547
  261    HG3  ARG  31          3HG       ARG  31   4.524   1.724   9.543
  262    HD2  ARG  31          2HD       ARG  31   5.429  -0.330  10.739
  263    HD3  ARG  31          3HD       ARG  31   6.940  -0.093   9.854
  264    HE   ARG  31           HE       ARG  31   5.987   2.203  11.376
  265   HH11  ARG  31          1HH1      ARG  31   8.061  -0.650  11.404
  266   HH12  ARG  31          2HH1      ARG  31   9.039  -0.072  12.719
  267   HH21  ARG  31          1HH2      ARG  31   7.247   2.939  13.103
  268   HH22  ARG  31          2HH2      ARG  31   8.570   1.981  13.688
  269    H    ARG  32           H        ARG  32   1.535   0.231   7.768
  270    HA   ARG  32           HA       ARG  32  -0.132   0.686  10.022
  271    HB2  ARG  32          2HB       ARG  32   1.562   2.481  10.462
  272    HB3  ARG  32          3HB       ARG  32   1.281   3.150   8.865
  273    HG2  ARG  32          2HG       ARG  32   0.187   4.503  10.576
  274    HG3  ARG  32          3HG       ARG  32  -1.019   3.767   9.518
  275    HD2  ARG  32          2HD       ARG  32  -1.745   3.666  11.857
  276    HD3  ARG  32          3HD       ARG  32  -1.468   2.044  11.228
  277    HE   ARG  32           HE       ARG  32   0.518   1.887  12.533
  278   HH11  ARG  32          1HH1      ARG  32  -1.367   4.763  13.283
  279   HH12  ARG  32          2HH1      ARG  32  -0.601   5.016  14.820
  280   HH21  ARG  32          1HH2      ARG  32   1.528   2.233  14.537
  281   HH22  ARG  32          2HH2      ARG  32   1.048   3.575  15.531
  282    H    VAL  33           H        VAL  33  -2.199   1.541   9.377
  283    HA   VAL  33           HA       VAL  33  -2.626   1.923   6.457
  284    HB   VAL  33           HB       VAL  33  -4.746   1.048   8.503
  285   HG11  VAL  33          1HG1      VAL  33  -6.081   0.464   6.499
  286   HG12  VAL  33          2HG1      VAL  33  -4.793   1.068   5.454
  287   HG13  VAL  33          3HG1      VAL  33  -5.662   2.179   6.516
  288   HG21  VAL  33          1HG2      VAL  33  -4.540  -1.228   7.564
  289   HG22  VAL  33          2HG2      VAL  33  -3.042  -0.701   8.337
  290   HG23  VAL  33          3HG2      VAL  33  -3.174  -0.698   6.576
  291    H    GLN  34           H        GLN  34  -2.908   4.071   6.050
  292    HA   GLN  34           HA       GLN  34  -4.244   5.813   8.035
  293    HB2  GLN  34          2HB       GLN  34  -2.524   6.512   5.626
  294    HB3  GLN  34          3HB       GLN  34  -3.341   7.695   6.655
  295    HG2  GLN  34          2HG       GLN  34  -2.046   6.879   8.603
  296    HG3  GLN  34          3HG       GLN  34  -1.208   5.735   7.549
  297   HE21  GLN  34          1HE2      GLN  34   0.209   6.561   5.951
  298   HE22  GLN  34          2HE2      GLN  34   0.877   8.135   6.108
  299    H    LYS  35           H        LYS  35  -6.074   7.048   7.390
  300    HA   LYS  35           HA       LYS  35  -7.300   6.460   4.763
  301    HB2  LYS  35          2HB       LYS  35  -8.124   4.893   6.655
  302    HB3  LYS  35          3HB       LYS  35  -8.858   6.303   7.399
  303    HG2  LYS  35          2HG       LYS  35  -9.550   5.452   4.577
  304    HG3  LYS  35          3HG       LYS  35 -10.331   4.729   5.975
  305    HD2  LYS  35          2HD       LYS  35 -11.091   7.056   6.644
  306    HD3  LYS  35          3HD       LYS  35 -10.446   7.646   5.108
  307    HE2  LYS  35          2HE       LYS  35 -11.996   6.199   3.867
  308    HE3  LYS  35          3HE       LYS  35 -12.595   5.504   5.375
  309    HZ1  LYS  35          1HZ       LYS  35 -14.119   7.156   4.574
  310    HZ2  LYS  35          2HZ       LYS  35 -12.905   8.327   4.493
  311    HZ3  LYS  35          3HZ       LYS  35 -13.402   7.730   5.994
  312    H    GLN  36           H        GLN  36  -7.706   8.370   3.869
  313    HA   GLN  36           HA       GLN  36  -8.420  10.745   5.483
  314    HB2  GLN  36          2HB       GLN  36  -6.325  10.679   3.245
  315    HB3  GLN  36          3HB       GLN  36  -6.904  12.134   4.048
  316    HG2  GLN  36          2HG       GLN  36  -5.905  11.428   6.149
  317    HG3  GLN  36          3HG       GLN  36  -5.424   9.887   5.445
  318   HE21  GLN  36          1HE2      GLN  36  -4.730  13.322   5.578
  319   HE22  GLN  36          2HE2      GLN  36  -3.187  13.234   4.806
  320    H    GLY  37           H        GLY  37 -10.539  10.769   4.823
  321    HA2  GLY  37          2HA       GLY  37 -12.367  11.228   3.514
  322    HA3  GLY  37          3HA       GLY  37 -11.263  11.766   2.255
  323    H    ASN  38           H        ASN  38 -10.659  10.335   0.616
  324    HA   ASN  38           HA       ASN  38 -11.986   7.674   0.538
  325    HB2  ASN  38          2HB       ASN  38 -11.259   9.543  -1.771
  326    HB3  ASN  38          3HB       ASN  38 -11.794   7.882  -1.990
  327   HD21  ASN  38          1HD2      ASN  38 -13.973   7.346  -1.514
  328   HD22  ASN  38          2HD2      ASN  38 -15.201   8.557  -1.437
  329    H    THR  39           H        THR  39  -8.968   9.404   0.363
  330    HA   THR  39           HA       THR  39  -7.468   7.287  -0.922
  331    HB   THR  39           HB       THR  39  -6.359   9.761   0.470
  332    HG1  THR  39           HG1      THR  39  -6.261  10.314  -1.982
  333   HG21  THR  39          1HG2      THR  39  -5.165   7.959  -1.689
  334   HG22  THR  39          2HG2      THR  39  -4.656   8.024   0.002
  335   HG23  THR  39          3HG2      THR  39  -4.421   9.423  -1.043
  336    H    ILE  40           H        ILE  40  -7.405   5.467   0.340
  337    HA   ILE  40           HA       ILE  40  -6.355   5.580   3.061
  338    HB   ILE  40           HB       ILE  40  -6.946   3.162   1.278
  339   HG12  ILE  40          2HG1      ILE  40  -8.502   4.445   3.561
  340   HG13  ILE  40          3HG1      ILE  40  -8.990   4.363   1.875
  341   HG21  ILE  40          1HG2      ILE  40  -6.223   3.214   4.241
  342   HG22  ILE  40          2HG2      ILE  40  -5.190   2.622   2.939
  343   HG23  ILE  40          3HG2      ILE  40  -6.693   1.785   3.318
  344   HD11  ILE  40          1HD1      ILE  40  -8.756   2.034   3.780
  345   HD12  ILE  40          2HD1      ILE  40  -9.235   1.936   2.082
  346   HD13  ILE  40          3HD1      ILE  40 -10.239   2.814   3.232
  347    H    ARG  41           H        ARG  41  -4.276   6.160   3.195
  348    HA   ARG  41           HA       ARG  41  -2.255   5.260   1.259
  349    HB2  ARG  41          2HB       ARG  41  -2.061   7.155   3.648
  350    HB3  ARG  41          3HB       ARG  41  -0.719   6.764   2.574
  351    HG2  ARG  41          2HG       ARG  41  -1.982   7.774   0.679
  352    HG3  ARG  41          3HG       ARG  41  -3.273   8.221   1.800
  353    HD2  ARG  41          2HD       ARG  41  -1.732   9.651   3.050
  354    HD3  ARG  41          3HD       ARG  41  -0.384   9.142   2.028
  355    HE   ARG  41           HE       ARG  41  -2.028  10.194   0.197
  356   HH11  ARG  41          1HH1      ARG  41  -0.997  11.482   3.315
  357   HH12  ARG  41          2HH1      ARG  41  -1.114  13.137   2.809
  358   HH21  ARG  41          1HH2      ARG  41  -2.138  12.365  -0.463
  359   HH22  ARG  41          2HH2      ARG  41  -1.766  13.642   0.653
  360    H    VAL  42           H        VAL  42  -1.985   3.094   1.722
  361    HA   VAL  42           HA       VAL  42  -1.551   2.166   4.435
  362    HB   VAL  42           HB       VAL  42  -1.074   0.626   1.828
  363   HG11  VAL  42          1HG1      VAL  42  -1.262  -1.388   3.234
  364   HG12  VAL  42          2HG1      VAL  42  -1.491  -0.385   4.672
  365   HG13  VAL  42          3HG1      VAL  42   0.049  -0.354   3.811
  366   HG21  VAL  42          1HG2      VAL  42  -3.561   0.713   3.573
  367   HG22  VAL  42          2HG2      VAL  42  -3.308  -0.364   2.195
  368   HG23  VAL  42          3HG2      VAL  42  -3.405   1.381   1.943
  369    H    GLU  43           H        GLU  43   0.317   2.505   5.420
  370    HA   GLU  43           HA       GLU  43   2.864   2.838   4.054
  371    HB2  GLU  43          2HB       GLU  43   2.319   2.507   7.041
  372    HB3  GLU  43          3HB       GLU  43   3.761   3.196   6.297
  373    HG2  GLU  43          2HG       GLU  43   0.978   4.393   6.302
  374    HG3  GLU  43          3HG       GLU  43   2.338   4.931   7.284
  375    H    LEU  44           H        LEU  44   3.868   1.016   3.315
  376    HA   LEU  44           HA       LEU  44   3.642  -1.474   4.920
  377    HB2  LEU  44          2HB       LEU  44   4.287  -1.451   1.947
  378    HB3  LEU  44          3HB       LEU  44   3.838  -2.805   2.967
  379    HG   LEU  44           HG       LEU  44   1.537  -1.420   3.201
  380   HD11  LEU  44          1HD1      LEU  44   0.932  -0.303   1.104
  381   HD12  LEU  44          2HD1      LEU  44   2.578  -0.518   0.502
  382   HD13  LEU  44          3HD1      LEU  44   2.276   0.509   1.907
  383   HD21  LEU  44          1HD2      LEU  44   2.190  -3.103   0.767
  384   HD22  LEU  44          2HD2      LEU  44   0.572  -2.739   1.381
  385   HD23  LEU  44          3HD2      LEU  44   1.683  -3.708   2.346
  386    H    GLU  45           H        GLU  45   5.476  -2.619   5.288
  387    HA   GLU  45           HA       GLU  45   8.024  -1.166   4.984
  388    HB2  GLU  45          2HB       GLU  45   7.076  -1.487   7.272
  389    HB3  GLU  45          3HB       GLU  45   7.102  -3.231   7.046
  390    HG2  GLU  45          2HG       GLU  45   9.568  -3.172   6.928
  391    HG3  GLU  45          3HG       GLU  45   9.539  -1.417   7.136
  392    H    LEU  46           H        LEU  46   9.048  -1.974   3.258
  393    HA   LEU  46           HA       LEU  46   9.131  -4.898   2.732
  394    HB2  LEU  46          2HB       LEU  46   7.820  -3.686   1.050
  395    HB3  LEU  46          3HB       LEU  46   9.115  -2.547   0.781
  396    HG   LEU  46           HG       LEU  46   9.551  -5.493   0.147
  397   HD11  LEU  46          1HD1      LEU  46   8.794  -5.138  -2.154
  398   HD12  LEU  46          2HD1      LEU  46   8.274  -3.496  -1.755
  399   HD13  LEU  46          3HD1      LEU  46   7.470  -4.884  -1.018
  400   HD21  LEU  46          1HD2      LEU  46  11.524  -4.032   0.053
  401   HD22  LEU  46          2HD2      LEU  46  10.700  -2.958  -1.078
  402   HD23  LEU  46          3HD2      LEU  46  11.098  -4.613  -1.556
  403    H    ARG  47           H        ARG  47  11.129  -5.798   2.504
  404    HA   ARG  47           HA       ARG  47  13.477  -4.059   3.015
  405    HB2  ARG  47          2HB       ARG  47  13.272  -7.093   3.329
  406    HB3  ARG  47          3HB       ARG  47  14.549  -6.043   3.941
  407    HG2  ARG  47          2HG       ARG  47  13.058  -5.074   5.587
  408    HG3  ARG  47          3HG       ARG  47  11.665  -5.898   4.878
  409    HD2  ARG  47          2HD       ARG  47  14.014  -7.234   6.270
  410    HD3  ARG  47          3HD       ARG  47  12.387  -7.026   6.927
  411    HE   ARG  47           HE       ARG  47  12.298  -8.423   4.457
  412   HH11  ARG  47          1HH1      ARG  47  13.129  -8.965   7.841
  413   HH12  ARG  47          2HH1      ARG  47  12.804 -10.667   7.766
  414   HH21  ARG  47          1HH2      ARG  47  11.940 -10.664   4.360
  415   HH22  ARG  47          2HH2      ARG  47  12.132 -11.631   5.789
  416    H    THR  48           H        THR  48  14.086  -3.411   0.962
  417    HA   THR  48           HA       THR  48  14.185  -5.164  -1.326
  418    HB   THR  48           HB       THR  48  15.340  -2.351  -0.958
  419    HG1  THR  48           HG1      THR  48  13.335  -1.770  -1.175
  420   HG21  THR  48          1HG2      THR  48  14.832  -3.914  -3.525
  421   HG22  THR  48          2HG2      THR  48  16.418  -3.507  -2.865
  422   HG23  THR  48          3HG2      THR  48  15.345  -2.226  -3.428
  423    H    ASN  49           H        ASN  49  15.577  -6.839  -0.988
  424    HA   ASN  49           HA       ASN  49  17.465  -8.074  -0.796
  425    HB2  ASN  49          2HB       ASN  49  18.856  -5.492  -1.651
  426    HB3  ASN  49          3HB       ASN  49  19.600  -7.088  -1.624
  427   HD21  ASN  49          1HD2      ASN  49  20.049  -6.979  -3.844
  428   HD22  ASN  49          2HD2      ASN  49  18.818  -7.147  -5.045
  429    H    GLY  50           H        GLY  50  16.433  -6.606   1.537
  430    HA2  GLY  50          2HA       GLY  50  17.078  -6.956   3.791
  431    HA3  GLY  50          3HA       GLY  50  18.768  -6.856   3.331
  432    H    LYS  51           H        LYS  51  17.582  -4.329   1.700
  433    HA   LYS  51           HA       LYS  51  18.138  -2.385   3.788
  434    HB2  LYS  51          2HB       LYS  51  17.341  -2.022   0.865
  435    HB3  LYS  51          3HB       LYS  51  17.758  -0.703   1.947
  436    HG2  LYS  51          2HG       LYS  51  19.679  -2.937   1.207
  437    HG3  LYS  51          3HG       LYS  51  19.556  -1.418   0.328
  438    HD2  LYS  51          2HD       LYS  51  21.361  -0.988   1.745
  439    HD3  LYS  51          3HD       LYS  51  20.022  -0.298   2.656
  440    HE2  LYS  51          2HE       LYS  51  19.941  -2.334   4.059
  441    HE3  LYS  51          3HE       LYS  51  21.271  -3.024   3.130
  442    HZ1  LYS  51          1HZ       LYS  51  21.419  -0.537   4.760
  443    HZ2  LYS  51          2HZ       LYS  51  22.686  -1.210   3.870
  444    HZ3  LYS  51          3HZ       LYS  51  22.045  -2.042   5.194
  445    H    LYS  52           H        LYS  52  16.606  -1.435   5.028
  446    HA   LYS  52           HA       LYS  52  13.844  -2.279   4.781
  447    HB2  LYS  52          2HB       LYS  52  14.957  -2.243   6.987
  448    HB3  LYS  52          3HB       LYS  52  15.229  -0.509   6.847
  449    HG2  LYS  52          2HG       LYS  52  12.771  -0.134   6.848
  450    HG3  LYS  52          3HG       LYS  52  12.514  -1.875   7.030
  451    HD2  LYS  52          2HD       LYS  52  13.677  -1.835   9.201
  452    HD3  LYS  52          3HD       LYS  52  14.013  -0.110   9.009
  453    HE2  LYS  52          2HE       LYS  52  11.629   0.394   9.084
  454    HE3  LYS  52          3HE       LYS  52  11.243  -1.327   9.165
  455    HZ1  LYS  52          1HZ       LYS  52  11.134  -0.358  11.336
  456    HZ2  LYS  52          2HZ       LYS  52  12.704   0.245  11.210
  457    HZ3  LYS  52          3HZ       LYS  52  12.447  -1.426  11.286
  458    H    GLU  53           H        GLU  53  12.563  -1.217   3.433
  459    HA   GLU  53           HA       GLU  53  12.640   1.734   3.242
  460    HB2  GLU  53          2HB       GLU  53  12.131  -0.181   0.914
  461    HB3  GLU  53          3HB       GLU  53  12.179   1.580   0.835
  462    HG2  GLU  53          2HG       GLU  53  14.613   1.379   1.661
  463    HG3  GLU  53          3HG       GLU  53  14.469  -0.341   1.311
  464    H    ASN  54           H        ASN  54  10.774   2.485   4.030
  465    HA   ASN  54           HA       ASN  54   8.279   1.006   3.952
  466    HB2  ASN  54          2HB       ASN  54   8.831   3.910   4.758
  467    HB3  ASN  54          3HB       ASN  54   7.299   3.064   4.982
  468   HD21  ASN  54          1HD2      ASN  54  10.598   3.361   6.105
  469   HD22  ASN  54          2HD2      ASN  54  10.392   2.438   7.548
  470    H    TYR  55           H        TYR  55   6.482   1.553   2.652
  471    HA   TYR  55           HA       TYR  55   6.897   3.424   0.392
  472    HB2  TYR  55          2HB       TYR  55   5.716   0.601   0.288
  473    HB3  TYR  55          3HB       TYR  55   5.572   1.770  -1.020
  474    HD1  TYR  55           HD1      TYR  55   7.369   2.074  -2.601
  475    HD2  TYR  55           HD2      TYR  55   8.035  -0.294   0.889
  476    HE1  TYR  55           HE1      TYR  55   9.492   1.262  -3.550
  477    HE2  TYR  55           HE2      TYR  55  10.139  -1.113  -0.062
  478    HH   TYR  55           HH       TYR  55  11.716   0.282  -2.580
  479    H    THR  56           H        THR  56   5.394   4.965   0.582
  480    HA   THR  56           HA       THR  56   2.788   4.537   1.794
  481    HB   THR  56           HB       THR  56   4.006   6.953   0.363
  482    HG1  THR  56           HG1      THR  56   3.752   6.272   3.117
  483   HG21  THR  56          1HG2      THR  56   1.537   7.058   0.298
  484   HG22  THR  56          2HG2      THR  56   2.199   8.277   1.386
  485   HG23  THR  56          3HG2      THR  56   1.478   6.812   2.050
  486    H    VAL  57           H        VAL  57   1.609   3.154   0.483
  487    HA   VAL  57           HA       VAL  57   1.322   3.823  -2.384
  488    HB   VAL  57           HB       VAL  57   0.172   1.395  -0.908
  489   HG11  VAL  57          1HG1      VAL  57   0.406   1.978  -3.894
  490   HG12  VAL  57          2HG1      VAL  57  -1.084   1.998  -2.951
  491   HG13  VAL  57          3HG1      VAL  57  -0.212   0.483  -3.180
  492   HG21  VAL  57          1HG2      VAL  57   2.637   1.337  -0.898
  493   HG22  VAL  57          2HG2      VAL  57   2.663   1.564  -2.648
  494   HG23  VAL  57          3HG2      VAL  57   1.980   0.088  -1.959
  495    H    GLU  58           H        GLU  58   0.025   5.452  -2.542
  496    HA   GLU  58           HA       GLU  58  -2.271   5.973  -0.863
  497    HB2  GLU  58          2HB       GLU  58  -1.396   7.372  -3.437
  498    HB3  GLU  58          3HB       GLU  58  -2.500   8.007  -2.216
  499    HG2  GLU  58          2HG       GLU  58  -0.626   8.110  -0.595
  500    HG3  GLU  58          3HG       GLU  58   0.464   7.468  -1.822
  501    H    VAL  59           H        VAL  59  -3.859   4.466  -1.211
  502    HA   VAL  59           HA       VAL  59  -4.818   4.012  -3.985
  503    HB   VAL  59           HB       VAL  59  -5.497   2.348  -1.512
  504   HG11  VAL  59          1HG1      VAL  59  -6.207   0.654  -3.164
  505   HG12  VAL  59          2HG1      VAL  59  -5.804   1.765  -4.477
  506   HG13  VAL  59          3HG1      VAL  59  -7.102   2.164  -3.349
  507   HG21  VAL  59          1HG2      VAL  59  -3.061   2.206  -1.884
  508   HG22  VAL  59          2HG2      VAL  59  -3.333   1.741  -3.566
  509   HG23  VAL  59          3HG2      VAL  59  -3.850   0.671  -2.257
  510    H    GLU  60           H        GLU  60  -6.420   5.397  -4.419
  511    HA   GLU  60           HA       GLU  60  -8.177   6.439  -2.295
  512    HB2  GLU  60          2HB       GLU  60  -6.889   8.087  -3.602
  513    HB3  GLU  60          3HB       GLU  60  -7.566   7.462  -5.101
  514    HG2  GLU  60          2HG       GLU  60  -9.806   8.235  -4.431
  515    HG3  GLU  60          3HG       GLU  60  -9.158   8.829  -2.900
  516    H    ARG  61           H        ARG  61 -10.386   6.399  -2.532
  517    HA   ARG  61           HA       ARG  61 -11.512   4.195  -4.023
  518    HB2  ARG  61          2HB       ARG  61 -12.148   4.706  -1.689
  519    HB3  ARG  61          3HB       ARG  61 -12.780   6.268  -2.186
  520    HG2  ARG  61          2HG       ARG  61 -14.577   4.694  -1.819
  521    HG3  ARG  61          3HG       ARG  61 -14.509   5.156  -3.517
  522    HD2  ARG  61          2HD       ARG  61 -13.623   3.040  -4.160
  523    HD3  ARG  61          3HD       ARG  61 -13.233   2.603  -2.487
  524    HE   ARG  61           HE       ARG  61 -16.030   3.028  -3.316
  525   HH11  ARG  61          1HH1      ARG  61 -13.556   0.814  -2.146
  526   HH12  ARG  61          2HH1      ARG  61 -14.704  -0.403  -1.706
  527   HH21  ARG  61          1HH2      ARG  61 -17.496   1.472  -2.650
  528   HH22  ARG  61          2HH2      ARG  61 -16.937  -0.028  -1.993
  529    H    GLN  62           H        GLN  62 -11.915   4.514  -6.123
  530    HA   GLN  62           HA       GLN  62 -13.186   7.008  -7.097
  531    HB2  GLN  62          2HB       GLN  62 -11.050   6.252  -8.204
  532    HB3  GLN  62          3HB       GLN  62 -11.855   4.774  -8.703
  533    HG2  GLN  62          2HG       GLN  62 -11.767   6.276 -10.573
  534    HG3  GLN  62          3HG       GLN  62 -13.443   6.141 -10.057
  535   HE21  GLN  62          1HE2      GLN  62 -12.009   8.226 -11.601
  536   HE22  GLN  62          2HE2      GLN  62 -12.321   9.716 -10.788
  537    H    GLY  63           H        GLY  63 -15.287   6.620  -6.502
  538    HA2  GLY  63          2HA       GLY  63 -17.433   5.877  -6.709
  539    HA3  GLY  63          3HA       GLY  63 -16.927   4.932  -8.100
  540    H    ASN  64           H        ASN  64 -16.560   2.795  -7.873
  541    HA   ASN  64           HA       ASN  64 -17.167   1.508  -5.274
  542    HB2  ASN  64          2HB       ASN  64 -17.334   0.357  -8.103
  543    HB3  ASN  64          3HB       ASN  64 -17.791  -0.478  -6.620
  544   HD21  ASN  64          1HD2      ASN  64 -19.371   0.153  -8.998
  545   HD22  ASN  64          2HD2      ASN  64 -20.733   1.063  -8.446
  546    H    THR  65           H        THR  65 -14.729   1.912  -7.712
  547    HA   THR  65           HA       THR  65 -13.179  -0.457  -6.920
  548    HB   THR  65           HB       THR  65 -11.695   0.229  -8.868
  549    HG1  THR  65           HG1      THR  65 -12.985   2.508  -8.667
  550   HG21  THR  65          1HG2      THR  65 -13.295  -0.439 -10.631
  551   HG22  THR  65          2HG2      THR  65 -14.644  -0.143  -9.533
  552   HG23  THR  65          3HG2      THR  65 -13.495  -1.440  -9.192
  553    H    TRP  66           H        TRP  66 -10.881  -0.263  -6.512
  554    HA   TRP  66           HA       TRP  66 -10.044   2.194  -5.085
  555    HB2  TRP  66          2HB       TRP  66  -9.240  -0.735  -4.760
  556    HB3  TRP  66          3HB       TRP  66  -8.340   0.580  -4.021
  557    HD1  TRP  66           HD1      TRP  66 -11.314  -1.616  -3.397
  558    HE1  TRP  66           HE1      TRP  66 -12.508  -0.872  -1.230
  559    HE3  TRP  66           HE3      TRP  66  -8.957   2.870  -2.662
  560    HZ2  TRP  66           HZ2      TRP  66 -12.463   1.324   0.529
  561    HZ3  TRP  66           HZ3      TRP  66  -9.600   4.237  -0.720
  562    HH2  TRP  66           HH2      TRP  66 -11.319   3.477   0.844
  563    H    THR  67           H        THR  67  -8.822   3.438  -6.363
  564    HA   THR  67           HA       THR  67  -7.013   2.265  -8.380
  565    HB   THR  67           HB       THR  67  -8.673   3.815  -9.294
  566    HG1  THR  67           HG1      THR  67  -6.970   5.488 -10.023
  567   HG21  THR  67          1HG2      THR  67  -8.708   6.221  -8.729
  568   HG22  THR  67          2HG2      THR  67  -7.504   5.955  -7.470
  569   HG23  THR  67          3HG2      THR  67  -9.106   5.236  -7.312
  570    H    VAL  68           H        VAL  68  -4.852   2.346  -8.054
  571    HA   VAL  68           HA       VAL  68  -3.692   3.675  -5.759
  572    HB   VAL  68           HB       VAL  68  -2.298   2.206  -8.057
  573   HG11  VAL  68          1HG1      VAL  68  -1.202   3.041  -5.339
  574   HG12  VAL  68          2HG1      VAL  68  -0.755   3.727  -6.903
  575   HG13  VAL  68          3HG1      VAL  68  -0.351   2.052  -6.531
  576   HG21  VAL  68          1HG2      VAL  68  -2.164   0.279  -6.514
  577   HG22  VAL  68          2HG2      VAL  68  -3.841   0.719  -6.841
  578   HG23  VAL  68          3HG2      VAL  68  -3.095   1.167  -5.304
  579    H    LYS  69           H        LYS  69  -3.466   5.816  -5.814
  580    HA   LYS  69           HA       LYS  69  -3.186   7.416  -8.142
  581    HB2  LYS  69          2HB       LYS  69  -2.540   8.239  -5.278
  582    HB3  LYS  69          3HB       LYS  69  -2.920   9.300  -6.632
  583    HG2  LYS  69          2HG       LYS  69  -4.824   7.385  -5.252
  584    HG3  LYS  69          3HG       LYS  69  -4.826   9.143  -5.130
  585    HD2  LYS  69          2HD       LYS  69  -5.386   7.562  -7.673
  586    HD3  LYS  69          3HD       LYS  69  -6.619   8.265  -6.626
  587    HE2  LYS  69          2HE       LYS  69  -4.505   9.842  -8.140
  588    HE3  LYS  69          3HE       LYS  69  -6.186   9.649  -8.635
  589    HZ1  LYS  69          1HZ       LYS  69  -6.880  10.791  -6.633
  590    HZ2  LYS  69          2HZ       LYS  69  -5.814  11.754  -7.520
  591    HZ3  LYS  69          3HZ       LYS  69  -5.273  10.955  -6.131
  592    H    ARG  70           H        ARG  70  -0.865   6.477  -5.571
  593    HA   ARG  70           HA       ARG  70   1.291   6.226  -7.419
  594    HB2  ARG  70          2HB       ARG  70   1.302   8.695  -7.233
  595    HB3  ARG  70          3HB       ARG  70   1.439   8.587  -5.482
  596    HG2  ARG  70          2HG       ARG  70   3.647   7.523  -5.713
  597    HG3  ARG  70          3HG       ARG  70   3.514   7.589  -7.470
  598    HD2  ARG  70          2HD       ARG  70   3.594  10.012  -7.433
  599    HD3  ARG  70          3HD       ARG  70   3.512  10.032  -5.665
  600    HE   ARG  70           HE       ARG  70   5.737   8.507  -6.366
  601   HH11  ARG  70          1HH1      ARG  70   4.747  11.878  -6.708
  602   HH12  ARG  70          2HH1      ARG  70   6.381  12.466  -6.673
  603   HH21  ARG  70          1HH2      ARG  70   7.839   9.296  -6.287
  604   HH22  ARG  70          2HH2      ARG  70   8.128  11.003  -6.435
  605    H    ILE  71           H        ILE  71   2.859   4.959  -6.625
  606    HA   ILE  71           HA       ILE  71   3.019   4.249  -3.767
  607    HB   ILE  71           HB       ILE  71   4.610   3.161  -6.150
  608   HG12  ILE  71          2HG1      ILE  71   2.221   1.823  -4.798
  609   HG13  ILE  71          3HG1      ILE  71   2.121   2.707  -6.319
  610   HG21  ILE  71          1HG2      ILE  71   5.765   2.839  -4.009
  611   HG22  ILE  71          2HG2      ILE  71   5.197   1.291  -4.632
  612   HG23  ILE  71          3HG2      ILE  71   4.327   2.082  -3.316
  613   HD11  ILE  71          1HD1      ILE  71   3.664   0.184  -5.778
  614   HD12  ILE  71          2HD1      ILE  71   3.783   1.120  -7.273
  615   HD13  ILE  71          3HD1      ILE  71   2.245   0.402  -6.801
  616    H    THR  72           H        THR  72   4.185   5.827  -2.711
  617    HA   THR  72           HA       THR  72   6.588   7.014  -3.937
  618    HB   THR  72           HB       THR  72   5.031   7.869  -1.443
  619    HG1  THR  72           HG1      THR  72   4.328   8.107  -3.959
  620   HG21  THR  72          1HG2      THR  72   7.376   8.656  -1.402
  621   HG22  THR  72          2HG2      THR  72   6.275  10.005  -1.678
  622   HG23  THR  72          3HG2      THR  72   7.192   9.328  -3.025
  623    H    ARG  73           H        ARG  73   8.505   6.105  -3.353
  624    HA   ARG  73           HA       ARG  73   8.767   4.309  -1.103
  625    HB2  ARG  73          2HB       ARG  73  10.008   3.962  -3.246
  626    HB3  ARG  73          3HB       ARG  73  10.916   5.446  -2.963
  627    HG2  ARG  73          2HG       ARG  73  12.078   4.504  -1.106
  628    HG3  ARG  73          3HG       ARG  73  10.966   3.136  -1.002
  629    HD2  ARG  73          2HD       ARG  73  13.048   2.385  -1.946
  630    HD3  ARG  73          3HD       ARG  73  11.814   2.321  -3.200
  631    HE   ARG  73           HE       ARG  73  12.915   4.690  -3.700
  632   HH11  ARG  73          1HH1      ARG  73  14.492   1.600  -3.057
  633   HH12  ARG  73          2HH1      ARG  73  15.881   1.986  -4.026
  634   HH21  ARG  73          1HH2      ARG  73  14.741   5.198  -4.887
  635   HH22  ARG  73          2HH2      ARG  73  16.022   4.039  -5.069
  636    H    THR  74           H        THR  74  10.128   4.662   0.734
  637    HA   THR  74           HA       THR  74   9.553   6.980   2.141
  638    HB   THR  74           HB       THR  74  10.045   4.872   3.271
  639    HG1  THR  74           HG1      THR  74  10.437   6.883   4.397
  640   HG21  THR  74          1HG2      THR  74  12.954   5.241   2.423
  641   HG22  THR  74          2HG2      THR  74  11.852   4.003   1.822
  642   HG23  THR  74          3HG2      THR  74  12.350   3.985   3.512
  643    H    VAL  75           H        VAL  75  10.542   8.868   2.556
  644    HA   VAL  75           HA       VAL  75  12.666   9.857   0.924
  645    HB   VAL  75           HB       VAL  75  11.506  11.120   3.454
  646   HG11  VAL  75          1HG1      VAL  75  12.321  13.262   2.521
  647   HG12  VAL  75          2HG1      VAL  75  13.029  12.405   1.149
  648   HG13  VAL  75          3HG1      VAL  75  13.651  12.130   2.778
  649   HG21  VAL  75          1HG2      VAL  75  10.617  11.470   0.559
  650   HG22  VAL  75          2HG2      VAL  75   9.993  12.374   1.941
  651   HG23  VAL  75          3HG2      VAL  75   9.719  10.635   1.831
  652    H    GLY  76           H        GLY  76  14.614   9.062   1.160
  653    HA2  GLY  76          2HA       GLY  76  16.436   9.314   3.178
  654    HA3  GLY  76          3HA       GLY  76  15.597   7.805   3.564
  655    H    SER  77           H        SER  77  15.002   6.951   0.987
  656    HA   SER  77           HA       SER  77  17.570   6.086  -0.096
  657    HB2  SER  77          2HB       SER  77  15.626   4.502   0.195
  658    HB3  SER  77          3HB       SER  77  14.743   5.406  -1.040
  659    HG   SER  77           HG       SER  77  15.996   3.472  -1.714
  660    H    LEU  78           H        LEU  78  17.428   5.994  -2.728
  661    HA   LEU  78           HA       LEU  78  16.616   8.638  -3.774
  662    HB2  LEU  78          2HB       LEU  78  19.153   8.381  -3.003
  663    HB3  LEU  78          3HB       LEU  78  19.335   7.478  -4.491
  664    HG   LEU  78           HG       LEU  78  18.533  10.412  -4.244
  665   HD11  LEU  78          1HD1      LEU  78  20.887  10.033  -3.749
  666   HD12  LEU  78          2HD1      LEU  78  20.711  10.873  -5.285
  667   HD13  LEU  78          3HD1      LEU  78  21.102   9.151  -5.265
  668   HD21  LEU  78          1HD2      LEU  78  18.679  10.557  -6.690
  669   HD22  LEU  78          2HD2      LEU  78  17.408   9.444  -6.196
  670   HD23  LEU  78          3HD2      LEU  78  18.943   8.813  -6.795
  671    H    GLU  79           H        GLU  79  15.293   8.152  -5.418
  672    HA   GLU  79           HA       GLU  79  15.513   5.745  -7.025
  673    HB2  GLU  79          2HB       GLU  79  13.754   8.225  -7.369
  674    HB3  GLU  79          3HB       GLU  79  13.629   6.767  -8.342
  675    HG2  GLU  79          2HG       GLU  79  11.866   6.633  -6.771
  676    HG3  GLU  79          3HG       GLU  79  13.095   5.509  -6.202
  677    H    HIS  80           H        HIS  80  17.371   5.711  -8.245
  678    HA   HIS  80           HA       HIS  80  18.777   8.051  -9.009
  679    HB2  HIS  80          2HB       HIS  80  20.425   6.588 -10.050
  680    HB3  HIS  80          3HB       HIS  80  19.903   5.870  -8.536
  681    HD1  HIS  80           HD1      HIS  80  19.694   5.381 -12.267
  682    HD2  HIS  80           HD2      HIS  80  18.725   3.339  -8.773
  683    HE1  HIS  80           HE1      HIS  80  19.183   3.022 -12.976
  684    HE2  HIS  80           HE2      HIS  80  18.511   1.838 -10.862
  685    H    HIS  81           H        HIS  81  19.393   8.728 -11.155
  686    HA   HIS  81           HA       HIS  81  17.111   9.163 -12.812
  687    HB2  HIS  81          2HB       HIS  81  20.022  10.002 -13.118
  688    HB3  HIS  81          3HB       HIS  81  18.777  10.442 -14.287
  689    HD1  HIS  81           HD1      HIS  81  17.274  12.373 -13.710
  690    HD2  HIS  81           HD2      HIS  81  19.658  11.218 -10.516
  691    HE1  HIS  81           HE1      HIS  81  16.959  14.147 -11.966
  692    HE2  HIS  81           HE2      HIS  81  18.288  13.345  -9.985
  693    H    HIS  82           H        HIS  82  16.960   8.766 -15.064
  694    HA   HIS  82           HA       HIS  82  17.784   6.023 -15.763
  695    HB2  HIS  82          2HB       HIS  82  15.622   7.840 -16.944
  696    HB3  HIS  82          3HB       HIS  82  15.924   6.172 -17.428
  697    HD1  HIS  82           HD1      HIS  82  14.519   4.481 -16.276
  698    HD2  HIS  82           HD2      HIS  82  14.816   7.975 -14.035
  699    HE1  HIS  82           HE1      HIS  82  12.944   4.183 -14.344
  700    HE2  HIS  82           HE2      HIS  82  13.187   6.281 -12.969
  701    H    HIS  83           H        HIS  83  19.517   5.861 -17.106
  702    HA   HIS  83           HA       HIS  83  20.519   7.997 -18.725
  703    HB2  HIS  83          2HB       HIS  83  22.011   6.181 -17.869
  704    HB3  HIS  83          3HB       HIS  83  21.169   5.008 -18.876
  705    HD1  HIS  83           HD1      HIS  83  23.779   7.649 -18.993
  706    HD2  HIS  83           HD2      HIS  83  21.730   5.230 -21.683
  707    HE1  HIS  83           HE1      HIS  83  25.024   7.844 -21.166
  708    HE2  HIS  83           HE2      HIS  83  23.826   6.287 -22.742
  709    H    HIS  84           H        HIS  84  19.355   8.722 -20.439
  710    HA   HIS  84           HA       HIS  84  17.288   7.223 -21.677
  711    HB2  HIS  84          2HB       HIS  84  16.812   9.148 -23.013
  712    HB3  HIS  84          3HB       HIS  84  17.358   9.771 -21.466
  713    HD1  HIS  84           HD1      HIS  84  18.191   9.670 -25.078
  714    HD2  HIS  84           HD2      HIS  84  19.868  11.141 -21.569
  715    HE1  HIS  84           HE1      HIS  84  19.998  11.249 -25.803
  716    HE2  HIS  84           HE2      HIS  84  20.870  12.258 -23.673
  717    H    HIS  85           H        HIS  85  17.400   5.792 -23.273
  718    HA   HIS  85           HA       HIS  85  19.824   5.264 -24.744
  719    HB2  HIS  85          2HB       HIS  85  18.431   3.524 -25.960
  720    HB3  HIS  85          3HB       HIS  85  18.479   3.347 -24.213
  721    HD1  HIS  85           HD1      HIS  85  16.140   4.699 -26.889
  722    HD2  HIS  85           HD2      HIS  85  16.024   3.120 -23.047
  723    HE1  HIS  85           HE1      HIS  85  13.705   4.410 -26.350
  724    HE2  HIS  85           HE2      HIS  85  13.679   3.253 -24.118
  Start of MODEL    9
    1    H1   MET   1          1H        MET   1 -19.864   2.135   1.193
    2    H2   MET   1          2H        MET   1 -18.708   1.732   0.031
    3    H3   MET   1          3H        MET   1 -18.324   1.638   1.674
    4    HA   MET   1           HA       MET   1 -20.311  -0.021   0.245
    5    HB2  MET   1          2HB       MET   1 -17.542  -0.674   1.345
    6    HB3  MET   1          3HB       MET   1 -18.679  -1.897   0.791
    7    HG2  MET   1          2HG       MET   1 -17.511   0.295  -0.942
    8    HG3  MET   1          3HG       MET   1 -16.944  -1.376  -0.884
    9    HE1  MET   1          1HE       MET   1 -17.227  -1.785  -3.501
   10    HE2  MET   1          2HE       MET   1 -17.633  -0.073  -3.641
   11    HE3  MET   1          3HE       MET   1 -18.661  -1.290  -4.396
   12    HA   PRO   2           HA       PRO   2 -22.272  -0.854   4.251
   13    HB2  PRO   2          2HB       PRO   2 -22.368  -3.726   3.313
   14    HB3  PRO   2          3HB       PRO   2 -23.681  -2.687   3.910
   15    HG2  PRO   2          2HG       PRO   2 -23.498  -3.207   1.317
   16    HG3  PRO   2          3HG       PRO   2 -23.920  -1.569   1.871
   17    HD2  PRO   2          2HD       PRO   2 -21.273  -2.591   0.854
   18    HD3  PRO   2          3HD       PRO   2 -22.087  -1.045   0.522
   19    H    SER   3           H        SER   3 -19.817  -3.150   3.110
   20    HA   SER   3           HA       SER   3 -19.033  -3.949   5.793
   21    HB2  SER   3          2HB       SER   3 -17.817  -4.621   3.083
   22    HB3  SER   3          3HB       SER   3 -17.432  -5.414   4.615
   23    HG   SER   3           HG       SER   3 -19.797  -5.518   3.087
   24    H    GLU   4           H        GLU   4 -17.997  -2.458   6.909
   25    HA   GLU   4           HA       GLU   4 -16.470  -0.311   5.744
   26    HB2  GLU   4          2HB       GLU   4 -18.027   0.004   7.660
   27    HB3  GLU   4          3HB       GLU   4 -17.017  -1.026   8.659
   28    HG2  GLU   4          2HG       GLU   4 -15.588   1.307   7.487
   29    HG3  GLU   4          3HG       GLU   4 -16.903   1.743   8.575
   30    H    GLU   5           H        GLU   5 -15.754  -3.280   7.587
   31    HA   GLU   5           HA       GLU   5 -12.986  -2.774   8.025
   32    HB2  GLU   5          2HB       GLU   5 -14.104  -5.589   7.714
   33    HB3  GLU   5          3HB       GLU   5 -12.769  -5.049   8.722
   34    HG2  GLU   5          2HG       GLU   5 -15.733  -4.689   9.195
   35    HG3  GLU   5          3HG       GLU   5 -14.588  -5.617  10.154
   36    H    GLU   6           H        GLU   6 -14.823  -4.194   5.421
   37    HA   GLU   6           HA       GLU   6 -13.016  -5.586   3.892
   38    HB2  GLU   6          2HB       GLU   6 -15.461  -5.476   3.514
   39    HB3  GLU   6          3HB       GLU   6 -15.302  -3.817   2.952
   40    HG2  GLU   6          2HG       GLU   6 -13.812  -4.728   1.094
   41    HG3  GLU   6          3HG       GLU   6 -14.322  -6.341   1.594
   42    H    GLU   7           H        GLU   7 -13.650  -2.097   3.918
   43    HA   GLU   7           HA       GLU   7 -12.298  -1.311   1.612
   44    HB2  GLU   7          2HB       GLU   7 -12.665   0.292   4.179
   45    HB3  GLU   7          3HB       GLU   7 -12.311   0.966   2.587
   46    HG2  GLU   7          2HG       GLU   7 -14.844  -0.490   3.416
   47    HG3  GLU   7          3HG       GLU   7 -14.675   1.240   3.124
   48    H    LYS   8           H        LYS   8 -11.074  -1.658   4.923
   49    HA   LYS   8           HA       LYS   8  -8.456  -0.601   4.447
   50    HB2  LYS   8          2HB       LYS   8  -9.490  -2.406   6.693
   51    HB3  LYS   8          3HB       LYS   8  -7.873  -1.714   6.659
   52    HG2  LYS   8          2HG       LYS   8  -9.204  -0.374   8.145
   53    HG3  LYS   8          3HG       LYS   8  -8.899   0.577   6.691
   54    HD2  LYS   8          2HD       LYS   8 -11.193  -0.053   5.866
   55    HD3  LYS   8          3HD       LYS   8 -11.491  -0.870   7.405
   56    HE2  LYS   8          2HE       LYS   8 -11.333   1.239   8.598
   57    HE3  LYS   8          3HE       LYS   8 -10.823   2.083   7.131
   58    HZ1  LYS   8          1HZ       LYS   8 -13.167   2.432   7.613
   59    HZ2  LYS   8          2HZ       LYS   8 -13.459   0.769   7.526
   60    HZ3  LYS   8          3HZ       LYS   8 -12.966   1.614   6.147
   61    H    ARG   9           H        ARG   9  -9.839  -3.839   4.690
   62    HA   ARG   9           HA       ARG   9  -7.552  -5.432   4.385
   63    HB2  ARG   9          2HB       ARG   9 -10.466  -5.991   3.689
   64    HB3  ARG   9          3HB       ARG   9  -9.213  -7.231   3.745
   65    HG2  ARG   9          2HG       ARG   9  -8.929  -6.991   6.104
   66    HG3  ARG   9          3HG       ARG   9  -9.872  -5.499   6.148
   67    HD2  ARG   9          2HD       ARG   9 -11.119  -7.440   7.045
   68    HD3  ARG   9          3HD       ARG   9 -11.911  -6.718   5.643
   69    HE   ARG   9           HE       ARG   9 -10.333  -8.788   4.673
   70   HH11  ARG   9          1HH1      ARG   9 -13.081  -8.528   6.877
   71   HH12  ARG   9          2HH1      ARG   9 -13.686 -10.106   6.485
   72   HH21  ARG   9          1HH2      ARG   9 -11.204 -10.823   4.127
   73   HH22  ARG   9          2HH2      ARG   9 -12.630 -11.398   4.937
   74    H    GLN  10           H        GLN  10  -9.660  -3.951   1.965
   75    HA   GLN  10           HA       GLN  10  -8.634  -5.293  -0.340
   76    HB2  GLN  10          2HB       GLN  10 -10.229  -2.716  -0.027
   77    HB3  GLN  10          3HB       GLN  10  -9.756  -3.355  -1.602
   78    HG2  GLN  10          2HG       GLN  10 -11.060  -5.375  -1.216
   79    HG3  GLN  10          3HG       GLN  10 -11.488  -4.826   0.405
   80   HE21  GLN  10          1HE2      GLN  10 -12.865  -2.980   0.607
   81   HE22  GLN  10          2HE2      GLN  10 -13.942  -2.534  -0.661
   82    H    VAL  11           H        VAL  11  -8.077  -2.024   1.029
   83    HA   VAL  11           HA       VAL  11  -6.366  -1.102  -1.022
   84    HB   VAL  11           HB       VAL  11  -6.549  -0.102   1.863
   85   HG11  VAL  11          1HG1      VAL  11  -5.672   2.045   0.970
   86   HG12  VAL  11          2HG1      VAL  11  -5.469   1.283  -0.603
   87   HG13  VAL  11          3HG1      VAL  11  -4.516   0.729   0.755
   88   HG21  VAL  11          1HG2      VAL  11  -8.133   1.555   1.014
   89   HG22  VAL  11          2HG2      VAL  11  -8.717  -0.071   0.665
   90   HG23  VAL  11          3HG2      VAL  11  -7.989   0.891  -0.617
   91    H    LYS  12           H        LYS  12  -5.650  -2.512   2.169
   92    HA   LYS  12           HA       LYS  12  -2.826  -2.225   2.093
   93    HB2  LYS  12          2HB       LYS  12  -4.497  -4.232   3.666
   94    HB3  LYS  12          3HB       LYS  12  -2.806  -3.833   3.982
   95    HG2  LYS  12          2HG       LYS  12  -3.473  -1.501   4.507
   96    HG3  LYS  12          3HG       LYS  12  -5.164  -1.933   4.236
   97    HD2  LYS  12          2HD       LYS  12  -3.337  -3.094   6.372
   98    HD3  LYS  12          3HD       LYS  12  -4.614  -1.914   6.642
   99    HE2  LYS  12          2HE       LYS  12  -6.302  -3.573   6.004
  100    HE3  LYS  12          3HE       LYS  12  -5.034  -4.750   5.639
  101    HZ1  LYS  12          1HZ       LYS  12  -5.868  -5.209   7.802
  102    HZ2  LYS  12          2HZ       LYS  12  -5.695  -3.603   8.293
  103    HZ3  LYS  12          3HZ       LYS  12  -4.324  -4.545   8.000
  104    H    GLN  13           H        GLN  13  -5.049  -4.741   0.987
  105    HA   GLN  13           HA       GLN  13  -3.137  -6.729   0.322
  106    HB2  GLN  13          2HB       GLN  13  -5.516  -7.292   0.541
  107    HB3  GLN  13          3HB       GLN  13  -5.930  -6.220  -0.792
  108    HG2  GLN  13          2HG       GLN  13  -4.685  -7.683  -2.351
  109    HG3  GLN  13          3HG       GLN  13  -4.260  -8.745  -1.012
  110   HE21  GLN  13          1HE2      GLN  13  -7.450  -7.249  -1.456
  111   HE22  GLN  13          2HE2      GLN  13  -8.287  -8.727  -1.769
  112    H    VAL  14           H        VAL  14  -4.897  -4.399  -1.795
  113    HA   VAL  14           HA       VAL  14  -3.650  -4.871  -4.225
  114    HB   VAL  14           HB       VAL  14  -4.758  -2.213  -3.182
  115   HG11  VAL  14          1HG1      VAL  14  -4.200  -3.014  -6.067
  116   HG12  VAL  14          2HG1      VAL  14  -3.319  -1.797  -5.141
  117   HG13  VAL  14          3HG1      VAL  14  -5.014  -1.532  -5.551
  118   HG21  VAL  14          1HG2      VAL  14  -6.430  -4.028  -3.167
  119   HG22  VAL  14          2HG2      VAL  14  -6.112  -4.348  -4.873
  120   HG23  VAL  14          3HG2      VAL  14  -6.831  -2.811  -4.380
  121    H    ALA  15           H        ALA  15  -2.730  -2.615  -1.663
  122    HA   ALA  15           HA       ALA  15  -0.562  -1.317  -2.882
  123    HB1  ALA  15          1HB       ALA  15  -1.735  -0.464  -0.887
  124    HB2  ALA  15          2HB       ALA  15   0.002  -0.586  -0.597
  125    HB3  ALA  15          3HB       ALA  15  -1.094  -1.804   0.063
  126    H    LYS  16           H        LYS  16  -0.711  -4.170  -0.825
  127    HA   LYS  16           HA       LYS  16   2.044  -4.776  -0.684
  128    HB2  LYS  16          2HB       LYS  16   0.662  -5.747   0.963
  129    HB3  LYS  16          3HB       LYS  16  -0.547  -6.250  -0.204
  130    HG2  LYS  16          2HG       LYS  16   0.931  -8.010  -1.009
  131    HG3  LYS  16          3HG       LYS  16   2.174  -7.534   0.159
  132    HD2  LYS  16          2HD       LYS  16   0.804  -8.215   2.027
  133    HD3  LYS  16          3HD       LYS  16  -0.638  -8.345   1.013
  134    HE2  LYS  16          2HE       LYS  16   1.801 -10.143   0.799
  135    HE3  LYS  16          3HE       LYS  16   0.294 -10.562   1.617
  136    HZ1  LYS  16          1HZ       LYS  16   0.510  -9.870  -1.265
  137    HZ2  LYS  16          2HZ       LYS  16  -0.875 -10.389  -0.456
  138    HZ3  LYS  16          3HZ       LYS  16   0.433 -11.442  -0.652
  139    H    GLU  17           H        GLU  17  -0.547  -5.795  -2.931
  140    HA   GLU  17           HA       GLU  17   0.851  -7.792  -4.340
  141    HB2  GLU  17          2HB       GLU  17  -1.384  -6.006  -5.413
  142    HB3  GLU  17          3HB       GLU  17  -0.866  -7.538  -6.113
  143    HG2  GLU  17          2HG       GLU  17  -2.325  -7.072  -3.513
  144    HG3  GLU  17          3HG       GLU  17  -2.899  -7.929  -4.935
  145    H    LYS  18           H        LYS  18   0.489  -4.313  -4.896
  146    HA   LYS  18           HA       LYS  18   1.847  -4.128  -7.361
  147    HB2  LYS  18          2HB       LYS  18   1.379  -2.035  -5.191
  148    HB3  LYS  18          3HB       LYS  18   2.021  -1.662  -6.790
  149    HG2  LYS  18          2HG       LYS  18  -0.722  -2.813  -6.186
  150    HG3  LYS  18          3HG       LYS  18  -0.379  -1.146  -6.660
  151    HD2  LYS  18          2HD       LYS  18   0.296  -1.845  -8.883
  152    HD3  LYS  18          3HD       LYS  18   0.293  -3.545  -8.415
  153    HE2  LYS  18          2HE       LYS  18  -2.199  -3.334  -8.033
  154    HE3  LYS  18          3HE       LYS  18  -2.108  -1.732  -8.779
  155    HZ1  LYS  18          1HZ       LYS  18  -2.717  -3.470 -10.376
  156    HZ2  LYS  18          2HZ       LYS  18  -1.260  -4.279 -10.070
  157    HZ3  LYS  18          3HZ       LYS  18  -1.247  -2.748 -10.790
  158    H    LEU  19           H        LEU  19   2.981  -3.806  -3.980
  159    HA   LEU  19           HA       LEU  19   5.703  -3.191  -4.627
  160    HB2  LEU  19          2HB       LEU  19   4.429  -4.240  -2.077
  161    HB3  LEU  19          3HB       LEU  19   6.134  -3.825  -2.191
  162    HG   LEU  19           HG       LEU  19   3.788  -1.903  -2.501
  163   HD11  LEU  19          1HD1      LEU  19   4.609  -0.872  -0.439
  164   HD12  LEU  19          2HD1      LEU  19   5.873  -2.099  -0.309
  165   HD13  LEU  19          3HD1      LEU  19   4.173  -2.560  -0.181
  166   HD21  LEU  19          1HD2      LEU  19   6.759  -1.311  -2.670
  167   HD22  LEU  19          2HD2      LEU  19   5.460  -0.113  -2.643
  168   HD23  LEU  19          3HD2      LEU  19   5.591  -1.234  -3.994
  169    H    LEU  20           H        LEU  20   3.940  -6.220  -4.283
  170    HA   LEU  20           HA       LEU  20   6.221  -7.973  -4.272
  171    HB2  LEU  20          2HB       LEU  20   3.298  -8.489  -4.966
  172    HB3  LEU  20          3HB       LEU  20   4.515  -9.754  -4.888
  173    HG   LEU  20           HG       LEU  20   3.565  -8.046  -2.553
  174   HD11  LEU  20          1HD1      LEU  20   3.076 -10.980  -3.135
  175   HD12  LEU  20          2HD1      LEU  20   1.889  -9.676  -3.240
  176   HD13  LEU  20          3HD1      LEU  20   2.579 -10.110  -1.678
  177   HD21  LEU  20          1HD2      LEU  20   5.599 -10.296  -2.554
  178   HD22  LEU  20          2HD2      LEU  20   4.940  -9.500  -1.122
  179   HD23  LEU  20          3HD2      LEU  20   5.920  -8.584  -2.261
  180    H    GLU  21           H        GLU  21   4.186  -6.498  -6.762
  181    HA   GLU  21           HA       GLU  21   5.224  -7.945  -9.008
  182    HB2  GLU  21          2HB       GLU  21   3.708  -5.309  -8.821
  183    HB3  GLU  21          3HB       GLU  21   4.182  -6.031 -10.358
  184    HG2  GLU  21          2HG       GLU  21   2.817  -8.031  -9.827
  185    HG3  GLU  21          3HG       GLU  21   2.321  -7.282  -8.310
  186    H    GLN  22           H        GLN  22   6.087  -4.924  -7.401
  187    HA   GLN  22           HA       GLN  22   8.097  -4.111  -9.304
  188    HB2  GLN  22          2HB       GLN  22   7.541  -3.164  -6.458
  189    HB3  GLN  22          3HB       GLN  22   8.687  -2.402  -7.559
  190    HG2  GLN  22          2HG       GLN  22   6.874  -1.813  -9.091
  191    HG3  GLN  22          3HG       GLN  22   5.704  -2.636  -8.067
  192   HE21  GLN  22          1HE2      GLN  22   6.902  -1.605  -5.565
  193   HE22  GLN  22          2HE2      GLN  22   6.440   0.055  -5.489
  194    H    SER  23           H        SER  23   8.086  -5.913  -6.260
  195    HA   SER  23           HA       SER  23  10.799  -6.867  -6.768
  196    HB2  SER  23          2HB       SER  23  11.131  -4.832  -5.335
  197    HB3  SER  23          3HB       SER  23  10.086  -5.541  -4.107
  198    HG   SER  23           HG       SER  23  12.600  -5.820  -4.160
  199    HA   PRO  24           HA       PRO  24   8.192 -10.342  -5.132
  200    HB2  PRO  24          2HB       PRO  24   9.148 -12.272  -6.804
  201    HB3  PRO  24          3HB       PRO  24   7.914 -11.105  -7.330
  202    HG2  PRO  24          2HG       PRO  24  10.881 -11.050  -7.835
  203    HG3  PRO  24          3HG       PRO  24   9.543 -10.756  -8.971
  204    HD2  PRO  24          2HD       PRO  24  10.923  -8.717  -7.771
  205    HD3  PRO  24          3HD       PRO  24   9.218  -8.574  -8.242
  206    H    ASN  25           H        ASN  25  11.468  -9.538  -5.158
  207    HA   ASN  25           HA       ASN  25  12.498 -11.788  -3.628
  208    HB2  ASN  25          2HB       ASN  25  13.672  -9.045  -4.290
  209    HB3  ASN  25          3HB       ASN  25  14.533 -10.287  -3.394
  210   HD21  ASN  25          1HD2      ASN  25  12.513 -10.970  -6.246
  211   HD22  ASN  25          2HD2      ASN  25  13.837 -11.415  -7.256
  212    H    SER  26           H        SER  26  10.728  -8.923  -3.025
  213    HA   SER  26           HA       SER  26  11.796  -8.369  -0.385
  214    HB2  SER  26          2HB       SER  26  11.230  -6.468  -1.785
  215    HB3  SER  26          3HB       SER  26   9.575  -7.050  -1.993
  216    HG   SER  26           HG       SER  26   9.098  -6.471   0.027
  217    H    LYS  27           H        LYS  27  10.880  -8.847   1.502
  218    HA   LYS  27           HA       LYS  27   8.252 -10.107   1.700
  219    HB2  LYS  27          2HB       LYS  27  10.077 -10.964   3.139
  220    HB3  LYS  27          3HB       LYS  27  10.311  -9.368   3.836
  221    HG2  LYS  27          2HG       LYS  27   9.089 -10.794   5.390
  222    HG3  LYS  27          3HG       LYS  27   8.050  -9.476   4.843
  223    HD2  LYS  27          2HD       LYS  27   6.770 -11.543   4.890
  224    HD3  LYS  27          3HD       LYS  27   6.977 -11.032   3.216
  225    HE2  LYS  27          2HE       LYS  27   8.754 -12.710   2.906
  226    HE3  LYS  27          3HE       LYS  27   8.629 -13.180   4.603
  227    HZ1  LYS  27          1HZ       LYS  27   7.431 -14.705   3.157
  228    HZ2  LYS  27          2HZ       LYS  27   6.462 -13.446   2.587
  229    HZ3  LYS  27          3HZ       LYS  27   6.368 -13.914   4.208
  230    H    VAL  28           H        VAL  28   6.593  -8.739   1.544
  231    HA   VAL  28           HA       VAL  28   6.831  -5.907   2.322
  232    HB   VAL  28           HB       VAL  28   4.745  -7.339   0.600
  233   HG11  VAL  28          1HG1      VAL  28   3.919  -5.078   0.008
  234   HG12  VAL  28          2HG1      VAL  28   5.049  -4.365   1.163
  235   HG13  VAL  28          3HG1      VAL  28   3.741  -5.403   1.735
  236   HG21  VAL  28          1HG2      VAL  28   6.988  -5.449  -0.227
  237   HG22  VAL  28          2HG2      VAL  28   5.803  -6.190  -1.309
  238   HG23  VAL  28          3HG2      VAL  28   6.981  -7.198  -0.467
  239    H    GLN  29           H        GLN  29   6.155  -5.464   4.313
  240    HA   GLN  29           HA       GLN  29   3.893  -6.960   5.532
  241    HB2  GLN  29          2HB       GLN  29   6.017  -7.446   6.676
  242    HB3  GLN  29          3HB       GLN  29   6.363  -5.727   6.846
  243    HG2  GLN  29          2HG       GLN  29   5.586  -6.663   8.972
  244    HG3  GLN  29          3HG       GLN  29   4.435  -5.473   8.362
  245   HE21  GLN  29          1HE2      GLN  29   2.608  -6.228   9.341
  246   HE22  GLN  29          2HE2      GLN  29   1.908  -7.780   9.046
  247    H    VAL  30           H        VAL  30   2.111  -5.730   5.847
  248    HA   VAL  30           HA       VAL  30   1.994  -2.926   5.532
  249    HB   VAL  30           HB       VAL  30   0.009  -4.664   7.072
  250   HG11  VAL  30          1HG1      VAL  30  -0.357  -1.917   5.811
  251   HG12  VAL  30          2HG1      VAL  30  -0.274  -2.262   7.540
  252   HG13  VAL  30          3HG1      VAL  30  -1.621  -2.871   6.586
  253   HG21  VAL  30          1HG2      VAL  30   0.316  -5.523   4.781
  254   HG22  VAL  30          2HG2      VAL  30  -0.013  -3.919   4.121
  255   HG23  VAL  30          3HG2      VAL  30  -1.284  -4.800   4.970
  256    H    ARG  31           H        ARG  31   3.037  -1.565   6.795
  257    HA   ARG  31           HA       ARG  31   3.735  -2.188   9.551
  258    HB2  ARG  31          2HB       ARG  31   5.442  -1.349   7.957
  259    HB3  ARG  31          3HB       ARG  31   4.551   0.159   7.789
  260    HG2  ARG  31          2HG       ARG  31   6.481   0.410   9.297
  261    HG3  ARG  31          3HG       ARG  31   4.963   0.694  10.154
  262    HD2  ARG  31          2HD       ARG  31   5.095  -1.736  10.948
  263    HD3  ARG  31          3HD       ARG  31   6.735  -1.770  10.287
  264    HE   ARG  31           HE       ARG  31   7.356  -0.061  11.871
  265   HH11  ARG  31          1HH1      ARG  31   4.259  -1.618  12.547
  266   HH12  ARG  31          2HH1      ARG  31   4.270  -1.161  14.220
  267   HH21  ARG  31          1HH2      ARG  31   7.325   0.537  14.061
  268   HH22  ARG  31          2HH2      ARG  31   6.003   0.057  15.068
  269    H    ARG  32           H        ARG  32   1.726   0.140   7.776
  270    HA   ARG  32           HA       ARG  32   0.088   0.799  10.008
  271    HB2  ARG  32          2HB       ARG  32   2.274   2.097  10.473
  272    HB3  ARG  32          3HB       ARG  32   1.883   3.091   9.077
  273    HG2  ARG  32          2HG       ARG  32   0.042   4.107  10.164
  274    HG3  ARG  32          3HG       ARG  32  -0.093   2.810  11.354
  275    HD2  ARG  32          2HD       ARG  32   2.162   4.846  11.220
  276    HD3  ARG  32          3HD       ARG  32   0.812   4.881  12.361
  277    HE   ARG  32           HE       ARG  32   1.734   2.521  12.980
  278   HH11  ARG  32          1HH1      ARG  32   3.726   5.330  12.247
  279   HH12  ARG  32          2HH1      ARG  32   5.049   4.793  13.232
  280   HH21  ARG  32          1HH2      ARG  32   3.496   1.828  14.253
  281   HH22  ARG  32          2HH2      ARG  32   4.918   2.818  14.362
  282    H    VAL  33           H        VAL  33  -1.524   2.561   9.366
  283    HA   VAL  33           HA       VAL  33  -1.875   2.960   6.462
  284    HB   VAL  33           HB       VAL  33  -4.059   1.803   8.282
  285   HG11  VAL  33          1HG1      VAL  33  -4.202   2.506   5.327
  286   HG12  VAL  33          2HG1      VAL  33  -5.016   3.360   6.639
  287   HG13  VAL  33          3HG1      VAL  33  -5.474   1.701   6.253
  288   HG21  VAL  33          1HG2      VAL  33  -2.441   0.074   7.652
  289   HG22  VAL  33          2HG2      VAL  33  -2.626   0.495   5.947
  290   HG23  VAL  33          3HG2      VAL  33  -3.983  -0.196   6.839
  291    H    GLN  34           H        GLN  34  -2.215   5.137   6.205
  292    HA   GLN  34           HA       GLN  34  -3.707   6.675   8.248
  293    HB2  GLN  34          2HB       GLN  34  -2.242   7.728   5.783
  294    HB3  GLN  34          3HB       GLN  34  -2.942   8.692   7.078
  295    HG2  GLN  34          2HG       GLN  34  -0.482   6.934   7.180
  296    HG3  GLN  34          3HG       GLN  34  -0.581   8.675   7.412
  297   HE21  GLN  34          1HE2      GLN  34  -0.833   5.572   8.894
  298   HE22  GLN  34          2HE2      GLN  34  -1.106   6.121  10.514
  299    H    LYS  35           H        LYS  35  -5.868   6.593   7.935
  300    HA   LYS  35           HA       LYS  35  -7.027   6.462   5.219
  301    HB2  LYS  35          2HB       LYS  35  -7.656   4.800   7.093
  302    HB3  LYS  35          3HB       LYS  35  -8.459   6.133   7.903
  303    HG2  LYS  35          2HG       LYS  35  -9.202   5.135   5.130
  304    HG3  LYS  35          3HG       LYS  35  -9.970   4.569   6.610
  305    HD2  LYS  35          2HD       LYS  35 -10.769   6.884   7.061
  306    HD3  LYS  35          3HD       LYS  35 -10.011   7.434   5.566
  307    HE2  LYS  35          2HE       LYS  35 -12.291   5.443   5.795
  308    HE3  LYS  35          3HE       LYS  35 -12.409   7.115   5.239
  309    HZ1  LYS  35          1HZ       LYS  35 -10.993   6.552   3.361
  310    HZ2  LYS  35          2HZ       LYS  35 -12.368   5.570   3.396
  311    HZ3  LYS  35          3HZ       LYS  35 -10.882   4.949   3.897
  312    H    GLN  36           H        GLN  36  -7.264   8.511   4.399
  313    HA   GLN  36           HA       GLN  36  -8.692  10.553   6.013
  314    HB2  GLN  36          2HB       GLN  36  -6.341  10.985   4.123
  315    HB3  GLN  36          3HB       GLN  36  -7.400  12.296   4.625
  316    HG2  GLN  36          2HG       GLN  36  -5.677  10.607   6.471
  317    HG3  GLN  36          3HG       GLN  36  -5.326  12.251   5.946
  318   HE21  GLN  36          1HE2      GLN  36  -6.667  13.968   6.749
  319   HE22  GLN  36          2HE2      GLN  36  -7.581  13.778   8.204
  320    H    GLY  37           H        GLY  37 -10.691  10.210   5.216
  321    HA2  GLY  37          2HA       GLY  37 -12.502  10.581   3.893
  322    HA3  GLY  37          3HA       GLY  37 -11.452  11.491   2.815
  323    H    ASN  38           H        ASN  38 -11.460  10.708   0.814
  324    HA   ASN  38           HA       ASN  38 -12.367   8.052   0.130
  325    HB2  ASN  38          2HB       ASN  38 -11.130  10.195  -1.667
  326    HB3  ASN  38          3HB       ASN  38 -12.008   8.768  -2.208
  327   HD21  ASN  38          1HD2      ASN  38 -14.256   8.727  -2.035
  328   HD22  ASN  38          2HD2      ASN  38 -15.190  10.140  -1.701
  329    H    THR  39           H        THR  39  -9.245   9.677   0.450
  330    HA   THR  39           HA       THR  39  -7.790   7.523  -0.902
  331    HB   THR  39           HB       THR  39  -6.777  10.096   0.363
  332    HG1  THR  39           HG1      THR  39  -8.127   9.993  -1.729
  333   HG21  THR  39          1HG2      THR  39  -4.962   8.392   0.344
  334   HG22  THR  39          2HG2      THR  39  -4.646   9.644  -0.853
  335   HG23  THR  39          3HG2      THR  39  -5.270   8.083  -1.378
  336    H    ILE  40           H        ILE  40  -6.985   5.864   0.138
  337    HA   ILE  40           HA       ILE  40  -6.362   6.004   3.028
  338    HB   ILE  40           HB       ILE  40  -7.034   3.517   1.374
  339   HG12  ILE  40          2HG1      ILE  40  -8.752   5.064   3.373
  340   HG13  ILE  40          3HG1      ILE  40  -9.058   4.854   1.654
  341   HG21  ILE  40          1HG2      ILE  40  -5.481   3.038   3.223
  342   HG22  ILE  40          2HG2      ILE  40  -7.061   2.324   3.538
  343   HG23  ILE  40          3HG2      ILE  40  -6.585   3.807   4.369
  344   HD11  ILE  40          1HD1      ILE  40  -9.143   2.668   3.739
  345   HD12  ILE  40          2HD1      ILE  40  -9.439   2.469   2.008
  346   HD13  ILE  40          3HD1      ILE  40 -10.522   3.464   2.978
  347    H    ARG  41           H        ARG  41  -4.257   6.474   3.094
  348    HA   ARG  41           HA       ARG  41  -2.249   5.369   1.311
  349    HB2  ARG  41          2HB       ARG  41  -2.025   7.069   3.844
  350    HB3  ARG  41          3HB       ARG  41  -0.654   6.590   2.844
  351    HG2  ARG  41          2HG       ARG  41  -1.702   7.833   0.932
  352    HG3  ARG  41          3HG       ARG  41  -2.947   8.407   2.043
  353    HD2  ARG  41          2HD       ARG  41  -1.326   9.617   3.351
  354    HD3  ARG  41          3HD       ARG  41   0.025   8.880   2.483
  355    HE   ARG  41           HE       ARG  41  -1.374  10.157   0.527
  356   HH11  ARG  41          1HH1      ARG  41  -0.033  11.277   3.598
  357   HH12  ARG  41          2HH1      ARG  41   0.224  12.894   3.018
  358   HH21  ARG  41          1HH2      ARG  41  -0.973  12.242  -0.223
  359   HH22  ARG  41          2HH2      ARG  41  -0.307  13.443   0.847
  360    H    VAL  42           H        VAL  42  -1.139   3.508   1.723
  361    HA   VAL  42           HA       VAL  42  -1.226   2.352   4.461
  362    HB   VAL  42           HB       VAL  42  -0.896   0.762   1.866
  363   HG11  VAL  42          1HG1      VAL  42  -1.381  -0.168   4.723
  364   HG12  VAL  42          2HG1      VAL  42   0.138  -0.298   3.836
  365   HG13  VAL  42          3HG1      VAL  42  -1.271  -1.216   3.302
  366   HG21  VAL  42          1HG2      VAL  42  -3.390   1.098   3.573
  367   HG22  VAL  42          2HG2      VAL  42  -3.206  -0.068   2.257
  368   HG23  VAL  42          3HG2      VAL  42  -3.162   1.663   1.910
  369    H    GLU  43           H        GLU  43   0.652   2.645   5.379
  370    HA   GLU  43           HA       GLU  43   3.188   2.769   3.970
  371    HB2  GLU  43          2HB       GLU  43   2.559   2.699   6.966
  372    HB3  GLU  43          3HB       GLU  43   4.136   3.022   6.265
  373    HG2  GLU  43          2HG       GLU  43   3.195   5.112   6.988
  374    HG3  GLU  43          3HG       GLU  43   3.214   5.099   5.228
  375    H    LEU  44           H        LEU  44   3.691   0.747   3.111
  376    HA   LEU  44           HA       LEU  44   3.796  -1.562   4.988
  377    HB2  LEU  44          2HB       LEU  44   4.196  -1.893   2.004
  378    HB3  LEU  44          3HB       LEU  44   3.692  -3.072   3.200
  379    HG   LEU  44           HG       LEU  44   1.514  -1.497   3.321
  380   HD11  LEU  44          1HD1      LEU  44   0.900  -0.547   1.169
  381   HD12  LEU  44          2HD1      LEU  44   2.467  -0.998   0.494
  382   HD13  LEU  44          3HD1      LEU  44   2.372   0.202   1.785
  383   HD21  LEU  44          1HD2      LEU  44   1.933  -3.513   1.097
  384   HD22  LEU  44          2HD2      LEU  44   0.375  -2.946   1.709
  385   HD23  LEU  44          3HD2      LEU  44   1.448  -3.871   2.756
  386    H    GLU  45           H        GLU  45   5.800  -3.010   4.466
  387    HA   GLU  45           HA       GLU  45   8.137  -1.216   4.175
  388    HB2  GLU  45          2HB       GLU  45   7.646  -1.713   6.528
  389    HB3  GLU  45          3HB       GLU  45   7.752  -3.441   6.204
  390    HG2  GLU  45          2HG       GLU  45  10.094  -3.368   5.882
  391    HG3  GLU  45          3HG       GLU  45  10.101  -1.621   5.627
  392    H    LEU  46           H        LEU  46   9.560  -1.841   2.770
  393    HA   LEU  46           HA       LEU  46   9.361  -4.429   1.395
  394    HB2  LEU  46          2HB       LEU  46   9.162  -2.298   0.116
  395    HB3  LEU  46          3HB       LEU  46  10.756  -1.810   0.649
  396    HG   LEU  46           HG       LEU  46  10.413  -4.338  -0.998
  397   HD11  LEU  46          1HD1      LEU  46  10.696  -1.574  -2.198
  398   HD12  LEU  46          2HD1      LEU  46   9.253  -2.589  -2.268
  399   HD13  LEU  46          3HD1      LEU  46  10.732  -3.110  -3.073
  400   HD21  LEU  46          1HD2      LEU  46  12.706  -3.832  -1.762
  401   HD22  LEU  46          2HD2      LEU  46  12.620  -3.999  -0.012
  402   HD23  LEU  46          3HD2      LEU  46  12.727  -2.393  -0.737
  403    H    ARG  47           H        ARG  47  10.729  -5.956   2.096
  404    HA   ARG  47           HA       ARG  47  13.376  -5.244   3.248
  405    HB2  ARG  47          2HB       ARG  47  11.571  -7.586   4.021
  406    HB3  ARG  47          3HB       ARG  47  13.167  -7.264   4.690
  407    HG2  ARG  47          2HG       ARG  47  12.319  -5.184   5.725
  408    HG3  ARG  47          3HG       ARG  47  10.718  -5.492   5.037
  409    HD2  ARG  47          2HD       ARG  47  10.593  -7.611   6.329
  410    HD3  ARG  47          3HD       ARG  47  12.177  -7.271   7.031
  411    HE   ARG  47           HE       ARG  47  10.340  -5.135   7.514
  412   HH11  ARG  47          1HH1      ARG  47  11.188  -8.372   8.642
  413   HH12  ARG  47          2HH1      ARG  47  10.543  -8.116  10.232
  414   HH21  ARG  47          1HH2      ARG  47   9.469  -4.839   9.600
  415   HH22  ARG  47          2HH2      ARG  47   9.570  -6.113  10.773
  416    H    THR  48           H        THR  48  14.807  -5.715   1.582
  417    HA   THR  48           HA       THR  48  15.205  -8.495   0.869
  418    HB   THR  48           HB       THR  48  13.553  -7.855  -0.872
  419    HG1  THR  48           HG1      THR  48  14.998  -9.361  -1.531
  420   HG21  THR  48          1HG2      THR  48  14.048  -6.238  -2.636
  421   HG22  THR  48          2HG2      THR  48  15.581  -5.829  -1.861
  422   HG23  THR  48          3HG2      THR  48  14.059  -5.430  -1.066
  423    H    ASN  49           H        ASN  49  17.359  -8.897   0.557
  424    HA   ASN  49           HA       ASN  49  19.620  -8.646   0.411
  425    HB2  ASN  49          2HB       ASN  49  18.845  -6.225  -1.283
  426    HB3  ASN  49          3HB       ASN  49  20.493  -6.834  -1.144
  427   HD21  ASN  49          1HD2      ASN  49  17.266  -7.574  -2.333
  428   HD22  ASN  49          2HD2      ASN  49  17.764  -8.780  -3.460
  429    H    GLY  50           H        GLY  50  18.153  -7.270   2.665
  430    HA2  GLY  50          2HA       GLY  50  18.915  -6.210   4.599
  431    HA3  GLY  50          3HA       GLY  50  20.372  -5.721   3.757
  432    H    LYS  51           H        LYS  51  17.840  -4.894   1.807
  433    HA   LYS  51           HA       LYS  51  17.812  -2.087   2.561
  434    HB2  LYS  51          2HB       LYS  51  16.294  -3.556   0.341
  435    HB3  LYS  51          3HB       LYS  51  16.427  -1.802   0.508
  436    HG2  LYS  51          2HG       LYS  51  18.809  -3.632   0.095
  437    HG3  LYS  51          3HG       LYS  51  17.927  -2.896  -1.240
  438    HD2  LYS  51          2HD       LYS  51  19.187  -1.223   0.967
  439    HD3  LYS  51          3HD       LYS  51  20.103  -1.752  -0.444
  440    HE2  LYS  51          2HE       LYS  51  19.304   0.508  -0.814
  441    HE3  LYS  51          3HE       LYS  51  18.467  -0.581  -1.916
  442    HZ1  LYS  51          1HZ       LYS  51  16.519  -0.483  -0.520
  443    HZ2  LYS  51          2HZ       LYS  51  17.005   1.094  -0.881
  444    HZ3  LYS  51          3HZ       LYS  51  17.336   0.436   0.635
  445    H    LYS  52           H        LYS  52  16.258  -1.191   3.795
  446    HA   LYS  52           HA       LYS  52  13.655  -2.518   4.247
  447    HB2  LYS  52          2HB       LYS  52  15.163  -3.164   6.113
  448    HB3  LYS  52          3HB       LYS  52  15.569  -1.476   6.394
  449    HG2  LYS  52          2HG       LYS  52  13.143  -1.079   6.993
  450    HG3  LYS  52          3HG       LYS  52  12.894  -2.828   6.887
  451    HD2  LYS  52          2HD       LYS  52  14.596  -3.173   8.671
  452    HD3  LYS  52          3HD       LYS  52  14.855  -1.430   8.762
  453    HE2  LYS  52          2HE       LYS  52  12.498  -1.144   9.467
  454    HE3  LYS  52          3HE       LYS  52  12.285  -2.895   9.429
  455    HZ1  LYS  52          1HZ       LYS  52  14.084  -3.029  11.108
  456    HZ2  LYS  52          2HZ       LYS  52  12.703  -2.225  11.654
  457    HZ3  LYS  52          3HZ       LYS  52  14.077  -1.343  11.213
  458    H    GLU  53           H        GLU  53  12.504  -0.992   3.144
  459    HA   GLU  53           HA       GLU  53  12.494   1.795   4.133
  460    HB2  GLU  53          2HB       GLU  53  12.634   0.997   1.185
  461    HB3  GLU  53          3HB       GLU  53  12.224   2.615   1.755
  462    HG2  GLU  53          2HG       GLU  53  14.432   2.831   2.800
  463    HG3  GLU  53          3HG       GLU  53  14.850   1.198   2.281
  464    H    ASN  54           H        ASN  54  10.494   2.515   4.499
  465    HA   ASN  54           HA       ASN  54   8.183   0.862   3.909
  466    HB2  ASN  54          2HB       ASN  54   8.544   3.428   5.512
  467    HB3  ASN  54          3HB       ASN  54   6.955   2.729   5.210
  468   HD21  ASN  54          1HD2      ASN  54  10.024   2.240   6.853
  469   HD22  ASN  54          2HD2      ASN  54   9.473   0.994   7.912
  470    H    TYR  55           H        TYR  55   6.871   1.127   2.229
  471    HA   TYR  55           HA       TYR  55   6.926   3.596   0.612
  472    HB2  TYR  55          2HB       TYR  55   6.104   0.734  -0.036
  473    HB3  TYR  55          3HB       TYR  55   5.747   2.085  -1.104
  474    HD1  TYR  55           HD1      TYR  55   7.200   2.383  -2.885
  475    HD2  TYR  55           HD2      TYR  55   8.761   0.655   0.695
  476    HE1  TYR  55           HE1      TYR  55   9.384   2.080  -3.982
  477    HE2  TYR  55           HE2      TYR  55  10.947   0.367  -0.392
  478    HH   TYR  55           HH       TYR  55  11.872   0.161  -2.648
  479    H    THR  56           H        THR  56   5.323   4.909   1.019
  480    HA   THR  56           HA       THR  56   2.728   4.142   2.067
  481    HB   THR  56           HB       THR  56   3.938   6.819   1.248
  482    HG1  THR  56           HG1      THR  56   3.415   5.609   3.770
  483   HG21  THR  56          1HG2      THR  56   1.480   6.952   1.026
  484   HG22  THR  56          2HG2      THR  56   2.039   7.892   2.406
  485   HG23  THR  56          3HG2      THR  56   1.295   6.318   2.674
  486    H    VAL  57           H        VAL  57   1.606   3.063   0.553
  487    HA   VAL  57           HA       VAL  57   1.436   3.984  -2.224
  488    HB   VAL  57           HB       VAL  57   0.139   1.531  -0.936
  489   HG11  VAL  57          1HG1      VAL  57   0.552   2.218  -3.874
  490   HG12  VAL  57          2HG1      VAL  57  -0.985   2.248  -3.010
  491   HG13  VAL  57          3HG1      VAL  57  -0.145   0.716  -3.257
  492   HG21  VAL  57          1HG2      VAL  57   1.962   0.190  -1.925
  493   HG22  VAL  57          2HG2      VAL  57   2.600   1.371  -0.777
  494   HG23  VAL  57          3HG2      VAL  57   2.740   1.662  -2.512
  495    H    GLU  58           H        GLU  58   0.115   5.675  -2.389
  496    HA   GLU  58           HA       GLU  58  -2.282   6.105  -0.828
  497    HB2  GLU  58          2HB       GLU  58  -1.336   7.531  -3.361
  498    HB3  GLU  58          3HB       GLU  58  -2.538   8.124  -2.211
  499    HG2  GLU  58          2HG       GLU  58  -0.786   8.329  -0.485
  500    HG3  GLU  58          3HG       GLU  58   0.410   7.698  -1.618
  501    H    VAL  59           H        VAL  59  -4.030   4.849  -1.248
  502    HA   VAL  59           HA       VAL  59  -4.850   4.371  -4.070
  503    HB   VAL  59           HB       VAL  59  -5.510   2.502  -1.764
  504   HG11  VAL  59          1HG1      VAL  59  -6.097   0.884  -3.537
  505   HG12  VAL  59          2HG1      VAL  59  -5.710   2.101  -4.758
  506   HG13  VAL  59          3HG1      VAL  59  -7.051   2.367  -3.642
  507   HG21  VAL  59          1HG2      VAL  59  -3.069   2.431  -1.994
  508   HG22  VAL  59          2HG2      VAL  59  -3.222   2.128  -3.730
  509   HG23  VAL  59          3HG2      VAL  59  -3.780   0.918  -2.570
  510    H    GLU  60           H        GLU  60  -6.628   5.520  -4.475
  511    HA   GLU  60           HA       GLU  60  -8.394   6.469  -2.305
  512    HB2  GLU  60          2HB       GLU  60  -7.420   8.213  -3.670
  513    HB3  GLU  60          3HB       GLU  60  -7.880   7.392  -5.159
  514    HG2  GLU  60          2HG       GLU  60 -10.312   7.771  -4.473
  515    HG3  GLU  60          3HG       GLU  60  -9.693   8.806  -3.182
  516    H    ARG  61           H        ARG  61 -10.641   6.194  -2.441
  517    HA   ARG  61           HA       ARG  61 -11.633   3.953  -3.983
  518    HB2  ARG  61          2HB       ARG  61 -12.311   4.407  -1.587
  519    HB3  ARG  61          3HB       ARG  61 -13.183   5.832  -2.136
  520    HG2  ARG  61          2HG       ARG  61 -14.635   3.842  -1.751
  521    HG3  ARG  61          3HG       ARG  61 -14.746   4.488  -3.388
  522    HD2  ARG  61          2HD       ARG  61 -14.203   2.460  -4.247
  523    HD3  ARG  61          3HD       ARG  61 -12.686   2.447  -3.358
  524    HE   ARG  61           HE       ARG  61 -14.473   1.660  -1.489
  525   HH11  ARG  61          1HH1      ARG  61 -13.802   0.526  -4.766
  526   HH12  ARG  61          2HH1      ARG  61 -14.252  -1.109  -4.418
  527   HH21  ARG  61          1HH2      ARG  61 -14.934  -0.537  -1.035
  528   HH22  ARG  61          2HH2      ARG  61 -14.888  -1.710  -2.322
  529    H    GLN  62           H        GLN  62 -12.191   4.244  -6.030
  530    HA   GLN  62           HA       GLN  62 -13.589   6.704  -6.929
  531    HB2  GLN  62          2HB       GLN  62 -11.235   6.361  -7.842
  532    HB3  GLN  62          3HB       GLN  62 -11.796   4.898  -8.624
  533    HG2  GLN  62          2HG       GLN  62 -11.737   6.642 -10.272
  534    HG3  GLN  62          3HG       GLN  62 -13.425   6.278  -9.935
  535   HE21  GLN  62          1HE2      GLN  62 -12.144   8.693 -11.080
  536   HE22  GLN  62          2HE2      GLN  62 -12.657  10.016 -10.092
  537    H    GLY  63           H        GLY  63 -15.602   5.803  -6.420
  538    HA2  GLY  63          2HA       GLY  63 -17.564   4.684  -6.844
  539    HA3  GLY  63          3HA       GLY  63 -16.859   4.119  -8.357
  540    H    ASN  64           H        ASN  64 -17.158   1.967  -8.375
  541    HA   ASN  64           HA       ASN  64 -17.020   0.292  -6.009
  542    HB2  ASN  64          2HB       ASN  64 -17.437  -0.391  -8.953
  543    HB3  ASN  64          3HB       ASN  64 -17.433  -1.590  -7.664
  544   HD21  ASN  64          1HD2      ASN  64 -19.549  -2.208  -8.078
  545   HD22  ASN  64          2HD2      ASN  64 -20.908  -1.202  -7.715
  546    H    THR  65           H        THR  65 -14.588   1.640  -7.836
  547    HA   THR  65           HA       THR  65 -12.806  -0.737  -7.662
  548    HB   THR  65           HB       THR  65 -11.461   0.274  -9.485
  549    HG1  THR  65           HG1      THR  65 -12.515   2.510  -8.883
  550   HG21  THR  65          1HG2      THR  65 -13.049  -0.039 -11.356
  551   HG22  THR  65          2HG2      THR  65 -14.405   0.066 -10.231
  552   HG23  THR  65          3HG2      THR  65 -13.272  -1.283 -10.124
  553    H    TRP  66           H        TRP  66 -10.742  -0.460  -6.785
  554    HA   TRP  66           HA       TRP  66 -10.094   2.058  -5.387
  555    HB2  TRP  66          2HB       TRP  66  -8.930  -0.761  -5.225
  556    HB3  TRP  66          3HB       TRP  66  -8.167   0.623  -4.451
  557    HD1  TRP  66           HD1      TRP  66 -10.834  -1.943  -3.854
  558    HE1  TRP  66           HE1      TRP  66 -12.036  -1.441  -1.641
  559    HE3  TRP  66           HE3      TRP  66  -9.013   2.759  -2.940
  560    HZ2  TRP  66           HZ2      TRP  66 -12.221   0.628   0.226
  561    HZ3  TRP  66           HZ3      TRP  66  -9.775   3.938  -0.911
  562    HH2  TRP  66           HH2      TRP  66 -11.353   2.889   0.636
  563    H    THR  67           H        THR  67  -8.861   3.484  -6.449
  564    HA   THR  67           HA       THR  67  -7.111   2.607  -8.664
  565    HB   THR  67           HB       THR  67  -8.769   4.271  -9.350
  566    HG1  THR  67           HG1      THR  67  -6.549   4.345 -10.167
  567   HG21  THR  67          1HG2      THR  67  -9.173   5.430  -7.183
  568   HG22  THR  67          2HG2      THR  67  -8.825   6.579  -8.475
  569   HG23  THR  67          3HG2      THR  67  -7.575   6.182  -7.298
  570    H    VAL  68           H        VAL  68  -4.986   2.474  -8.242
  571    HA   VAL  68           HA       VAL  68  -3.781   3.578  -5.862
  572    HB   VAL  68           HB       VAL  68  -2.384   2.254  -8.243
  573   HG11  VAL  68          1HG1      VAL  68  -1.375   2.739  -5.410
  574   HG12  VAL  68          2HG1      VAL  68  -0.839   3.590  -6.860
  575   HG13  VAL  68          3HG1      VAL  68  -0.505   1.868  -6.678
  576   HG21  VAL  68          1HG2      VAL  68  -4.050   0.731  -7.221
  577   HG22  VAL  68          2HG2      VAL  68  -3.311   0.973  -5.636
  578   HG23  VAL  68          3HG2      VAL  68  -2.402   0.172  -6.921
  579    H    LYS  69           H        LYS  69  -3.535   5.704  -5.777
  580    HA   LYS  69           HA       LYS  69  -3.311   7.469  -7.968
  581    HB2  LYS  69          2HB       LYS  69  -2.510   8.012  -5.071
  582    HB3  LYS  69          3HB       LYS  69  -2.891   9.219  -6.297
  583    HG2  LYS  69          2HG       LYS  69  -4.830   7.222  -5.086
  584    HG3  LYS  69          3HG       LYS  69  -4.731   8.938  -4.694
  585    HD2  LYS  69          2HD       LYS  69  -5.452   7.835  -7.438
  586    HD3  LYS  69          3HD       LYS  69  -6.626   8.310  -6.219
  587    HE2  LYS  69          2HE       LYS  69  -6.553  10.194  -7.592
  588    HE3  LYS  69          3HE       LYS  69  -5.422  10.644  -6.318
  589    HZ1  LYS  69          1HZ       LYS  69  -3.586  10.060  -7.759
  590    HZ2  LYS  69          2HZ       LYS  69  -4.606  11.130  -8.579
  591    HZ3  LYS  69          3HZ       LYS  69  -4.642   9.480  -8.947
  592    H    ARG  70           H        ARG  70  -0.862   6.535  -5.501
  593    HA   ARG  70           HA       ARG  70   1.233   6.219  -7.410
  594    HB2  ARG  70          2HB       ARG  70   1.090   8.729  -7.317
  595    HB3  ARG  70          3HB       ARG  70   1.448   8.671  -5.594
  596    HG2  ARG  70          2HG       ARG  70   3.675   7.784  -6.039
  597    HG3  ARG  70          3HG       ARG  70   3.320   7.647  -7.763
  598    HD2  ARG  70          2HD       ARG  70   3.099  10.106  -7.905
  599    HD3  ARG  70          3HD       ARG  70   3.444  10.236  -6.180
  600    HE   ARG  70           HE       ARG  70   5.475   8.901  -7.779
  601   HH11  ARG  70          1HH1      ARG  70   4.423  11.960  -6.389
  602   HH12  ARG  70          2HH1      ARG  70   5.995  12.686  -6.480
  603   HH21  ARG  70          1HH2      ARG  70   7.530   9.883  -7.924
  604   HH22  ARG  70          2HH2      ARG  70   7.755  11.508  -7.351
  605    H    ILE  71           H        ILE  71   2.748   4.908  -6.599
  606    HA   ILE  71           HA       ILE  71   2.824   4.155  -3.774
  607    HB   ILE  71           HB       ILE  71   4.492   3.175  -6.149
  608   HG12  ILE  71          2HG1      ILE  71   2.102   1.839  -4.804
  609   HG13  ILE  71          3HG1      ILE  71   2.071   2.642  -6.370
  610   HG21  ILE  71          1HG2      ILE  71   4.303   1.999  -3.351
  611   HG22  ILE  71          2HG2      ILE  71   5.703   2.817  -4.045
  612   HG23  ILE  71          3HG2      ILE  71   5.163   1.275  -4.711
  613   HD11  ILE  71          1HD1      ILE  71   2.153   0.277  -6.671
  614   HD12  ILE  71          2HD1      ILE  71   3.594   0.136  -5.666
  615   HD13  ILE  71          3HD1      ILE  71   3.675   0.972  -7.221
  616    H    THR  72           H        THR  72   3.882   5.590  -2.530
  617    HA   THR  72           HA       THR  72   6.205   7.094  -3.568
  618    HB   THR  72           HB       THR  72   4.441   7.758  -1.166
  619    HG1  THR  72           HG1      THR  72   3.270   7.793  -3.184
  620   HG21  THR  72          1HG2      THR  72   6.692   8.841  -1.139
  621   HG22  THR  72          2HG2      THR  72   5.402  10.022  -1.365
  622   HG23  THR  72          3HG2      THR  72   6.369   9.514  -2.747
  623    H    ARG  73           H        ARG  73   8.095   6.195  -2.915
  624    HA   ARG  73           HA       ARG  73   8.488   4.631  -0.559
  625    HB2  ARG  73          2HB       ARG  73   9.969   4.470  -2.560
  626    HB3  ARG  73          3HB       ARG  73  10.530   6.116  -2.280
  627    HG2  ARG  73          2HG       ARG  73  11.372   5.275   0.005
  628    HG3  ARG  73          3HG       ARG  73  11.058   3.647  -0.597
  629    HD2  ARG  73          2HD       ARG  73  12.890   5.646  -1.956
  630    HD3  ARG  73          3HD       ARG  73  13.435   4.420  -0.810
  631    HE   ARG  73           HE       ARG  73  11.955   3.341  -3.039
  632   HH11  ARG  73          1HH1      ARG  73  15.172   4.297  -1.933
  633   HH12  ARG  73          2HH1      ARG  73  15.987   3.285  -3.080
  634   HH21  ARG  73          1HH2      ARG  73  13.048   2.016  -4.514
  635   HH22  ARG  73          2HH2      ARG  73  14.786   1.994  -4.545
  636    H    THR  74           H        THR  74   9.402   5.250   1.432
  637    HA   THR  74           HA       THR  74   9.243   7.836   2.520
  638    HB   THR  74           HB       THR  74   9.422   5.863   3.976
  639    HG1  THR  74           HG1      THR  74  11.112   6.636   5.376
  640   HG21  THR  74          1HG2      THR  74  11.524   4.585   4.239
  641   HG22  THR  74          2HG2      THR  74  12.261   5.516   2.933
  642   HG23  THR  74          3HG2      THR  74  10.905   4.438   2.592
  643    H    VAL  75           H        VAL  75  10.949   9.392   2.973
  644    HA   VAL  75           HA       VAL  75  12.895   9.765   0.936
  645    HB   VAL  75           HB       VAL  75  12.048  11.734   2.037
  646   HG11  VAL  75          1HG1      VAL  75  13.208  10.756   4.668
  647   HG12  VAL  75          2HG1      VAL  75  11.496  10.848   4.256
  648   HG13  VAL  75          3HG1      VAL  75  12.448  12.327   4.391
  649   HG21  VAL  75          1HG2      VAL  75  14.974  11.405   2.799
  650   HG22  VAL  75          2HG2      VAL  75  14.121  12.937   2.598
  651   HG23  VAL  75          3HG2      VAL  75  14.364  11.877   1.211
  652    H    GLY  76           H        GLY  76  14.341   8.210   0.694
  653    HA2  GLY  76          2HA       GLY  76  16.231   7.523   2.874
  654    HA3  GLY  76          3HA       GLY  76  15.479   6.263   1.896
  655    H    SER  77           H        SER  77  15.601   8.135  -0.508
  656    HA   SER  77           HA       SER  77  18.123   7.328  -1.554
  657    HB2  SER  77          2HB       SER  77  16.126   7.660  -2.997
  658    HB3  SER  77          3HB       SER  77  16.149   9.390  -2.646
  659    HG   SER  77           HG       SER  77  17.191   8.674  -4.651
  660    H    LEU  78           H        LEU  78  20.039   8.356  -1.497
  661    HA   LEU  78           HA       LEU  78  20.592  10.504   0.226
  662    HB2  LEU  78          2HB       LEU  78  22.281   8.829  -0.376
  663    HB3  LEU  78          3HB       LEU  78  22.238   9.341  -2.054
  664    HG   LEU  78           HG       LEU  78  23.201  11.571  -1.366
  665   HD11  LEU  78          1HD1      LEU  78  22.448  11.670   0.937
  666   HD12  LEU  78          2HD1      LEU  78  24.199  11.841   0.858
  667   HD13  LEU  78          3HD1      LEU  78  23.487  10.307   1.370
  668   HD21  LEU  78          1HD2      LEU  78  24.885   9.163  -0.612
  669   HD22  LEU  78          2HD2      LEU  78  25.497  10.774  -0.999
  670   HD23  LEU  78          3HD2      LEU  78  24.671   9.829  -2.234
  671    H    GLU  79           H        GLU  79  19.981  10.397  -3.256
  672    HA   GLU  79           HA       GLU  79  20.872  13.084  -3.805
  673    HB2  GLU  79          2HB       GLU  79  20.213  12.677  -6.101
  674    HB3  GLU  79          3HB       GLU  79  21.047  11.248  -5.503
  675    HG2  GLU  79          2HG       GLU  79  19.066   9.972  -5.402
  676    HG3  GLU  79          3HG       GLU  79  18.031  11.395  -5.442
  677    H    HIS  80           H        HIS  80  18.232  12.167  -2.136
  678    HA   HIS  80           HA       HIS  80  15.932  13.195  -3.181
  679    HB2  HIS  80          2HB       HIS  80  15.937  12.098  -0.995
  680    HB3  HIS  80          3HB       HIS  80  16.891  13.401  -0.288
  681    HD1  HIS  80           HD1      HIS  80  13.403  12.573  -1.449
  682    HD2  HIS  80           HD2      HIS  80  15.385  15.650   0.523
  683    HE1  HIS  80           HE1      HIS  80  11.609  14.053  -0.514
  684    HE2  HIS  80           HE2      HIS  80  12.831  15.974   0.546
  685    H    HIS  81           H        HIS  81  15.709  15.001  -4.241
  686    HA   HIS  81           HA       HIS  81  17.213  17.388  -3.928
  687    HB2  HIS  81          2HB       HIS  81  14.575  16.878  -5.381
  688    HB3  HIS  81          3HB       HIS  81  15.543  18.339  -5.548
  689    HD1  HIS  81           HD1      HIS  81  17.083  18.309  -7.513
  690    HD2  HIS  81           HD2      HIS  81  16.166  14.461  -6.246
  691    HE1  HIS  81           HE1      HIS  81  18.201  16.766  -9.146
  692    HE2  HIS  81           HE2      HIS  81  17.755  14.459  -8.267
  693    H    HIS  82           H        HIS  82  16.606  19.386  -3.001
  694    HA   HIS  82           HA       HIS  82  15.293  19.157  -0.500
  695    HB2  HIS  82          2HB       HIS  82  16.317  21.605  -1.995
  696    HB3  HIS  82          3HB       HIS  82  15.631  21.689  -0.374
  697    HD1  HIS  82           HD1      HIS  82  17.329  21.568   1.437
  698    HD2  HIS  82           HD2      HIS  82  18.626  19.616  -1.995
  699    HE1  HIS  82           HE1      HIS  82  19.646  20.758   1.951
  700    HE2  HIS  82           HE2      HIS  82  20.419  19.622  -0.147
  701    H    HIS  83           H        HIS  83  13.255  18.631  -0.590
  702    HA   HIS  83           HA       HIS  83  11.160  20.441  -1.261
  703    HB2  HIS  83          2HB       HIS  83  11.582  19.633  -3.561
  704    HB3  HIS  83          3HB       HIS  83  11.552  17.961  -3.016
  705    HD1  HIS  83           HD1      HIS  83   9.277  20.896  -3.651
  706    HD2  HIS  83           HD2      HIS  83   9.010  16.827  -2.868
  707    HE1  HIS  83           HE1      HIS  83   6.862  20.297  -3.979
  708    HE2  HIS  83           HE2      HIS  83   6.702  17.890  -3.276
  709    H    HIS  84           H        HIS  84   9.678  20.032   0.232
  710    HA   HIS  84           HA       HIS  84   9.613  17.477   1.687
  711    HB2  HIS  84          2HB       HIS  84   8.268  20.162   2.254
  712    HB3  HIS  84          3HB       HIS  84   8.091  18.732   3.266
  713    HD1  HIS  84           HD1      HIS  84   9.675  18.606   5.162
  714    HD2  HIS  84           HD2      HIS  84  11.133  21.025   2.115
  715    HE1  HIS  84           HE1      HIS  84  11.824  19.570   6.027
  716    HE2  HIS  84           HE2      HIS  84  12.589  21.154   4.234
  717    H    HIS  85           H        HIS  85   7.837  16.154   1.698
  718    HA   HIS  85           HA       HIS  85   5.882  16.346  -0.401
  719    HB2  HIS  85          2HB       HIS  85   6.698  14.132   0.279
  720    HB3  HIS  85          3HB       HIS  85   6.159  14.391   1.935
  721    HD1  HIS  85           HD1      HIS  85   3.586  14.329   2.364
  722    HD2  HIS  85           HD2      HIS  85   4.716  13.191  -1.469
  723    HE1  HIS  85           HE1      HIS  85   1.582  13.202   1.379
  724    HE2  HIS  85           HE2      HIS  85   2.349  12.367  -0.860
  Start of MODEL   10
    1    H1   MET   1          1H        MET   1 -22.446  -2.966   4.460
    2    H2   MET   1          2H        MET   1 -21.815  -2.962   2.896
    3    H3   MET   1          3H        MET   1 -21.524  -1.657   3.925
    4    HA   MET   1           HA       MET   1 -20.553  -4.423   4.310
    5    HB2  MET   1          2HB       MET   1 -18.999  -1.893   3.576
    6    HB3  MET   1          3HB       MET   1 -18.306  -3.495   3.802
    7    HG2  MET   1          2HG       MET   1 -19.470  -4.330   1.847
    8    HG3  MET   1          3HG       MET   1 -20.334  -2.808   1.664
    9    HE1  MET   1          1HE       MET   1 -17.962  -0.655   2.215
   10    HE2  MET   1          2HE       MET   1 -19.114  -0.493   0.887
   11    HE3  MET   1          3HE       MET   1 -17.384  -0.399   0.569
   12    HA   PRO   2           HA       PRO   2 -21.204  -2.571   8.540
   13    HB2  PRO   2          2HB       PRO   2 -20.543  -5.414   9.325
   14    HB3  PRO   2          3HB       PRO   2 -21.911  -4.390   9.822
   15    HG2  PRO   2          2HG       PRO   2 -22.294  -6.364   8.086
   16    HG3  PRO   2          3HG       PRO   2 -23.119  -4.802   7.870
   17    HD2  PRO   2          2HD       PRO   2 -20.690  -5.866   6.430
   18    HD3  PRO   2          3HD       PRO   2 -22.096  -4.989   5.781
   19    H    SER   3           H        SER   3 -18.629  -4.974   7.909
   20    HA   SER   3           HA       SER   3 -16.749  -3.644   9.700
   21    HB2  SER   3          2HB       SER   3 -16.318  -5.993   7.796
   22    HB3  SER   3          3HB       SER   3 -15.222  -5.476   9.077
   23    HG   SER   3           HG       SER   3 -17.811  -5.958   9.894
   24    H    GLU   4           H        GLU   4 -16.196  -1.655   8.819
   25    HA   GLU   4           HA       GLU   4 -15.589  -1.228   6.051
   26    HB2  GLU   4          2HB       GLU   4 -14.881   1.038   6.784
   27    HB3  GLU   4          3HB       GLU   4 -16.453   0.582   7.413
   28    HG2  GLU   4          2HG       GLU   4 -15.442   1.692   9.203
   29    HG3  GLU   4          3HG       GLU   4 -15.241  -0.012   9.601
   30    H    GLU   5           H        GLU   5 -13.735  -2.351   8.774
   31    HA   GLU   5           HA       GLU   5 -11.109  -2.258   7.903
   32    HB2  GLU   5          2HB       GLU   5 -12.631  -4.437   9.378
   33    HB3  GLU   5          3HB       GLU   5 -10.900  -4.558   9.085
   34    HG2  GLU   5          2HG       GLU   5 -12.249  -2.323  10.627
   35    HG3  GLU   5          3HG       GLU   5 -11.447  -3.720  11.345
   36    H    GLU   6           H        GLU   6 -13.725  -4.200   6.593
   37    HA   GLU   6           HA       GLU   6 -12.333  -6.079   5.074
   38    HB2  GLU   6          2HB       GLU   6 -14.789  -6.080   5.380
   39    HB3  GLU   6          3HB       GLU   6 -14.928  -4.622   4.408
   40    HG2  GLU   6          2HG       GLU   6 -15.596  -6.618   3.145
   41    HG3  GLU   6          3HG       GLU   6 -14.187  -5.837   2.425
   42    H    GLU   7           H        GLU   7 -13.083  -2.663   4.397
   43    HA   GLU   7           HA       GLU   7 -12.128  -2.566   1.741
   44    HB2  GLU   7          2HB       GLU   7 -12.195  -0.282   3.759
   45    HB3  GLU   7          3HB       GLU   7 -12.055  -0.114   2.011
   46    HG2  GLU   7          2HG       GLU   7 -14.436  -1.055   3.611
   47    HG3  GLU   7          3HG       GLU   7 -14.322   0.351   2.553
   48    H    LYS   8           H        LYS   8 -10.526  -2.054   4.856
   49    HA   LYS   8           HA       LYS   8  -7.991  -1.235   3.897
   50    HB2  LYS   8          2HB       LYS   8  -8.850  -2.561   6.499
   51    HB3  LYS   8          3HB       LYS   8  -7.156  -2.220   6.171
   52    HG2  LYS   8          2HG       LYS   8  -8.120  -0.494   7.579
   53    HG3  LYS   8          3HG       LYS   8  -7.648   0.183   6.019
   54    HD2  LYS   8          2HD       LYS   8  -9.954   0.283   5.288
   55    HD3  LYS   8          3HD       LYS   8 -10.500  -0.630   6.700
   56    HE2  LYS   8          2HE       LYS   8  -9.222   2.125   6.799
   57    HE3  LYS   8          3HE       LYS   8 -10.954   1.799   6.910
   58    HZ1  LYS   8          1HZ       LYS   8  -8.879   0.853   8.808
   59    HZ2  LYS   8          2HZ       LYS   8 -10.530   0.485   8.905
   60    HZ3  LYS   8          3HZ       LYS   8 -10.007   2.083   9.084
   61    H    ARG   9           H        ARG   9  -9.358  -4.429   4.625
   62    HA   ARG   9           HA       ARG   9  -7.131  -6.073   4.209
   63    HB2  ARG   9          2HB       ARG   9  -9.118  -6.993   5.203
   64    HB3  ARG   9          3HB       ARG   9 -10.116  -6.535   3.828
   65    HG2  ARG   9          2HG       ARG   9  -9.015  -8.235   2.439
   66    HG3  ARG   9          3HG       ARG   9  -7.962  -8.677   3.783
   67    HD2  ARG   9          2HD       ARG   9  -9.851  -9.492   5.068
   68    HD3  ARG   9          3HD       ARG   9 -10.989  -8.891   3.852
   69    HE   ARG   9           HE       ARG   9  -9.583 -10.533   2.344
   70   HH11  ARG   9          1HH1      ARG   9 -10.794 -11.161   5.597
   71   HH12  ARG   9          2HH1      ARG   9 -10.940 -12.868   5.327
   72   HH21  ARG   9          1HH2      ARG   9  -9.829 -12.750   2.009
   73   HH22  ARG   9          2HH2      ARG   9 -10.394 -13.765   3.299
   74    H    GLN  10           H        GLN  10  -9.545  -4.862   1.928
   75    HA   GLN  10           HA       GLN  10  -8.574  -6.189  -0.396
   76    HB2  GLN  10          2HB       GLN  10 -10.377  -3.748  -0.106
   77    HB3  GLN  10          3HB       GLN  10 -10.100  -4.601  -1.622
   78    HG2  GLN  10          2HG       GLN  10 -11.170  -6.604  -0.772
   79    HG3  GLN  10          3HG       GLN  10 -11.283  -5.910   0.849
   80   HE21  GLN  10          1HE2      GLN  10 -12.852  -4.281   1.235
   81   HE22  GLN  10          2HE2      GLN  10 -14.170  -4.000   0.160
   82    H    VAL  11           H        VAL  11  -8.065  -2.932   0.937
   83    HA   VAL  11           HA       VAL  11  -6.695  -1.859  -1.333
   84    HB   VAL  11           HB       VAL  11  -7.057  -0.866   1.534
   85   HG11  VAL  11          1HG1      VAL  11  -5.743   0.624  -0.757
   86   HG12  VAL  11          2HG1      VAL  11  -4.970   0.119   0.743
   87   HG13  VAL  11          3HG1      VAL  11  -6.233   1.348   0.772
   88   HG21  VAL  11          1HG2      VAL  11  -8.599   0.752   0.487
   89   HG22  VAL  11          2HG2      VAL  11  -9.089  -0.906   0.152
   90   HG23  VAL  11          3HG2      VAL  11  -8.280   0.043  -1.096
   91    H    LYS  12           H        LYS  12  -5.578  -3.075   1.837
   92    HA   LYS  12           HA       LYS  12  -2.811  -2.593   1.535
   93    HB2  LYS  12          2HB       LYS  12  -4.244  -4.764   3.126
   94    HB3  LYS  12          3HB       LYS  12  -2.515  -4.452   3.236
   95    HG2  LYS  12          2HG       LYS  12  -2.961  -2.199   4.121
   96    HG3  LYS  12          3HG       LYS  12  -4.700  -2.481   3.991
   97    HD2  LYS  12          2HD       LYS  12  -2.781  -4.090   5.728
   98    HD3  LYS  12          3HD       LYS  12  -3.864  -2.831   6.313
   99    HE2  LYS  12          2HE       LYS  12  -5.817  -4.185   5.628
  100    HE3  LYS  12          3HE       LYS  12  -4.737  -5.440   5.019
  101    HZ1  LYS  12          1HZ       LYS  12  -4.841  -4.533   7.844
  102    HZ2  LYS  12          2HZ       LYS  12  -3.926  -5.815   7.236
  103    HZ3  LYS  12          3HZ       LYS  12  -5.617  -5.913   7.252
  104    H    GLN  13           H        GLN  13  -4.919  -5.258   0.533
  105    HA   GLN  13           HA       GLN  13  -2.916  -7.039  -0.381
  106    HB2  GLN  13          2HB       GLN  13  -5.256  -7.773  -0.003
  107    HB3  GLN  13          3HB       GLN  13  -5.809  -6.758  -1.332
  108    HG2  GLN  13          2HG       GLN  13  -4.440  -8.130  -2.905
  109    HG3  GLN  13          3HG       GLN  13  -3.970  -9.163  -1.558
  110   HE21  GLN  13          1HE2      GLN  13  -7.229  -7.825  -2.013
  111   HE22  GLN  13          2HE2      GLN  13  -7.981  -9.341  -2.346
  112    H    VAL  14           H        VAL  14  -4.930  -4.662  -2.158
  113    HA   VAL  14           HA       VAL  14  -3.812  -4.931  -4.702
  114    HB   VAL  14           HB       VAL  14  -4.941  -2.387  -3.418
  115   HG11  VAL  14          1HG1      VAL  14  -4.566  -3.039  -6.365
  116   HG12  VAL  14          2HG1      VAL  14  -3.692  -1.813  -5.444
  117   HG13  VAL  14          3HG1      VAL  14  -5.425  -1.631  -5.735
  118   HG21  VAL  14          1HG2      VAL  14  -6.566  -4.243  -3.367
  119   HG22  VAL  14          2HG2      VAL  14  -6.375  -4.484  -5.098
  120   HG23  VAL  14          3HG2      VAL  14  -7.090  -2.989  -4.490
  121    H    ALA  15           H        ALA  15  -2.822  -2.919  -1.976
  122    HA   ALA  15           HA       ALA  15  -0.808  -1.380  -3.216
  123    HB1  ALA  15          1HB       ALA  15  -0.206  -0.764  -0.908
  124    HB2  ALA  15          2HB       ALA  15  -1.196  -2.086  -0.282
  125    HB3  ALA  15          3HB       ALA  15  -1.952  -0.735  -1.134
  126    H    LYS  16           H        LYS  16  -0.641  -4.345  -1.240
  127    HA   LYS  16           HA       LYS  16   2.197  -4.464  -1.129
  128    HB2  LYS  16          2HB       LYS  16   1.935  -6.606  -0.030
  129    HB3  LYS  16          3HB       LYS  16   0.701  -5.510   0.568
  130    HG2  LYS  16          2HG       LYS  16  -0.950  -6.611  -0.935
  131    HG3  LYS  16          3HG       LYS  16   0.285  -7.774  -1.403
  132    HD2  LYS  16          2HD       LYS  16  -0.788  -7.366   1.423
  133    HD3  LYS  16          3HD       LYS  16  -1.234  -8.680   0.332
  134    HE2  LYS  16          2HE       LYS  16   1.532  -8.171   1.476
  135    HE3  LYS  16          3HE       LYS  16   0.421  -9.459   1.952
  136    HZ1  LYS  16          1HZ       LYS  16   0.591 -10.403  -0.237
  137    HZ2  LYS  16          2HZ       LYS  16   2.126 -10.233   0.425
  138    HZ3  LYS  16          3HZ       LYS  16   1.590  -9.146  -0.756
  139    H    GLU  17           H        GLU  17  -0.228  -5.862  -3.280
  140    HA   GLU  17           HA       GLU  17   1.420  -7.693  -4.632
  141    HB2  GLU  17          2HB       GLU  17  -1.072  -6.227  -5.589
  142    HB3  GLU  17          3HB       GLU  17  -0.286  -7.509  -6.497
  143    HG2  GLU  17          2HG       GLU  17  -1.680  -7.745  -3.829
  144    HG3  GLU  17          3HG       GLU  17  -2.167  -8.455  -5.358
  145    H    LYS  18           H        LYS  18   0.767  -4.242  -5.215
  146    HA   LYS  18           HA       LYS  18   2.151  -3.997  -7.674
  147    HB2  LYS  18          2HB       LYS  18   1.837  -1.821  -5.575
  148    HB3  LYS  18          3HB       LYS  18   2.120  -1.590  -7.291
  149    HG2  LYS  18          2HG       LYS  18  -0.410  -2.521  -5.930
  150    HG3  LYS  18          3HG       LYS  18  -0.162  -1.037  -6.831
  151    HD2  LYS  18          2HD       LYS  18  -0.202  -3.840  -8.030
  152    HD3  LYS  18          3HD       LYS  18  -1.536  -2.688  -8.077
  153    HE2  LYS  18          2HE       LYS  18   1.183  -2.265  -9.353
  154    HE3  LYS  18          3HE       LYS  18  -0.274  -2.752 -10.209
  155    HZ1  LYS  18          1HZ       LYS  18   0.156  -0.173  -8.804
  156    HZ2  LYS  18          2HZ       LYS  18  -1.285  -0.630  -9.561
  157    HZ3  LYS  18          3HZ       LYS  18   0.120  -0.415 -10.473
  158    H    LEU  19           H        LEU  19   3.176  -3.627  -4.303
  159    HA   LEU  19           HA       LEU  19   5.889  -2.871  -4.807
  160    HB2  LEU  19          2HB       LEU  19   4.514  -3.981  -2.337
  161    HB3  LEU  19          3HB       LEU  19   6.185  -3.438  -2.344
  162    HG   LEU  19           HG       LEU  19   3.744  -1.691  -2.871
  163   HD11  LEU  19          1HD1      LEU  19   5.661  -1.705  -0.524
  164   HD12  LEU  19          2HD1      LEU  19   3.999  -2.297  -0.509
  165   HD13  LEU  19          3HD1      LEU  19   4.318  -0.585  -0.769
  166   HD21  LEU  19          1HD2      LEU  19   5.323   0.196  -2.907
  167   HD22  LEU  19          2HD2      LEU  19   5.614  -0.928  -4.228
  168   HD23  LEU  19          3HD2      LEU  19   6.679  -0.930  -2.820
  169    H    LEU  20           H        LEU  20   4.284  -5.982  -4.473
  170    HA   LEU  20           HA       LEU  20   6.661  -7.595  -4.268
  171    HB2  LEU  20          2HB       LEU  20   3.796  -8.312  -5.034
  172    HB3  LEU  20          3HB       LEU  20   5.080  -9.504  -4.895
  173    HG   LEU  20           HG       LEU  20   4.015  -7.783  -2.617
  174   HD11  LEU  20          1HD1      LEU  20   2.410  -9.500  -3.296
  175   HD12  LEU  20          2HD1      LEU  20   3.085  -9.863  -1.711
  176   HD13  LEU  20          3HD1      LEU  20   3.648 -10.750  -3.132
  177   HD21  LEU  20          1HD2      LEU  20   6.392  -8.236  -2.299
  178   HD22  LEU  20          2HD2      LEU  20   6.121  -9.963  -2.544
  179   HD23  LEU  20          3HD2      LEU  20   5.426  -9.150  -1.141
  180    H    GLU  21           H        GLU  21   4.626  -6.401  -6.881
  181    HA   GLU  21           HA       GLU  21   5.866  -7.745  -9.063
  182    HB2  GLU  21          2HB       GLU  21   4.306  -5.123  -8.928
  183    HB3  GLU  21          3HB       GLU  21   4.844  -5.842 -10.446
  184    HG2  GLU  21          2HG       GLU  21   3.491  -7.854  -9.983
  185    HG3  GLU  21          3HG       GLU  21   2.949  -7.152  -8.463
  186    H    GLN  22           H        GLN  22   6.629  -4.813  -7.286
  187    HA   GLN  22           HA       GLN  22   8.760  -3.946  -9.023
  188    HB2  GLN  22          2HB       GLN  22   7.922  -3.091  -6.220
  189    HB3  GLN  22          3HB       GLN  22   9.296  -2.386  -7.070
  190    HG2  GLN  22          2HG       GLN  22   7.770  -1.667  -8.904
  191    HG3  GLN  22          3HG       GLN  22   6.407  -2.307  -7.987
  192   HE21  GLN  22          1HE2      GLN  22   5.709  -1.194  -6.150
  193   HE22  GLN  22          2HE2      GLN  22   6.192   0.431  -5.817
  194    H    SER  23           H        SER  23   8.579  -5.805  -5.997
  195    HA   SER  23           HA       SER  23  11.329  -6.730  -6.372
  196    HB2  SER  23          2HB       SER  23  11.418  -4.664  -4.896
  197    HB3  SER  23          3HB       SER  23  10.475  -5.547  -3.694
  198    HG   SER  23           HG       SER  23  12.629  -5.816  -3.203
  199    HA   PRO  24           HA       PRO  24   8.542 -10.226  -5.114
  200    HB2  PRO  24          2HB       PRO  24   9.572 -12.082  -6.838
  201    HB3  PRO  24          3HB       PRO  24   8.418 -10.843  -7.364
  202    HG2  PRO  24          2HG       PRO  24  11.400 -10.872  -7.663
  203    HG3  PRO  24          3HG       PRO  24  10.157 -10.425  -8.853
  204    HD2  PRO  24          2HD       PRO  24  11.552  -8.571  -7.399
  205    HD3  PRO  24          3HD       PRO  24   9.897  -8.295  -7.985
  206    H    ASN  25           H        ASN  25  11.977  -9.814  -5.109
  207    HA   ASN  25           HA       ASN  25  12.588 -12.160  -3.512
  208    HB2  ASN  25          2HB       ASN  25  14.255  -9.717  -4.257
  209    HB3  ASN  25          3HB       ASN  25  14.875 -11.100  -3.361
  210   HD21  ASN  25          1HD2      ASN  25  13.533 -13.140  -4.900
  211   HD22  ASN  25          2HD2      ASN  25  14.295 -13.172  -6.453
  212    H    SER  26           H        SER  26  11.324  -9.036  -2.910
  213    HA   SER  26           HA       SER  26  12.111  -9.032  -0.069
  214    HB2  SER  26          2HB       SER  26  10.636  -6.949  -1.752
  215    HB3  SER  26          3HB       SER  26  10.998  -6.777  -0.029
  216    HG   SER  26           HG       SER  26  12.812  -5.976  -0.709
  217    H    LYS  27           H        LYS  27  10.717  -9.597   1.504
  218    HA   LYS  27           HA       LYS  27   7.927 -10.229   0.969
  219    HB2  LYS  27          2HB       LYS  27   9.183 -11.609   2.582
  220    HB3  LYS  27          3HB       LYS  27   9.535 -10.188   3.564
  221    HG2  LYS  27          2HG       LYS  27   7.124  -9.917   4.049
  222    HG3  LYS  27          3HG       LYS  27   6.758 -11.332   3.062
  223    HD2  LYS  27          2HD       LYS  27   8.363 -11.291   5.650
  224    HD3  LYS  27          3HD       LYS  27   6.732 -11.930   5.441
  225    HE2  LYS  27          2HE       LYS  27   7.695 -13.609   3.813
  226    HE3  LYS  27          3HE       LYS  27   9.302 -13.041   4.268
  227    HZ1  LYS  27          1HZ       LYS  27   7.303 -14.209   6.124
  228    HZ2  LYS  27          2HZ       LYS  27   8.864 -13.723   6.536
  229    HZ3  LYS  27          3HZ       LYS  27   8.633 -15.028   5.492
  230    H    VAL  28           H        VAL  28   6.475  -8.607   0.871
  231    HA   VAL  28           HA       VAL  28   7.013  -6.029   2.204
  232    HB   VAL  28           HB       VAL  28   4.925  -6.723   0.079
  233   HG11  VAL  28          1HG1      VAL  28   4.590  -4.276  -0.105
  234   HG12  VAL  28          2HG1      VAL  28   5.712  -4.019   1.232
  235   HG13  VAL  28          3HG1      VAL  28   4.187  -4.861   1.510
  236   HG21  VAL  28          1HG2      VAL  28   6.365  -5.461  -1.490
  237   HG22  VAL  28          2HG2      VAL  28   7.233  -6.837  -0.807
  238   HG23  VAL  28          3HG2      VAL  28   7.555  -5.210  -0.208
  239    H    GLN  29           H        GLN  29   6.223  -5.928   4.201
  240    HA   GLN  29           HA       GLN  29   3.635  -7.131   4.964
  241    HB2  GLN  29          2HB       GLN  29   5.795  -5.761   6.647
  242    HB3  GLN  29          3HB       GLN  29   4.375  -6.590   7.276
  243    HG2  GLN  29          2HG       GLN  29   6.620  -7.905   5.721
  244    HG3  GLN  29          3HG       GLN  29   6.440  -7.943   7.475
  245   HE21  GLN  29          1HE2      GLN  29   4.762  -9.198   8.372
  246   HE22  GLN  29          2HE2      GLN  29   3.963 -10.444   7.478
  247    H    VAL  30           H        VAL  30   2.382  -5.528   6.593
  248    HA   VAL  30           HA       VAL  30   2.287  -2.818   5.368
  249    HB   VAL  30           HB       VAL  30   0.138  -3.972   5.204
  250   HG11  VAL  30          1HG1      VAL  30   0.156  -4.239   8.222
  251   HG12  VAL  30          2HG1      VAL  30   0.321  -5.553   7.059
  252   HG13  VAL  30          3HG1      VAL  30  -1.192  -4.652   7.158
  253   HG21  VAL  30          1HG2      VAL  30   0.080  -1.533   5.533
  254   HG22  VAL  30          2HG2      VAL  30   0.009  -1.751   7.283
  255   HG23  VAL  30          3HG2      VAL  30  -1.331  -2.294   6.271
  256    H    ARG  31           H        ARG  31   3.020  -1.159   6.526
  257    HA   ARG  31           HA       ARG  31   3.935  -1.497   9.270
  258    HB2  ARG  31          2HB       ARG  31   5.246  -0.246   7.459
  259    HB3  ARG  31          3HB       ARG  31   4.034   1.029   7.546
  260    HG2  ARG  31          2HG       ARG  31   5.949   1.690   8.862
  261    HG3  ARG  31          3HG       ARG  31   4.616   1.343   9.970
  262    HD2  ARG  31          2HD       ARG  31   5.593  -0.919  10.382
  263    HD3  ARG  31          3HD       ARG  31   6.945  -0.503   9.320
  264    HE   ARG  31           HE       ARG  31   6.617   1.382  11.438
  265   HH11  ARG  31          1HH1      ARG  31   7.962  -1.790  10.701
  266   HH12  ARG  31          2HH1      ARG  31   9.123  -1.726  11.984
  267   HH21  ARG  31          1HH2      ARG  31   8.118   1.447  13.136
  268   HH22  ARG  31          2HH2      ARG  31   9.207   0.118  13.369
  269    H    ARG  32           H        ARG  32   1.866   0.877   7.575
  270    HA   ARG  32           HA       ARG  32  -0.145   0.835   9.694
  271    HB2  ARG  32          2HB       ARG  32   1.345   3.361   8.842
  272    HB3  ARG  32          3HB       ARG  32  -0.252   3.426   9.581
  273    HG2  ARG  32          2HG       ARG  32   0.620   2.386  11.628
  274    HG3  ARG  32          3HG       ARG  32   2.221   2.255  10.895
  275    HD2  ARG  32          2HD       ARG  32   0.746   4.855  11.465
  276    HD3  ARG  32          3HD       ARG  32   2.082   4.190  12.420
  277    HE   ARG  32           HE       ARG  32   2.434   4.826   9.562
  278   HH11  ARG  32          1HH1      ARG  32   3.417   5.495  12.898
  279   HH12  ARG  32          2HH1      ARG  32   4.783   6.441  12.392
  280   HH21  ARG  32          1HH2      ARG  32   4.178   6.033   8.964
  281   HH22  ARG  32          2HH2      ARG  32   5.213   6.744  10.163
  282    H    VAL  33           H        VAL  33  -2.094   2.039   9.022
  283    HA   VAL  33           HA       VAL  33  -2.503   2.308   6.093
  284    HB   VAL  33           HB       VAL  33  -4.535   1.126   8.083
  285   HG11  VAL  33          1HG1      VAL  33  -5.638   2.358   6.266
  286   HG12  VAL  33          2HG1      VAL  33  -5.912   0.627   6.094
  287   HG13  VAL  33          3HG1      VAL  33  -4.733   1.437   5.061
  288   HG21  VAL  33          1HG2      VAL  33  -2.981  -0.314   5.908
  289   HG22  VAL  33          2HG2      VAL  33  -4.231  -1.021   6.937
  290   HG23  VAL  33          3HG2      VAL  33  -2.714  -0.466   7.647
  291    H    GLN  34           H        GLN  34  -2.859   4.493   5.824
  292    HA   GLN  34           HA       GLN  34  -4.218   6.002   7.987
  293    HB2  GLN  34          2HB       GLN  34  -1.889   6.750   7.365
  294    HB3  GLN  34          3HB       GLN  34  -2.455   7.088   5.731
  295    HG2  GLN  34          2HG       GLN  34  -2.365   9.160   6.982
  296    HG3  GLN  34          3HG       GLN  34  -4.058   8.762   6.680
  297   HE21  GLN  34          1HE2      GLN  34  -5.366   8.101   8.459
  298   HE22  GLN  34          2HE2      GLN  34  -4.872   8.366  10.097
  299    H    LYS  35           H        LYS  35  -6.381   6.065   7.509
  300    HA   LYS  35           HA       LYS  35  -7.393   6.519   4.840
  301    HB2  LYS  35          2HB       LYS  35  -8.710   5.289   6.563
  302    HB3  LYS  35          3HB       LYS  35  -8.800   6.749   7.544
  303    HG2  LYS  35          2HG       LYS  35 -10.897   6.373   6.333
  304    HG3  LYS  35          3HG       LYS  35 -10.124   7.861   5.781
  305    HD2  LYS  35          2HD       LYS  35  -9.271   6.700   3.786
  306    HD3  LYS  35          3HD       LYS  35  -9.971   5.180   4.349
  307    HE2  LYS  35          2HE       LYS  35 -11.537   7.668   3.606
  308    HE3  LYS  35          3HE       LYS  35 -11.318   6.253   2.582
  309    HZ1  LYS  35          1HZ       LYS  35 -12.479   4.936   4.265
  310    HZ2  LYS  35          2HZ       LYS  35 -13.440   6.179   3.654
  311    HZ3  LYS  35          3HZ       LYS  35 -12.736   6.328   5.181
  312    H    GLN  36           H        GLN  36  -7.960   8.447   3.947
  313    HA   GLN  36           HA       GLN  36  -7.776  10.953   5.467
  314    HB2  GLN  36          2HB       GLN  36  -5.472  10.381   4.493
  315    HB3  GLN  36          3HB       GLN  36  -6.181  10.509   2.887
  316    HG2  GLN  36          2HG       GLN  36  -5.017  12.561   3.426
  317    HG3  GLN  36          3HG       GLN  36  -6.746  12.887   3.363
  318   HE21  GLN  36          1HE2      GLN  36  -3.965  12.608   5.453
  319   HE22  GLN  36          2HE2      GLN  36  -4.679  13.350   6.840
  320    H    GLY  37           H        GLY  37 -10.035  10.924   5.160
  321    HA2  GLY  37          2HA       GLY  37 -11.953  11.708   4.181
  322    HA3  GLY  37          3HA       GLY  37 -10.997  12.218   2.796
  323    H    ASN  38           H        ASN  38 -10.466  10.607   1.170
  324    HA   ASN  38           HA       ASN  38 -12.051   8.102   1.169
  325    HB2  ASN  38          2HB       ASN  38 -11.833  10.134  -1.093
  326    HB3  ASN  38          3HB       ASN  38 -12.300   8.467  -1.391
  327   HD21  ASN  38          1HD2      ASN  38 -13.269  11.474   0.127
  328   HD22  ASN  38          2HD2      ASN  38 -14.944  11.079   0.279
  329    H    THR  39           H        THR  39  -9.028   9.695   0.563
  330    HA   THR  39           HA       THR  39  -7.859   7.497  -0.944
  331    HB   THR  39           HB       THR  39  -6.349   9.798   0.376
  332    HG1  THR  39           HG1      THR  39  -7.173   9.906  -2.320
  333   HG21  THR  39          1HG2      THR  39  -5.697   8.082  -2.058
  334   HG22  THR  39          2HG2      THR  39  -4.904   7.990  -0.482
  335   HG23  THR  39          3HG2      THR  39  -4.730   9.438  -1.473
  336    H    ILE  40           H        ILE  40  -7.369   5.628   0.161
  337    HA   ILE  40           HA       ILE  40  -6.372   5.751   2.919
  338    HB   ILE  40           HB       ILE  40  -6.712   3.302   1.115
  339   HG12  ILE  40          2HG1      ILE  40  -8.518   4.423   3.300
  340   HG13  ILE  40          3HG1      ILE  40  -8.909   4.273   1.592
  341   HG21  ILE  40          1HG2      ILE  40  -6.429   2.001   3.195
  342   HG22  ILE  40          2HG2      ILE  40  -6.177   3.490   4.105
  343   HG23  ILE  40          3HG2      ILE  40  -5.007   2.999   2.881
  344   HD11  ILE  40          1HD1      ILE  40  -8.483   1.997   3.536
  345   HD12  ILE  40          2HD1      ILE  40  -8.857   1.832   1.821
  346   HD13  ILE  40          3HD1      ILE  40 -10.023   2.576   2.904
  347    H    ARG  41           H        ARG  41  -4.357   6.512   2.966
  348    HA   ARG  41           HA       ARG  41  -2.258   5.748   1.090
  349    HB2  ARG  41          2HB       ARG  41  -1.951   7.393   3.642
  350    HB3  ARG  41          3HB       ARG  41  -0.944   7.429   2.198
  351    HG2  ARG  41          2HG       ARG  41  -2.812   8.461   0.941
  352    HG3  ARG  41          3HG       ARG  41  -3.792   8.454   2.412
  353    HD2  ARG  41          2HD       ARG  41  -2.932  10.658   2.269
  354    HD3  ARG  41          3HD       ARG  41  -1.915   9.863   3.481
  355    HE   ARG  41           HE       ARG  41  -1.086  10.068   0.658
  356   HH11  ARG  41          1HH1      ARG  41  -0.365  10.800   4.022
  357   HH12  ARG  41          2HH1      ARG  41   1.241  11.343   3.668
  358   HH21  ARG  41          1HH2      ARG  41   1.014  10.718   0.237
  359   HH22  ARG  41          2HH2      ARG  41   2.018  11.292   1.531
  360    H    VAL  42           H        VAL  42  -1.918   3.551   1.490
  361    HA   VAL  42           HA       VAL  42  -1.540   2.532   4.203
  362    HB   VAL  42           HB       VAL  42  -1.173   1.016   1.563
  363   HG11  VAL  42          1HG1      VAL  42  -1.460  -1.020   2.926
  364   HG12  VAL  42          2HG1      VAL  42  -1.610  -0.040   4.390
  365   HG13  VAL  42          3HG1      VAL  42  -0.083  -0.076   3.506
  366   HG21  VAL  42          1HG2      VAL  42  -3.443   0.122   1.934
  367   HG22  VAL  42          2HG2      VAL  42  -3.457   1.874   1.708
  368   HG23  VAL  42          3HG2      VAL  42  -3.631   1.191   3.328
  369    H    GLU  43           H        GLU  43   0.371   2.912   5.135
  370    HA   GLU  43           HA       GLU  43   2.881   3.071   3.642
  371    HB2  GLU  43          2HB       GLU  43   2.339   3.094   6.654
  372    HB3  GLU  43          3HB       GLU  43   3.889   3.443   5.889
  373    HG2  GLU  43          2HG       GLU  43   2.904   5.425   4.786
  374    HG3  GLU  43          3HG       GLU  43   1.352   5.066   5.538
  375    H    LEU  44           H        LEU  44   3.617   1.121   2.911
  376    HA   LEU  44           HA       LEU  44   3.409  -1.281   4.633
  377    HB2  LEU  44          2HB       LEU  44   4.142  -1.143   1.676
  378    HB3  LEU  44          3HB       LEU  44   3.890  -2.593   2.631
  379    HG   LEU  44           HG       LEU  44   1.448  -1.454   3.009
  380   HD11  LEU  44          1HD1      LEU  44   0.637  -0.408   0.966
  381   HD12  LEU  44          2HD1      LEU  44   2.257  -0.469   0.267
  382   HD13  LEU  44          3HD1      LEU  44   1.944   0.530   1.688
  383   HD21  LEU  44          1HD2      LEU  44   1.800  -3.713   2.172
  384   HD22  LEU  44          2HD2      LEU  44   2.183  -3.082   0.570
  385   HD23  LEU  44          3HD2      LEU  44   0.559  -2.878   1.234
  386    H    GLU  45           H        GLU  45   5.326  -2.805   4.310
  387    HA   GLU  45           HA       GLU  45   7.857  -1.324   4.696
  388    HB2  GLU  45          2HB       GLU  45   6.724  -2.122   6.801
  389    HB3  GLU  45          3HB       GLU  45   6.833  -3.777   6.214
  390    HG2  GLU  45          2HG       GLU  45   9.255  -3.712   6.329
  391    HG3  GLU  45          3HG       GLU  45   9.240  -1.997   6.740
  392    H    LEU  46           H        LEU  46   9.003  -1.797   2.888
  393    HA   LEU  46           HA       LEU  46   8.943  -4.488   1.664
  394    HB2  LEU  46          2HB       LEU  46   8.383  -2.413   0.307
  395    HB3  LEU  46          3HB       LEU  46  10.022  -1.855   0.537
  396    HG   LEU  46           HG       LEU  46   9.533  -4.533  -0.820
  397   HD11  LEU  46          1HD1      LEU  46   9.458  -3.444  -3.016
  398   HD12  LEU  46          2HD1      LEU  46   9.463  -1.853  -2.253
  399   HD13  LEU  46          3HD1      LEU  46   8.091  -2.937  -2.024
  400   HD21  LEU  46          1HD2      LEU  46  11.737  -2.464  -1.107
  401   HD22  LEU  46          2HD2      LEU  46  11.633  -3.987  -1.997
  402   HD23  LEU  46          3HD2      LEU  46  11.846  -4.004  -0.249
  403    H    ARG  47           H        ARG  47  10.546  -5.792   2.415
  404    HA   ARG  47           HA       ARG  47  13.050  -4.604   3.467
  405    HB2  ARG  47          2HB       ARG  47  11.941  -7.402   3.927
  406    HB3  ARG  47          3HB       ARG  47  13.313  -6.666   4.749
  407    HG2  ARG  47          2HG       ARG  47  11.855  -5.079   5.874
  408    HG3  ARG  47          3HG       ARG  47  10.456  -5.663   4.964
  409    HD2  ARG  47          2HD       ARG  47  10.765  -7.908   5.999
  410    HD3  ARG  47          3HD       ARG  47  12.090  -7.252   6.968
  411    HE   ARG  47           HE       ARG  47  10.247  -5.617   7.756
  412   HH11  ARG  47          1HH1      ARG  47   9.797  -9.045   7.129
  413   HH12  ARG  47          2HH1      ARG  47   8.504  -9.209   8.273
  414   HH21  ARG  47          1HH2      ARG  47   8.570  -5.830   9.242
  415   HH22  ARG  47          2HH2      ARG  47   7.806  -7.369   9.479
  416    H    THR  48           H        THR  48  14.403  -4.463   1.708
  417    HA   THR  48           HA       THR  48  14.857  -6.735  -0.074
  418    HB   THR  48           HB       THR  48  16.129  -3.959  -0.020
  419    HG1  THR  48           HG1      THR  48  14.495  -3.384  -1.250
  420   HG21  THR  48          1HG2      THR  48  16.278  -6.138  -2.147
  421   HG22  THR  48          2HG2      THR  48  17.625  -5.554  -1.164
  422   HG23  THR  48          3HG2      THR  48  16.862  -4.486  -2.341
  423    H    ASN  49           H        ASN  49  15.904  -8.308   1.042
  424    HA   ASN  49           HA       ASN  49  17.551  -9.540   1.972
  425    HB2  ASN  49          2HB       ASN  49  19.291  -7.371   0.720
  426    HB3  ASN  49          3HB       ASN  49  19.917  -8.888   1.369
  427   HD21  ASN  49          1HD2      ASN  49  19.442 -10.848   0.268
  428   HD22  ASN  49          2HD2      ASN  49  18.874 -10.854  -1.363
  429    H    GLY  50           H        GLY  50  16.235  -7.836   3.737
  430    HA2  GLY  50          2HA       GLY  50  16.482  -7.701   6.073
  431    HA3  GLY  50          3HA       GLY  50  18.227  -7.555   5.898
  432    H    LYS  51           H        LYS  51  17.521  -5.456   3.662
  433    HA   LYS  51           HA       LYS  51  17.549  -3.141   5.410
  434    HB2  LYS  51          2HB       LYS  51  17.613  -3.446   2.369
  435    HB3  LYS  51          3HB       LYS  51  17.608  -1.878   3.168
  436    HG2  LYS  51          2HG       LYS  51  19.733  -4.005   3.562
  437    HG3  LYS  51          3HG       LYS  51  19.875  -2.619   2.483
  438    HD2  LYS  51          2HD       LYS  51  19.583  -2.501   5.511
  439    HD3  LYS  51          3HD       LYS  51  21.064  -2.207   4.597
  440    HE2  LYS  51          2HE       LYS  51  20.030  -0.237   3.527
  441    HE3  LYS  51          3HE       LYS  51  18.528  -0.536   4.408
  442    HZ1  LYS  51          1HZ       LYS  51  19.835  -0.265   6.482
  443    HZ2  LYS  51          2HZ       LYS  51  19.724   1.138   5.555
  444    HZ3  LYS  51          3HZ       LYS  51  21.154   0.233   5.554
  445    H    LYS  52           H        LYS  52  15.817  -2.024   6.044
  446    HA   LYS  52           HA       LYS  52  13.132  -2.672   5.046
  447    HB2  LYS  52          2HB       LYS  52  13.516  -2.736   7.465
  448    HB3  LYS  52          3HB       LYS  52  14.135  -1.088   7.455
  449    HG2  LYS  52          2HG       LYS  52  11.851  -0.298   6.719
  450    HG3  LYS  52          3HG       LYS  52  11.271  -1.956   6.917
  451    HD2  LYS  52          2HD       LYS  52  10.720  -0.653   8.913
  452    HD3  LYS  52          3HD       LYS  52  11.926  -1.872   9.328
  453    HE2  LYS  52          2HE       LYS  52  13.698  -0.062   9.048
  454    HE3  LYS  52          3HE       LYS  52  12.380   1.103   8.906
  455    HZ1  LYS  52          1HZ       LYS  52  11.633   0.497  11.104
  456    HZ2  LYS  52          2HZ       LYS  52  13.252   0.965  11.158
  457    HZ3  LYS  52          3HZ       LYS  52  12.845  -0.674  11.241
  458    H    GLU  53           H        GLU  53  12.139  -1.347   3.621
  459    HA   GLU  53           HA       GLU  53  12.566   1.565   3.722
  460    HB2  GLU  53          2HB       GLU  53  13.988   0.564   1.878
  461    HB3  GLU  53          3HB       GLU  53  12.519  -0.021   1.114
  462    HG2  GLU  53          2HG       GLU  53  11.758   2.187   0.631
  463    HG3  GLU  53          3HG       GLU  53  12.929   2.923   1.724
  464    H    ASN  54           H        ASN  54  10.608   2.468   4.002
  465    HA   ASN  54           HA       ASN  54   8.201   0.866   3.582
  466    HB2  ASN  54          2HB       ASN  54   8.642   3.532   4.999
  467    HB3  ASN  54          3HB       ASN  54   7.070   2.735   4.866
  468   HD21  ASN  54          1HD2      ASN  54   6.741   0.755   5.990
  469   HD22  ASN  54          2HD2      ASN  54   7.761   0.277   7.304
  470    H    TYR  55           H        TYR  55   6.586   1.303   2.158
  471    HA   TYR  55           HA       TYR  55   6.828   3.647   0.341
  472    HB2  TYR  55          2HB       TYR  55   6.038   0.769  -0.299
  473    HB3  TYR  55          3HB       TYR  55   5.730   2.107  -1.395
  474    HD1  TYR  55           HD1      TYR  55   7.311   2.547  -3.063
  475    HD2  TYR  55           HD2      TYR  55   8.609   0.506   0.453
  476    HE1  TYR  55           HE1      TYR  55   9.518   2.213  -4.074
  477    HE2  TYR  55           HE2      TYR  55  10.830   0.176  -0.549
  478    HH   TYR  55           HH       TYR  55  11.990   0.261  -2.550
  479    H    THR  56           H        THR  56   5.153   4.975   0.670
  480    HA   THR  56           HA       THR  56   2.624   4.075   1.796
  481    HB   THR  56           HB       THR  56   3.443   6.875   0.860
  482    HG1  THR  56           HG1      THR  56   3.837   5.469   3.275
  483   HG21  THR  56          1HG2      THR  56   1.648   7.663   2.359
  484   HG22  THR  56          2HG2      THR  56   1.223   5.997   2.750
  485   HG23  THR  56          3HG2      THR  56   0.988   6.605   1.109
  486    H    VAL  57           H        VAL  57   1.501   2.923   0.295
  487    HA   VAL  57           HA       VAL  57   1.205   3.845  -2.474
  488    HB   VAL  57           HB       VAL  57   0.119   1.292  -1.180
  489   HG11  VAL  57          1HG1      VAL  57  -0.153   0.490  -3.512
  490   HG12  VAL  57          2HG1      VAL  57   0.376   2.061  -4.115
  491   HG13  VAL  57          3HG1      VAL  57  -1.127   1.929  -3.200
  492   HG21  VAL  57          1HG2      VAL  57   2.654   1.653  -2.814
  493   HG22  VAL  57          2HG2      VAL  57   2.001   0.109  -2.259
  494   HG23  VAL  57          3HG2      VAL  57   2.570   1.300  -1.087
  495    H    GLU  58           H        GLU  58  -0.211   5.400  -2.583
  496    HA   GLU  58           HA       GLU  58  -2.486   5.670  -0.799
  497    HB2  GLU  58          2HB       GLU  58  -1.512   7.408  -3.109
  498    HB3  GLU  58          3HB       GLU  58  -2.733   7.867  -1.921
  499    HG2  GLU  58          2HG       GLU  58  -1.055   7.776  -0.126
  500    HG3  GLU  58          3HG       GLU  58   0.154   7.209  -1.272
  501    H    VAL  59           H        VAL  59  -4.021   4.211  -1.306
  502    HA   VAL  59           HA       VAL  59  -5.023   3.976  -4.076
  503    HB   VAL  59           HB       VAL  59  -5.671   2.169  -1.700
  504   HG11  VAL  59          1HG1      VAL  59  -7.316   2.076  -3.505
  505   HG12  VAL  59          2HG1      VAL  59  -6.408   0.565  -3.433
  506   HG13  VAL  59          3HG1      VAL  59  -6.041   1.757  -4.683
  507   HG21  VAL  59          1HG2      VAL  59  -4.040   0.536  -2.606
  508   HG22  VAL  59          2HG2      VAL  59  -3.251   2.033  -2.103
  509   HG23  VAL  59          3HG2      VAL  59  -3.532   1.718  -3.817
  510    H    GLU  60           H        GLU  60  -6.696   5.334  -4.443
  511    HA   GLU  60           HA       GLU  60  -8.378   6.316  -2.216
  512    HB2  GLU  60          2HB       GLU  60  -7.161   7.970  -3.624
  513    HB3  GLU  60          3HB       GLU  60  -7.980   7.359  -5.056
  514    HG2  GLU  60          2HG       GLU  60 -10.163   8.092  -4.070
  515    HG3  GLU  60          3HG       GLU  60  -9.287   8.793  -2.710
  516    H    ARG  61           H        ARG  61 -10.628   6.290  -2.363
  517    HA   ARG  61           HA       ARG  61 -11.930   4.207  -3.784
  518    HB2  ARG  61          2HB       ARG  61 -12.738   5.108  -1.593
  519    HB3  ARG  61          3HB       ARG  61 -13.113   6.645  -2.371
  520    HG2  ARG  61          2HG       ARG  61 -15.181   5.526  -2.242
  521    HG3  ARG  61          3HG       ARG  61 -14.672   5.316  -3.914
  522    HD2  ARG  61          2HD       ARG  61 -15.420   3.183  -3.334
  523    HD3  ARG  61          3HD       ARG  61 -13.681   3.035  -3.064
  524    HE   ARG  61           HE       ARG  61 -14.806   3.872  -0.671
  525   HH11  ARG  61          1HH1      ARG  61 -15.024   0.987  -2.699
  526   HH12  ARG  61          2HH1      ARG  61 -15.381  -0.050  -1.353
  527   HH21  ARG  61          1HH2      ARG  61 -15.242   2.495   1.045
  528   HH22  ARG  61          2HH2      ARG  61 -15.502   0.803   0.762
  529    H    GLN  62           H        GLN  62 -11.929   4.359  -5.965
  530    HA   GLN  62           HA       GLN  62 -12.736   6.795  -7.380
  531    HB2  GLN  62          2HB       GLN  62 -10.824   5.367  -8.202
  532    HB3  GLN  62          3HB       GLN  62 -11.959   4.055  -8.492
  533    HG2  GLN  62          2HG       GLN  62 -11.434   5.236 -10.571
  534    HG3  GLN  62          3HG       GLN  62 -13.138   5.433 -10.155
  535   HE21  GLN  62          1HE2      GLN  62 -13.342   7.322 -11.395
  536   HE22  GLN  62          2HE2      GLN  62 -12.625   8.823 -10.925
  537    H    GLY  63           H        GLY  63 -14.891   6.945  -6.658
  538    HA2  GLY  63          2HA       GLY  63 -17.161   6.616  -6.728
  539    HA3  GLY  63          3HA       GLY  63 -16.905   5.456  -8.028
  540    H    ASN  64           H        ASN  64 -16.912   3.305  -7.559
  541    HA   ASN  64           HA       ASN  64 -17.568   2.423  -4.811
  542    HB2  ASN  64          2HB       ASN  64 -17.896   1.004  -7.505
  543    HB3  ASN  64          3HB       ASN  64 -18.387   0.348  -5.943
  544   HD21  ASN  64          1HD2      ASN  64 -19.836   1.229  -8.484
  545   HD22  ASN  64          2HD2      ASN  64 -21.133   2.203  -7.891
  546    H    THR  65           H        THR  65 -15.271   2.074  -7.433
  547    HA   THR  65           HA       THR  65 -13.920  -0.255  -6.318
  548    HB   THR  65           HB       THR  65 -12.450  -0.036  -8.348
  549    HG1  THR  65           HG1      THR  65 -14.159   2.188  -8.911
  550   HG21  THR  65          1HG2      THR  65 -15.433   0.007  -8.942
  551   HG22  THR  65          2HG2      THR  65 -14.493  -1.414  -8.478
  552   HG23  THR  65          3HG2      THR  65 -14.178  -0.613 -10.019
  553    H    TRP  66           H        TRP  66 -11.421  -0.133  -6.443
  554    HA   TRP  66           HA       TRP  66 -10.381   2.280  -5.061
  555    HB2  TRP  66          2HB       TRP  66  -9.557  -0.663  -4.865
  556    HB3  TRP  66          3HB       TRP  66  -8.653   0.657  -4.131
  557    HD1  TRP  66           HD1      TRP  66 -11.475  -1.680  -3.371
  558    HE1  TRP  66           HE1      TRP  66 -12.620  -0.986  -1.154
  559    HE3  TRP  66           HE3      TRP  66  -9.347   2.937  -2.746
  560    HZ2  TRP  66           HZ2      TRP  66 -12.616   1.218   0.585
  561    HZ3  TRP  66           HZ3      TRP  66  -9.976   4.275  -0.777
  562    HH2  TRP  66           HH2      TRP  66 -11.582   3.426   0.853
  563    H    THR  67           H        THR  67  -8.515   3.225  -5.864
  564    HA   THR  67           HA       THR  67  -7.173   2.042  -8.219
  565    HB   THR  67           HB       THR  67  -8.773   3.706  -9.113
  566    HG1  THR  67           HG1      THR  67  -6.625   3.478 -10.036
  567   HG21  THR  67          1HG2      THR  67  -8.975   5.225  -7.151
  568   HG22  THR  67          2HG2      THR  67  -8.580   6.115  -8.620
  569   HG23  THR  67          3HG2      THR  67  -7.325   5.795  -7.420
  570    H    VAL  68           H        VAL  68  -4.981   2.105  -8.056
  571    HA   VAL  68           HA       VAL  68  -3.676   3.406  -5.841
  572    HB   VAL  68           HB       VAL  68  -2.447   2.033  -8.286
  573   HG11  VAL  68          1HG1      VAL  68  -1.082   2.929  -5.710
  574   HG12  VAL  68          2HG1      VAL  68  -0.841   3.634  -7.311
  575   HG13  VAL  68          3HG1      VAL  68  -0.331   1.975  -6.991
  576   HG21  VAL  68          1HG2      VAL  68  -2.874   1.012  -5.451
  577   HG22  VAL  68          2HG2      VAL  68  -2.050   0.137  -6.746
  578   HG23  VAL  68          3HG2      VAL  68  -3.771   0.502  -6.885
  579    H    LYS  69           H        LYS  69  -3.694   5.537  -5.851
  580    HA   LYS  69           HA       LYS  69  -3.586   7.353  -8.002
  581    HB2  LYS  69          2HB       LYS  69  -2.729   7.727  -5.084
  582    HB3  LYS  69          3HB       LYS  69  -3.002   9.041  -6.222
  583    HG2  LYS  69          2HG       LYS  69  -5.134   7.071  -5.367
  584    HG3  LYS  69          3HG       LYS  69  -4.868   8.622  -4.582
  585    HD2  LYS  69          2HD       LYS  69  -5.545   8.359  -7.539
  586    HD3  LYS  69          3HD       LYS  69  -6.767   8.532  -6.279
  587    HE2  LYS  69          2HE       LYS  69  -6.431  10.720  -7.148
  588    HE3  LYS  69          3HE       LYS  69  -5.594  10.700  -5.600
  589    HZ1  LYS  69          1HZ       LYS  69  -3.504  10.398  -6.797
  590    HZ2  LYS  69          2HZ       LYS  69  -4.295  11.793  -7.314
  591    HZ3  LYS  69          3HZ       LYS  69  -4.325  10.410  -8.275
  592    H    ARG  70           H        ARG  70  -1.084   6.284  -5.716
  593    HA   ARG  70           HA       ARG  70   0.991   6.023  -7.594
  594    HB2  ARG  70          2HB       ARG  70   0.918   8.520  -7.653
  595    HB3  ARG  70          3HB       ARG  70   1.139   8.575  -5.911
  596    HG2  ARG  70          2HG       ARG  70   3.233   9.120  -7.039
  597    HG3  ARG  70          3HG       ARG  70   3.401   7.591  -6.173
  598    HD2  ARG  70          2HD       ARG  70   2.999   6.385  -8.347
  599    HD3  ARG  70          3HD       ARG  70   2.987   7.950  -9.165
  600    HE   ARG  70           HE       ARG  70   5.368   7.447  -7.603
  601   HH11  ARG  70          1HH1      ARG  70   3.884   6.965 -10.760
  602   HH12  ARG  70          2HH1      ARG  70   5.403   6.794 -11.581
  603   HH21  ARG  70          1HH2      ARG  70   7.360   7.263  -8.689
  604   HH22  ARG  70          2HH2      ARG  70   7.385   6.963 -10.399
  605    H    ILE  71           H        ILE  71   2.671   4.910  -6.694
  606    HA   ILE  71           HA       ILE  71   2.718   4.321  -3.831
  607    HB   ILE  71           HB       ILE  71   4.572   3.387  -6.079
  608   HG12  ILE  71          2HG1      ILE  71   2.161   2.043  -4.781
  609   HG13  ILE  71          3HG1      ILE  71   2.313   2.543  -6.460
  610   HG21  ILE  71          1HG2      ILE  71   5.346   1.666  -4.475
  611   HG22  ILE  71          2HG2      ILE  71   4.337   2.383  -3.220
  612   HG23  ILE  71          3HG2      ILE  71   5.688   3.299  -3.888
  613   HD11  ILE  71          1HD1      ILE  71   4.091   0.848  -6.750
  614   HD12  ILE  71          2HD1      ILE  71   2.518   0.193  -6.310
  615   HD13  ILE  71          3HD1      ILE  71   3.786   0.304  -5.094
  616    H    THR  72           H        THR  72   3.598   5.900  -2.613
  617    HA   THR  72           HA       THR  72   5.782   7.593  -3.557
  618    HB   THR  72           HB       THR  72   4.280   7.669  -0.884
  619    HG1  THR  72           HG1      THR  72   2.754   8.606  -1.964
  620   HG21  THR  72          1HG2      THR  72   6.009   9.783  -2.239
  621   HG22  THR  72          2HG2      THR  72   6.490   8.822  -0.837
  622   HG23  THR  72          3HG2      THR  72   5.152   9.963  -0.709
  623    H    ARG  73           H        ARG  73   7.670   6.493  -3.466
  624    HA   ARG  73           HA       ARG  73   8.546   4.767  -1.366
  625    HB2  ARG  73          2HB       ARG  73   9.572   4.747  -3.612
  626    HB3  ARG  73          3HB       ARG  73  10.097   6.416  -3.413
  627    HG2  ARG  73          2HG       ARG  73  11.596   5.707  -1.561
  628    HG3  ARG  73          3HG       ARG  73  11.085   4.033  -1.805
  629    HD2  ARG  73          2HD       ARG  73  12.012   4.074  -4.083
  630    HD3  ARG  73          3HD       ARG  73  12.484   5.762  -3.872
  631    HE   ARG  73           HE       ARG  73  13.567   3.782  -2.008
  632   HH11  ARG  73          1HH1      ARG  73  14.169   5.859  -4.779
  633   HH12  ARG  73          2HH1      ARG  73  15.894   5.738  -4.641
  634   HH21  ARG  73          1HH2      ARG  73  15.794   3.643  -1.814
  635   HH22  ARG  73          2HH2      ARG  73  16.821   4.470  -2.940
  636    H    THR  74           H        THR  74   9.332   5.353   0.631
  637    HA   THR  74           HA       THR  74   9.087   7.960   1.635
  638    HB   THR  74           HB       THR  74   8.984   5.951   3.083
  639    HG1  THR  74           HG1      THR  74  10.705   6.951   4.652
  640   HG21  THR  74          1HG2      THR  74  12.016   5.800   2.774
  641   HG22  THR  74          2HG2      THR  74  10.857   4.615   2.166
  642   HG23  THR  74          3HG2      THR  74  11.038   4.853   3.901
  643    H    VAL  75           H        VAL  75  10.436   9.682   1.659
  644    HA   VAL  75           HA       VAL  75  12.974   9.612   0.321
  645    HB   VAL  75           HB       VAL  75  11.645  11.621   0.079
  646   HG11  VAL  75          1HG1      VAL  75  11.159  13.205   1.896
  647   HG12  VAL  75          2HG1      VAL  75  11.853  12.087   3.071
  648   HG13  VAL  75          3HG1      VAL  75  10.396  11.637   2.185
  649   HG21  VAL  75          1HG2      VAL  75  14.145  12.254   1.695
  650   HG22  VAL  75          2HG2      VAL  75  13.315  13.363   0.602
  651   HG23  VAL  75          3HG2      VAL  75  14.086  11.912  -0.037
  652    H    GLY  76           H        GLY  76  14.458   8.413   1.313
  653    HA2  GLY  76          2HA       GLY  76  15.602   9.368   3.878
  654    HA3  GLY  76          3HA       GLY  76  15.217   7.661   3.707
  655    H    SER  77           H        SER  77  16.076   8.779   0.732
  656    HA   SER  77           HA       SER  77  18.967   8.225   1.012
  657    HB2  SER  77          2HB       SER  77  17.850   6.205   0.099
  658    HB3  SER  77          3HB       SER  77  17.081   7.169  -1.162
  659    HG   SER  77           HG       SER  77  19.631   6.172  -0.998
  660    H    LEU  78           H        LEU  78  20.223   9.707  -0.057
  661    HA   LEU  78           HA       LEU  78  18.989  12.014  -1.281
  662    HB2  LEU  78          2HB       LEU  78  21.941  11.306  -1.019
  663    HB3  LEU  78          3HB       LEU  78  21.318  12.842  -1.593
  664    HG   LEU  78           HG       LEU  78  21.976  13.266   0.637
  665   HD11  LEU  78          1HD1      LEU  78  18.992  12.772   0.813
  666   HD12  LEU  78          2HD1      LEU  78  19.773  14.206   0.145
  667   HD13  LEU  78          3HD1      LEU  78  19.948  13.830   1.856
  668   HD21  LEU  78          1HD2      LEU  78  22.319  10.976   1.415
  669   HD22  LEU  78          2HD2      LEU  78  20.578  10.731   1.552
  670   HD23  LEU  78          3HD2      LEU  78  21.390  11.897   2.599
  671    H    GLU  79           H        GLU  79  18.141  11.702  -3.208
  672    HA   GLU  79           HA       GLU  79  18.985   9.757  -5.100
  673    HB2  GLU  79          2HB       GLU  79  17.043  12.077  -5.427
  674    HB3  GLU  79          3HB       GLU  79  17.219  10.723  -6.544
  675    HG2  GLU  79          2HG       GLU  79  16.520   9.157  -4.756
  676    HG3  GLU  79          3HG       GLU  79  16.332  10.518  -3.649
  677    H    HIS  80           H        HIS  80  21.061  10.126  -5.564
  678    HA   HIS  80           HA       HIS  80  22.423  12.415  -6.309
  679    HB2  HIS  80          2HB       HIS  80  23.999  10.728  -7.489
  680    HB3  HIS  80          3HB       HIS  80  23.729  10.508  -5.767
  681    HD1  HIS  80           HD1      HIS  80  22.118   8.492  -5.085
  682    HD2  HIS  80           HD2      HIS  80  23.336   8.526  -9.063
  683    HE1  HIS  80           HE1      HIS  80  21.662   6.184  -5.955
  684    HE2  HIS  80           HE2      HIS  80  22.304   6.267  -8.379
  685    H    HIS  81           H        HIS  81  22.032  13.770  -7.906
  686    HA   HIS  81           HA       HIS  81  21.021  12.814 -10.516
  687    HB2  HIS  81          2HB       HIS  81  19.539  14.781 -10.635
  688    HB3  HIS  81          3HB       HIS  81  19.152  13.789  -9.236
  689    HD1  HIS  81           HD1      HIS  81  19.860  17.213 -10.198
  690    HD2  HIS  81           HD2      HIS  81  20.177  14.966  -6.723
  691    HE1  HIS  81           HE1      HIS  81  20.010  18.881  -8.328
  692    HE2  HIS  81           HE2      HIS  81  20.408  17.497  -6.266
  693    H    HIS  82           H        HIS  82  21.964  13.723 -12.294
  694    HA   HIS  82           HA       HIS  82  23.901  15.912 -12.015
  695    HB2  HIS  82          2HB       HIS  82  25.797  14.640 -12.849
  696    HB3  HIS  82          3HB       HIS  82  25.130  13.740 -11.489
  697    HD1  HIS  82           HD1      HIS  82  26.034  13.389 -15.017
  698    HD2  HIS  82           HD2      HIS  82  23.562  11.395 -12.337
  699    HE1  HIS  82           HE1      HIS  82  25.509  11.186 -16.097
  700    HE2  HIS  82           HE2      HIS  82  24.003  10.003 -14.471
  701    H    HIS  83           H        HIS  83  24.712  16.664 -14.074
  702    HA   HIS  83           HA       HIS  83  22.952  16.169 -16.398
  703    HB2  HIS  83          2HB       HIS  83  25.022  18.386 -15.987
  704    HB3  HIS  83          3HB       HIS  83  23.862  18.277 -17.309
  705    HD1  HIS  83           HD1      HIS  83  21.501  19.131 -16.870
  706    HD2  HIS  83           HD2      HIS  83  23.917  19.208 -13.492
  707    HE1  HIS  83           HE1      HIS  83  20.250  20.491 -15.178
  708    HE2  HIS  83           HE2      HIS  83  21.624  20.316 -13.083
  709    H    HIS  84           H        HIS  84  24.257  16.291 -18.565
  710    HA   HIS  84           HA       HIS  84  26.497  14.409 -18.403
  711    HB2  HIS  84          2HB       HIS  84  24.925  15.471 -20.786
  712    HB3  HIS  84          3HB       HIS  84  26.311  14.392 -20.936
  713    HD1  HIS  84           HD1      HIS  84  23.050  13.908 -21.461
  714    HD2  HIS  84           HD2      HIS  84  25.520  12.247 -18.564
  715    HE1  HIS  84           HE1      HIS  84  21.946  11.763 -20.782
  716    HE2  HIS  84           HE2      HIS  84  23.555  10.694 -19.187
  717    H    HIS  85           H        HIS  85  26.569  16.852 -20.988
  718    HA   HIS  85           HA       HIS  85  28.303  18.712 -19.624
  719    HB2  HIS  85          2HB       HIS  85  29.527  16.794 -21.662
  720    HB3  HIS  85          3HB       HIS  85  30.173  18.419 -21.479
  721    HD1  HIS  85           HD1      HIS  85  30.729  15.109 -20.297
  722    HD2  HIS  85           HD2      HIS  85  30.868  18.875 -18.546
  723    HE1  HIS  85           HE1      HIS  85  32.099  14.835 -18.215
  724    HE2  HIS  85           HE2      HIS  85  31.980  17.067 -17.074
  Start of MODEL   11
    1    H1   MET   1          1H        MET   1 -24.252  -2.909   8.114
    2    H2   MET   1          2H        MET   1 -23.059  -1.715   8.116
    3    H3   MET   1          3H        MET   1 -22.866  -3.094   9.063
    4    HA   MET   1           HA       MET   1 -22.757  -4.479   7.109
    5    HB2  MET   1          2HB       MET   1 -24.178  -3.065   5.669
    6    HB3  MET   1          3HB       MET   1 -22.946  -1.816   5.645
    7    HG2  MET   1          2HG       MET   1 -21.457  -3.261   4.356
    8    HG3  MET   1          3HG       MET   1 -22.616  -4.587   4.457
    9    HE1  MET   1          1HE       MET   1 -22.790  -3.582   0.663
   10    HE2  MET   1          2HE       MET   1 -22.561  -4.911   1.803
   11    HE3  MET   1          3HE       MET   1 -21.365  -3.618   1.692
   12    HA   PRO   2           HA       PRO   2 -18.346  -3.455   8.166
   13    HB2  PRO   2          2HB       PRO   2 -18.136  -6.244   7.015
   14    HB3  PRO   2          3HB       PRO   2 -17.382  -5.573   8.479
   15    HG2  PRO   2          2HG       PRO   2 -19.450  -7.207   8.710
   16    HG3  PRO   2          3HG       PRO   2 -19.347  -5.765   9.749
   17    HD2  PRO   2          2HD       PRO   2 -21.038  -6.208   7.295
   18    HD3  PRO   2          3HD       PRO   2 -21.455  -5.394   8.819
   19    H    SER   3           H        SER   3 -18.213  -1.917   6.557
   20    HA   SER   3           HA       SER   3 -17.329  -2.741   3.852
   21    HB2  SER   3          2HB       SER   3 -18.464  -0.608   3.069
   22    HB3  SER   3          3HB       SER   3 -19.580  -1.833   3.673
   23    HG   SER   3           HG       SER   3 -19.947  -0.662   5.454
   24    H    GLU   4           H        GLU   4 -17.395  -0.104   6.227
   25    HA   GLU   4           HA       GLU   4 -15.262   1.450   5.303
   26    HB2  GLU   4          2HB       GLU   4 -15.366   2.606   7.433
   27    HB3  GLU   4          3HB       GLU   4 -16.996   2.228   6.916
   28    HG2  GLU   4          2HG       GLU   4 -15.460   0.660   9.008
   29    HG3  GLU   4          3HG       GLU   4 -16.603   1.944   9.368
   30    H    GLU   5           H        GLU   5 -15.257  -1.287   7.575
   31    HA   GLU   5           HA       GLU   5 -12.398  -1.063   8.076
   32    HB2  GLU   5          2HB       GLU   5 -14.542  -3.009   8.974
   33    HB3  GLU   5          3HB       GLU   5 -12.841  -3.374   9.225
   34    HG2  GLU   5          2HG       GLU   5 -14.283  -0.935  10.301
   35    HG3  GLU   5          3HG       GLU   5 -13.872  -2.381  11.218
   36    H    GLU   6           H        GLU   6 -14.581  -2.959   6.052
   37    HA   GLU   6           HA       GLU   6 -12.822  -4.981   5.207
   38    HB2  GLU   6          2HB       GLU   6 -15.243  -5.145   4.875
   39    HB3  GLU   6          3HB       GLU   6 -15.227  -3.768   3.776
   40    HG2  GLU   6          2HG       GLU   6 -13.893  -5.044   2.159
   41    HG3  GLU   6          3HG       GLU   6 -13.809  -6.409   3.268
   42    H    GLU   7           H        GLU   7 -13.275  -1.662   4.136
   43    HA   GLU   7           HA       GLU   7 -11.945  -1.440   1.737
   44    HB2  GLU   7          2HB       GLU   7 -11.589   0.426   4.125
   45    HB3  GLU   7          3HB       GLU   7 -11.209   0.817   2.451
   46    HG2  GLU   7          2HG       GLU   7 -13.617   0.610   1.888
   47    HG3  GLU   7          3HG       GLU   7 -13.959   0.313   3.596
   48    H    LYS   8           H        LYS   8 -10.537  -1.400   4.983
   49    HA   LYS   8           HA       LYS   8  -7.847  -0.981   4.337
   50    HB2  LYS   8          2HB       LYS   8  -9.155  -2.325   6.755
   51    HB3  LYS   8          3HB       LYS   8  -7.418  -2.080   6.652
   52    HG2  LYS   8          2HG       LYS   8  -8.442  -0.363   8.051
   53    HG3  LYS   8          3HG       LYS   8  -7.751   0.369   6.602
   54    HD2  LYS   8          2HD       LYS   8 -10.016   0.497   5.600
   55    HD3  LYS   8          3HD       LYS   8 -10.698  -0.247   7.047
   56    HE2  LYS   8          2HE       LYS   8  -9.223   2.407   7.026
   57    HE3  LYS   8          3HE       LYS   8 -10.976   2.241   6.945
   58    HZ1  LYS   8          1HZ       LYS   8 -10.271   2.688   9.183
   59    HZ2  LYS   8          2HZ       LYS   8  -9.241   1.346   9.180
   60    HZ3  LYS   8          3HZ       LYS   8 -10.916   1.128   9.103
   61    H    ARG   9           H        ARG   9  -9.704  -3.980   4.762
   62    HA   ARG   9           HA       ARG   9  -7.564  -5.840   4.599
   63    HB2  ARG   9          2HB       ARG   9 -10.573  -6.106   4.234
   64    HB3  ARG   9          3HB       ARG   9  -9.511  -7.485   3.990
   65    HG2  ARG   9          2HG       ARG   9 -10.430  -7.592   6.230
   66    HG3  ARG   9          3HG       ARG   9  -8.703  -7.271   6.331
   67    HD2  ARG   9          2HD       ARG   9  -9.203  -4.865   6.761
   68    HD3  ARG   9          3HD       ARG   9 -10.929  -5.228   6.704
   69    HE   ARG   9           HE       ARG   9  -9.829  -6.904   8.623
   70   HH11  ARG   9          1HH1      ARG   9 -10.202  -3.414   8.197
   71   HH12  ARG   9          2HH1      ARG   9 -10.249  -3.089   9.901
   72   HH21  ARG   9          1HH2      ARG   9  -9.890  -6.463  10.837
   73   HH22  ARG   9          2HH2      ARG   9 -10.071  -4.834  11.404
   74    H    GLN  10           H        GLN  10  -9.652  -4.411   2.141
   75    HA   GLN  10           HA       GLN  10  -8.737  -5.990  -0.087
   76    HB2  GLN  10          2HB       GLN  10 -10.217  -3.322  -0.041
   77    HB3  GLN  10          3HB       GLN  10 -10.024  -4.351  -1.458
   78    HG2  GLN  10          2HG       GLN  10 -11.422  -6.081  -0.460
   79    HG3  GLN  10          3HG       GLN  10 -11.500  -5.188   1.061
   80   HE21  GLN  10          1HE2      GLN  10 -12.708  -3.261   1.152
   81   HE22  GLN  10          2HE2      GLN  10 -13.957  -2.918   0.011
   82    H    VAL  11           H        VAL  11  -7.958  -2.790   1.229
   83    HA   VAL  11           HA       VAL  11  -6.488  -1.899  -1.079
   84    HB   VAL  11           HB       VAL  11  -6.922  -0.648   1.674
   85   HG11  VAL  11          1HG1      VAL  11  -6.121   1.474   0.697
   86   HG12  VAL  11          2HG1      VAL  11  -5.692   0.626  -0.789
   87   HG13  VAL  11          3HG1      VAL  11  -4.847   0.252   0.710
   88   HG21  VAL  11          1HG2      VAL  11  -8.163  -0.003  -1.023
   89   HG22  VAL  11          2HG2      VAL  11  -8.513   0.812   0.503
   90   HG23  VAL  11          3HG2      VAL  11  -8.958  -0.881   0.285
   91    H    LYS  12           H        LYS  12  -5.608  -3.189   2.116
   92    HA   LYS  12           HA       LYS  12  -2.815  -2.763   2.013
   93    HB2  LYS  12          2HB       LYS  12  -4.385  -5.033   3.299
   94    HB3  LYS  12          3HB       LYS  12  -2.663  -4.772   3.552
   95    HG2  LYS  12          2HG       LYS  12  -3.123  -2.615   4.616
   96    HG3  LYS  12          3HG       LYS  12  -4.847  -2.808   4.313
   97    HD2  LYS  12          2HD       LYS  12  -3.130  -4.540   6.135
   98    HD3  LYS  12          3HD       LYS  12  -4.303  -3.333   6.651
   99    HE2  LYS  12          2HE       LYS  12  -5.462  -5.348   6.943
  100    HE3  LYS  12          3HE       LYS  12  -6.046  -4.808   5.371
  101    HZ1  LYS  12          1HZ       LYS  12  -4.501  -6.351   4.312
  102    HZ2  LYS  12          2HZ       LYS  12  -5.485  -7.179   5.409
  103    HZ3  LYS  12          3HZ       LYS  12  -3.890  -6.814   5.817
  104    H    GLN  13           H        GLN  13  -4.910  -5.297   0.706
  105    HA   GLN  13           HA       GLN  13  -2.876  -6.944  -0.400
  106    HB2  GLN  13          2HB       GLN  13  -5.156  -7.802  -0.020
  107    HB3  GLN  13          3HB       GLN  13  -5.809  -6.663  -1.190
  108    HG2  GLN  13          2HG       GLN  13  -4.440  -7.804  -2.964
  109    HG3  GLN  13          3HG       GLN  13  -3.967  -9.003  -1.764
  110   HE21  GLN  13          1HE2      GLN  13  -7.199  -7.566  -1.977
  111   HE22  GLN  13          2HE2      GLN  13  -7.991  -9.011  -2.486
  112    H    VAL  14           H        VAL  14  -4.982  -4.431  -1.895
  113    HA   VAL  14           HA       VAL  14  -3.967  -4.500  -4.498
  114    HB   VAL  14           HB       VAL  14  -5.104  -2.127  -2.934
  115   HG11  VAL  14          1HG1      VAL  14  -5.577  -1.029  -5.095
  116   HG12  VAL  14          2HG1      VAL  14  -4.730  -2.323  -5.945
  117   HG13  VAL  14          3HG1      VAL  14  -3.842  -1.260  -4.855
  118   HG21  VAL  14          1HG2      VAL  14  -7.231  -2.621  -4.101
  119   HG22  VAL  14          2HG2      VAL  14  -6.687  -3.995  -3.140
  120   HG23  VAL  14          3HG2      VAL  14  -6.477  -4.013  -4.890
  121    H    ALA  15           H        ALA  15  -2.805  -2.789  -1.661
  122    HA   ALA  15           HA       ALA  15  -0.838  -1.177  -2.888
  123    HB1  ALA  15          1HB       ALA  15  -1.038  -2.139  -0.016
  124    HB2  ALA  15          2HB       ALA  15  -1.795  -0.694  -0.680
  125    HB3  ALA  15          3HB       ALA  15  -0.038  -0.793  -0.600
  126    H    LYS  16           H        LYS  16  -0.631  -4.341  -1.233
  127    HA   LYS  16           HA       LYS  16   2.217  -4.500  -1.365
  128    HB2  LYS  16          2HB       LYS  16   1.992  -6.744  -0.425
  129    HB3  LYS  16          3HB       LYS  16   0.946  -5.613   0.416
  130    HG2  LYS  16          2HG       LYS  16  -0.995  -6.473  -0.792
  131    HG3  LYS  16          3HG       LYS  16   0.023  -7.609  -1.667
  132    HD2  LYS  16          2HD       LYS  16  -0.173  -7.619   1.372
  133    HD3  LYS  16          3HD       LYS  16  -1.300  -8.513   0.352
  134    HE2  LYS  16          2HE       LYS  16   1.710  -8.890   0.329
  135    HE3  LYS  16          3HE       LYS  16   0.560  -9.931   1.170
  136    HZ1  LYS  16          1HZ       LYS  16   0.714  -9.491  -1.762
  137    HZ2  LYS  16          2HZ       LYS  16  -0.495 -10.382  -0.989
  138    HZ3  LYS  16          3HZ       LYS  16   1.107 -10.903  -0.926
  139    H    GLU  17           H        GLU  17  -0.402  -5.736  -3.421
  140    HA   GLU  17           HA       GLU  17   1.091  -7.594  -4.927
  141    HB2  GLU  17          2HB       GLU  17  -1.318  -5.944  -5.820
  142    HB3  GLU  17          3HB       GLU  17  -0.678  -7.343  -6.672
  143    HG2  GLU  17          2HG       GLU  17  -1.956  -7.331  -3.937
  144    HG3  GLU  17          3HG       GLU  17  -2.651  -7.959  -5.417
  145    H    LYS  18           H        LYS  18   0.481  -4.128  -5.411
  146    HA   LYS  18           HA       LYS  18   1.828  -3.822  -7.884
  147    HB2  LYS  18          2HB       LYS  18   1.417  -1.750  -5.690
  148    HB3  LYS  18          3HB       LYS  18   1.794  -1.399  -7.372
  149    HG2  LYS  18          2HG       LYS  18  -0.736  -2.728  -6.374
  150    HG3  LYS  18          3HG       LYS  18  -0.592  -1.035  -6.805
  151    HD2  LYS  18          2HD       LYS  18  -0.039  -3.227  -8.832
  152    HD3  LYS  18          3HD       LYS  18  -1.675  -2.663  -8.509
  153    HE2  LYS  18          2HE       LYS  18  -0.878  -1.475 -10.433
  154    HE3  LYS  18          3HE       LYS  18  -0.913  -0.331  -9.092
  155    HZ1  LYS  18          1HZ       LYS  18   1.095  -0.134 -10.426
  156    HZ2  LYS  18          2HZ       LYS  18   1.502  -1.739 -10.101
  157    HZ3  LYS  18          3HZ       LYS  18   1.473  -0.601  -8.851
  158    H    LEU  19           H        LEU  19   2.881  -3.450  -4.503
  159    HA   LEU  19           HA       LEU  19   5.548  -2.659  -4.941
  160    HB2  LEU  19          2HB       LEU  19   4.279  -4.131  -2.601
  161    HB3  LEU  19          3HB       LEU  19   5.931  -3.542  -2.586
  162    HG   LEU  19           HG       LEU  19   3.396  -1.871  -2.680
  163   HD11  LEU  19          1HD1      LEU  19   5.639  -2.034  -0.643
  164   HD12  LEU  19          2HD1      LEU  19   4.020  -2.718  -0.467
  165   HD13  LEU  19          3HD1      LEU  19   4.232  -0.970  -0.550
  166   HD21  LEU  19          1HD2      LEU  19   4.862   0.121  -2.723
  167   HD22  LEU  19          2HD2      LEU  19   4.995  -0.836  -4.196
  168   HD23  LEU  19          3HD2      LEU  19   6.265  -0.921  -2.970
  169    H    LEU  20           H        LEU  20   4.089  -5.866  -4.891
  170    HA   LEU  20           HA       LEU  20   6.577  -7.324  -4.715
  171    HB2  LEU  20          2HB       LEU  20   3.708  -8.166  -5.255
  172    HB3  LEU  20          3HB       LEU  20   5.036  -9.315  -5.203
  173    HG   LEU  20           HG       LEU  20   4.289  -7.510  -2.867
  174   HD11  LEU  20          1HD1      LEU  20   3.266  -9.489  -1.824
  175   HD12  LEU  20          2HD1      LEU  20   3.552 -10.422  -3.297
  176   HD13  LEU  20          3HD1      LEU  20   2.445  -9.046  -3.321
  177   HD21  LEU  20          1HD2      LEU  20   5.754  -8.966  -1.560
  178   HD22  LEU  20          2HD2      LEU  20   6.641  -8.226  -2.888
  179   HD23  LEU  20          3HD2      LEU  20   6.133  -9.914  -2.997
  180    H    GLU  21           H        GLU  21   4.521  -6.181  -7.344
  181    HA   GLU  21           HA       GLU  21   5.838  -7.605  -9.450
  182    HB2  GLU  21          2HB       GLU  21   4.421  -4.907  -9.614
  183    HB3  GLU  21          3HB       GLU  21   4.823  -5.945 -10.974
  184    HG2  GLU  21          2HG       GLU  21   2.844  -6.581  -8.774
  185    HG3  GLU  21          3HG       GLU  21   2.446  -6.091 -10.415
  186    H    GLN  22           H        GLN  22   6.413  -4.550  -7.800
  187    HA   GLN  22           HA       GLN  22   8.633  -3.666  -9.415
  188    HB2  GLN  22          2HB       GLN  22   7.716  -2.759  -6.648
  189    HB3  GLN  22          3HB       GLN  22   8.860  -1.902  -7.677
  190    HG2  GLN  22          2HG       GLN  22   7.119  -1.423  -9.305
  191    HG3  GLN  22          3HG       GLN  22   5.969  -2.424  -8.429
  192   HE21  GLN  22          1HE2      GLN  22   6.797  -1.408  -5.779
  193   HE22  GLN  22          2HE2      GLN  22   6.145   0.186  -5.676
  194    H    SER  23           H        SER  23   8.249  -5.623  -6.524
  195    HA   SER  23           HA       SER  23  11.124  -6.165  -6.353
  196    HB2  SER  23          2HB       SER  23   9.540  -5.120  -3.954
  197    HB3  SER  23          3HB       SER  23  11.220  -5.648  -3.931
  198    HG   SER  23           HG       SER  23  11.243  -3.846  -5.744
  199    HA   PRO  24           HA       PRO  24   8.548 -10.007  -5.595
  200    HB2  PRO  24          2HB       PRO  24   9.871 -11.664  -7.311
  201    HB3  PRO  24          3HB       PRO  24   8.645 -10.514  -7.886
  202    HG2  PRO  24          2HG       PRO  24  11.635 -10.232  -7.915
  203    HG3  PRO  24          3HG       PRO  24  10.465  -9.880  -9.208
  204    HD2  PRO  24          2HD       PRO  24  11.502  -7.929  -7.594
  205    HD3  PRO  24          3HD       PRO  24   9.874  -7.822  -8.299
  206    H    ASN  25           H        ASN  25  11.941  -9.251  -5.448
  207    HA   ASN  25           HA       ASN  25  12.738 -11.593  -3.892
  208    HB2  ASN  25          2HB       ASN  25  14.274  -9.094  -4.760
  209    HB3  ASN  25          3HB       ASN  25  14.988 -10.450  -3.884
  210   HD21  ASN  25          1HD2      ASN  25  15.376 -12.383  -4.968
  211   HD22  ASN  25          2HD2      ASN  25  15.283 -12.521  -6.687
  212    H    SER  26           H        SER  26  10.790  -9.357  -2.960
  213    HA   SER  26           HA       SER  26  12.128  -8.667  -0.412
  214    HB2  SER  26          2HB       SER  26  11.764  -6.677  -1.822
  215    HB3  SER  26          3HB       SER  26  10.046  -7.063  -1.963
  216    HG   SER  26           HG       SER  26  11.305  -5.736  -0.015
  217    H    LYS  27           H        LYS  27  10.858  -8.680   1.456
  218    HA   LYS  27           HA       LYS  27   8.313 -10.189   1.359
  219    HB2  LYS  27          2HB       LYS  27  10.307 -11.061   2.743
  220    HB3  LYS  27          3HB       LYS  27  10.083  -9.669   3.785
  221    HG2  LYS  27          2HG       LYS  27   8.886 -11.214   4.999
  222    HG3  LYS  27          3HG       LYS  27   7.585 -10.639   3.966
  223    HD2  LYS  27          2HD       LYS  27   9.244 -13.109   3.323
  224    HD3  LYS  27          3HD       LYS  27   7.771 -13.171   4.282
  225    HE2  LYS  27          2HE       LYS  27   7.900 -12.148   1.426
  226    HE3  LYS  27          3HE       LYS  27   7.436 -13.786   1.880
  227    HZ1  LYS  27          1HZ       LYS  27   5.517 -12.385   1.504
  228    HZ2  LYS  27          2HZ       LYS  27   6.023 -11.311   2.706
  229    HZ3  LYS  27          3HZ       LYS  27   5.574 -12.889   3.116
  230    H    VAL  28           H        VAL  28   6.655  -8.774   1.326
  231    HA   VAL  28           HA       VAL  28   6.887  -6.111   2.542
  232    HB   VAL  28           HB       VAL  28   4.755  -7.208   0.640
  233   HG11  VAL  28          1HG1      VAL  28   3.898  -5.373   2.043
  234   HG12  VAL  28          2HG1      VAL  28   4.066  -4.849   0.367
  235   HG13  VAL  28          3HG1      VAL  28   5.263  -4.357   1.566
  236   HG21  VAL  28          1HG2      VAL  28   6.952  -7.073  -0.471
  237   HG22  VAL  28          2HG2      VAL  28   7.116  -5.389   0.032
  238   HG23  VAL  28          3HG2      VAL  28   5.852  -5.847  -1.112
  239    H    GLN  29           H        GLN  29   6.186  -5.966   4.555
  240    HA   GLN  29           HA       GLN  29   3.799  -7.408   5.552
  241    HB2  GLN  29          2HB       GLN  29   5.779  -5.623   7.061
  242    HB3  GLN  29          3HB       GLN  29   4.547  -6.657   7.774
  243    HG2  GLN  29          2HG       GLN  29   7.025  -7.580   6.289
  244    HG3  GLN  29          3HG       GLN  29   6.775  -7.636   8.032
  245   HE21  GLN  29          1HE2      GLN  29   7.376  -9.818   6.176
  246   HE22  GLN  29          2HE2      GLN  29   6.094 -10.962   6.343
  247    H    VAL  30           H        VAL  30   2.136  -6.072   6.646
  248    HA   VAL  30           HA       VAL  30   1.824  -3.361   5.580
  249    HB   VAL  30           HB       VAL  30   0.014  -4.889   7.512
  250   HG11  VAL  30          1HG1      VAL  30  -0.264  -2.433   7.635
  251   HG12  VAL  30          2HG1      VAL  30  -1.687  -3.201   6.935
  252   HG13  VAL  30          3HG1      VAL  30  -0.534  -2.372   5.890
  253   HG21  VAL  30          1HG2      VAL  30   0.184  -6.061   5.347
  254   HG22  VAL  30          2HG2      VAL  30  -0.249  -4.575   4.498
  255   HG23  VAL  30          3HG2      VAL  30  -1.420  -5.359   5.559
  256    H    ARG  31           H        ARG  31   2.831  -1.759   6.589
  257    HA   ARG  31           HA       ARG  31   3.944  -2.055   9.253
  258    HB2  ARG  31          2HB       ARG  31   5.227  -1.055   7.350
  259    HB3  ARG  31          3HB       ARG  31   4.069   0.268   7.280
  260    HG2  ARG  31          2HG       ARG  31   6.091   0.991   8.414
  261    HG3  ARG  31          3HG       ARG  31   4.745   0.971   9.553
  262    HD2  ARG  31          2HD       ARG  31   5.570  -1.276  10.368
  263    HD3  ARG  31          3HD       ARG  31   6.989  -1.070   9.332
  264    HE   ARG  31           HE       ARG  31   6.702   1.203  10.966
  265   HH11  ARG  31          1HH1      ARG  31   7.587  -2.193  11.297
  266   HH12  ARG  31          2HH1      ARG  31   8.558  -1.917  12.700
  267   HH21  ARG  31          1HH2      ARG  31   7.941   1.528  12.812
  268   HH22  ARG  31          2HH2      ARG  31   8.765   0.201  13.563
  269    H    ARG  32           H        ARG  32   1.588   0.065   7.618
  270    HA   ARG  32           HA       ARG  32  -0.140   0.269   9.883
  271    HB2  ARG  32          2HB       ARG  32   1.689   1.930  10.516
  272    HB3  ARG  32          3HB       ARG  32   1.292   2.854   9.077
  273    HG2  ARG  32          2HG       ARG  32   0.300   3.894  11.045
  274    HG3  ARG  32          3HG       ARG  32  -0.973   3.290   9.986
  275    HD2  ARG  32          2HD       ARG  32  -1.244   1.309  11.448
  276    HD3  ARG  32          3HD       ARG  32   0.038   1.913  12.504
  277    HE   ARG  32           HE       ARG  32  -1.860   3.930  12.344
  278   HH11  ARG  32          1HH1      ARG  32  -1.778   0.596  13.480
  279   HH12  ARG  32          2HH1      ARG  32  -3.001   0.842  14.680
  280   HH21  ARG  32          1HH2      ARG  32  -3.449   4.251  13.921
  281   HH22  ARG  32          2HH2      ARG  32  -3.959   2.937  14.934
  282    H    VAL  33           H        VAL  33  -2.141   1.407   9.318
  283    HA   VAL  33           HA       VAL  33  -2.485   1.991   6.420
  284    HB   VAL  33           HB       VAL  33  -4.563   0.810   8.336
  285   HG11  VAL  33          1HG1      VAL  33  -5.970   0.525   6.314
  286   HG12  VAL  33          2HG1      VAL  33  -4.752   1.366   5.355
  287   HG13  VAL  33          3HG1      VAL  33  -5.614   2.224   6.633
  288   HG21  VAL  33          1HG2      VAL  33  -4.366  -1.274   7.024
  289   HG22  VAL  33          2HG2      VAL  33  -2.824  -0.847   7.771
  290   HG23  VAL  33          3HG2      VAL  33  -3.083  -0.548   6.052
  291    H    GLN  34           H        GLN  34  -3.253   4.020   5.952
  292    HA   GLN  34           HA       GLN  34  -4.351   5.721   8.136
  293    HB2  GLN  34          2HB       GLN  34  -2.673   6.590   5.724
  294    HB3  GLN  34          3HB       GLN  34  -3.367   7.680   6.918
  295    HG2  GLN  34          2HG       GLN  34  -1.211   5.613   7.415
  296    HG3  GLN  34          3HG       GLN  34  -0.993   7.362   7.328
  297   HE21  GLN  34          1HE2      GLN  34  -0.404   5.491   9.480
  298   HE22  GLN  34          2HE2      GLN  34  -1.255   6.070  10.863
  299    H    LYS  35           H        LYS  35  -6.564   5.876   7.757
  300    HA   LYS  35           HA       LYS  35  -7.555   6.104   4.990
  301    HB2  LYS  35          2HB       LYS  35  -8.672   4.776   7.089
  302    HB3  LYS  35          3HB       LYS  35  -9.417   6.341   7.375
  303    HG2  LYS  35          2HG       LYS  35  -9.635   4.683   4.850
  304    HG3  LYS  35          3HG       LYS  35 -10.890   4.881   6.069
  305    HD2  LYS  35          2HD       LYS  35 -11.176   7.217   5.481
  306    HD3  LYS  35          3HD       LYS  35  -9.762   7.178   4.424
  307    HE2  LYS  35          2HE       LYS  35 -11.801   7.116   3.093
  308    HE3  LYS  35          3HE       LYS  35 -10.944   5.583   2.934
  309    HZ1  LYS  35          1HZ       LYS  35 -13.292   6.096   4.679
  310    HZ2  LYS  35          2HZ       LYS  35 -12.474   4.622   4.549
  311    HZ3  LYS  35          3HZ       LYS  35 -13.309   5.241   3.218
  312    H    GLN  36           H        GLN  36  -7.330   8.091   4.170
  313    HA   GLN  36           HA       GLN  36  -7.676  10.510   5.869
  314    HB2  GLN  36          2HB       GLN  36  -5.818  10.142   3.460
  315    HB3  GLN  36          3HB       GLN  36  -5.955  11.592   4.444
  316    HG2  GLN  36          2HG       GLN  36  -4.895   8.905   5.380
  317    HG3  GLN  36          3HG       GLN  36  -3.921  10.320   4.983
  318   HE21  GLN  36          1HE2      GLN  36  -4.256   8.772   7.506
  319   HE22  GLN  36          2HE2      GLN  36  -4.633   9.950   8.699
  320    H    GLY  37           H        GLY  37  -9.713  11.140   5.350
  321    HA2  GLY  37          2HA       GLY  37 -11.458  12.026   4.167
  322    HA3  GLY  37          3HA       GLY  37 -10.392  12.155   2.774
  323    H    ASN  38           H        ASN  38 -10.355  10.512   1.258
  324    HA   ASN  38           HA       ASN  38 -12.195   8.212   1.518
  325    HB2  ASN  38          2HB       ASN  38 -13.103  10.345   0.171
  326    HB3  ASN  38          3HB       ASN  38 -12.076   9.727  -1.112
  327   HD21  ASN  38          1HD2      ASN  38 -14.947   9.985  -1.071
  328   HD22  ASN  38          2HD2      ASN  38 -15.595   8.406  -1.313
  329    H    THR  39           H        THR  39  -9.148   9.137   1.232
  330    HA   THR  39           HA       THR  39  -8.265   7.101  -0.739
  331    HB   THR  39           HB       THR  39  -6.884   9.691   0.129
  332    HG1  THR  39           HG1      THR  39  -8.820   9.729  -1.354
  333   HG21  THR  39          1HG2      THR  39  -6.064   7.684  -2.016
  334   HG22  THR  39          2HG2      THR  39  -5.206   7.984  -0.498
  335   HG23  THR  39          3HG2      THR  39  -5.299   9.241  -1.733
  336    H    ILE  40           H        ILE  40  -7.444   5.369   0.331
  337    HA   ILE  40           HA       ILE  40  -6.403   5.623   3.048
  338    HB   ILE  40           HB       ILE  40  -6.776   3.136   1.321
  339   HG12  ILE  40          2HG1      ILE  40  -8.523   4.337   3.509
  340   HG13  ILE  40          3HG1      ILE  40  -8.951   4.150   1.817
  341   HG21  ILE  40          1HG2      ILE  40  -6.454   1.872   3.419
  342   HG22  ILE  40          2HG2      ILE  40  -6.150   3.377   4.286
  343   HG23  ILE  40          3HG2      ILE  40  -5.026   2.840   3.037
  344   HD11  ILE  40          1HD1      ILE  40  -8.930   1.713   2.103
  345   HD12  ILE  40          2HD1      ILE  40 -10.084   2.517   3.163
  346   HD13  ILE  40          3HD1      ILE  40  -8.557   1.925   3.817
  347    H    ARG  41           H        ARG  41  -4.401   6.376   3.128
  348    HA   ARG  41           HA       ARG  41  -2.256   5.646   1.295
  349    HB2  ARG  41          2HB       ARG  41  -2.137   7.248   3.896
  350    HB3  ARG  41          3HB       ARG  41  -0.936   7.234   2.611
  351    HG2  ARG  41          2HG       ARG  41  -2.522   8.383   1.103
  352    HG3  ARG  41          3HG       ARG  41  -3.745   8.372   2.376
  353    HD2  ARG  41          2HD       ARG  41  -2.301   9.787   3.790
  354    HD3  ARG  41          3HD       ARG  41  -1.056   9.787   2.538
  355    HE   ARG  41           HE       ARG  41  -3.008  10.834   1.138
  356   HH11  ARG  41          1HH1      ARG  41  -2.229  11.604   4.504
  357   HH12  ARG  41          2HH1      ARG  41  -2.848  13.221   4.391
  358   HH21  ARG  41          1HH2      ARG  41  -3.815  12.941   1.028
  359   HH22  ARG  41          2HH2      ARG  41  -3.748  13.977   2.416
  360    H    VAL  42           H        VAL  42  -1.929   3.403   1.650
  361    HA   VAL  42           HA       VAL  42  -1.553   2.390   4.361
  362    HB   VAL  42           HB       VAL  42  -1.094   0.856   1.757
  363   HG11  VAL  42          1HG1      VAL  42  -1.375  -1.162   3.167
  364   HG12  VAL  42          2HG1      VAL  42  -1.567  -0.145   4.597
  365   HG13  VAL  42          3HG1      VAL  42  -0.024  -0.177   3.739
  366   HG21  VAL  42          1HG2      VAL  42  -3.607   0.987   3.448
  367   HG22  VAL  42          2HG2      VAL  42  -3.339  -0.108   2.088
  368   HG23  VAL  42          3HG2      VAL  42  -3.411   1.634   1.815
  369    H    GLU  43           H        GLU  43   0.312   2.558   5.348
  370    HA   GLU  43           HA       GLU  43   2.888   2.864   3.999
  371    HB2  GLU  43          2HB       GLU  43   2.220   2.560   6.968
  372    HB3  GLU  43          3HB       GLU  43   3.766   3.078   6.300
  373    HG2  GLU  43          2HG       GLU  43   2.776   5.153   5.478
  374    HG3  GLU  43          3HG       GLU  43   1.168   4.611   5.964
  375    H    LEU  44           H        LEU  44   4.014   1.065   3.366
  376    HA   LEU  44           HA       LEU  44   3.586  -1.487   4.822
  377    HB2  LEU  44          2HB       LEU  44   4.317  -1.285   1.868
  378    HB3  LEU  44          3HB       LEU  44   3.969  -2.736   2.789
  379    HG   LEU  44           HG       LEU  44   1.575  -1.551   3.144
  380   HD11  LEU  44          1HD1      LEU  44   2.499  -0.357   0.519
  381   HD12  LEU  44          2HD1      LEU  44   2.162   0.531   2.008
  382   HD13  LEU  44          3HD1      LEU  44   0.856  -0.299   1.165
  383   HD21  LEU  44          1HD2      LEU  44   2.321  -2.962   0.573
  384   HD22  LEU  44          2HD2      LEU  44   0.689  -2.788   1.225
  385   HD23  LEU  44          3HD2      LEU  44   1.890  -3.742   2.095
  386    H    GLU  45           H        GLU  45   5.346  -2.832   5.057
  387    HA   GLU  45           HA       GLU  45   7.982  -1.500   5.076
  388    HB2  GLU  45          2HB       GLU  45   7.025  -2.169   7.265
  389    HB3  GLU  45          3HB       GLU  45   6.832  -3.824   6.705
  390    HG2  GLU  45          2HG       GLU  45   9.288  -4.053   6.546
  391    HG3  GLU  45          3HG       GLU  45   9.473  -2.389   7.102
  392    H    LEU  46           H        LEU  46   8.934  -2.034   3.210
  393    HA   LEU  46           HA       LEU  46   8.630  -4.717   2.006
  394    HB2  LEU  46          2HB       LEU  46   7.899  -2.779   0.687
  395    HB3  LEU  46          3HB       LEU  46   9.471  -2.028   0.838
  396    HG   LEU  46           HG       LEU  46   9.373  -4.727  -0.520
  397   HD11  LEU  46          1HD1      LEU  46   8.439  -2.207  -1.923
  398   HD12  LEU  46          2HD1      LEU  46   7.448  -3.618  -1.547
  399   HD13  LEU  46          3HD1      LEU  46   8.775  -3.759  -2.698
  400   HD21  LEU  46          1HD2      LEU  46  11.125  -3.745  -1.941
  401   HD22  LEU  46          2HD2      LEU  46  11.534  -3.578  -0.234
  402   HD23  LEU  46          3HD2      LEU  46  10.922  -2.189  -1.134
  403    H    ARG  47           H        ARG  47  10.255  -6.073   2.419
  404    HA   ARG  47           HA       ARG  47  12.791  -5.045   3.546
  405    HB2  ARG  47          2HB       ARG  47  11.572  -7.840   3.679
  406    HB3  ARG  47          3HB       ARG  47  13.000  -7.294   4.549
  407    HG2  ARG  47          2HG       ARG  47  11.648  -5.812   5.934
  408    HG3  ARG  47          3HG       ARG  47  10.202  -6.197   4.995
  409    HD2  ARG  47          2HD       ARG  47  10.357  -8.556   5.717
  410    HD3  ARG  47          3HD       ARG  47  11.807  -8.178   6.653
  411    HE   ARG  47           HE       ARG  47   9.732  -6.494   7.522
  412   HH11  ARG  47          1HH1      ARG  47  10.519  -9.936   7.587
  413   HH12  ARG  47          2HH1      ARG  47   9.637 -10.227   9.054
  414   HH21  ARG  47          1HH2      ARG  47   8.612  -6.893   9.458
  415   HH22  ARG  47          2HH2      ARG  47   8.557  -8.496  10.109
  416    H    THR  48           H        THR  48  14.183  -4.766   1.779
  417    HA   THR  48           HA       THR  48  14.583  -7.065  -0.060
  418    HB   THR  48           HB       THR  48  15.370  -4.146  -0.514
  419    HG1  THR  48           HG1      THR  48  13.453  -3.891  -1.334
  420   HG21  THR  48          1HG2      THR  48  16.819  -5.701  -1.780
  421   HG22  THR  48          2HG2      THR  48  15.724  -4.849  -2.872
  422   HG23  THR  48          3HG2      THR  48  15.393  -6.521  -2.420
  423    H    ASN  49           H        ASN  49  16.009  -8.260   1.145
  424    HA   ASN  49           HA       ASN  49  18.004  -9.081   1.812
  425    HB2  ASN  49          2HB       ASN  49  19.213  -6.807   0.171
  426    HB3  ASN  49          3HB       ASN  49  20.038  -8.282   0.666
  427   HD21  ASN  49          1HD2      ASN  49  19.565  -7.205  -2.017
  428   HD22  ASN  49          2HD2      ASN  49  18.739  -8.452  -2.878
  429    H    GLY  50           H        GLY  50  16.710  -7.354   3.602
  430    HA2  GLY  50          2HA       GLY  50  17.371  -6.944   5.842
  431    HA3  GLY  50          3HA       GLY  50  18.994  -6.547   5.296
  432    H    LYS  51           H        LYS  51  17.156  -4.950   3.146
  433    HA   LYS  51           HA       LYS  51  17.325  -2.394   4.538
  434    HB2  LYS  51          2HB       LYS  51  16.383  -3.074   1.712
  435    HB3  LYS  51          3HB       LYS  51  16.610  -1.445   2.343
  436    HG2  LYS  51          2HG       LYS  51  19.017  -1.791   2.536
  437    HG3  LYS  51          3HG       LYS  51  18.837  -3.488   2.078
  438    HD2  LYS  51          2HD       LYS  51  19.641  -2.125   0.176
  439    HD3  LYS  51          3HD       LYS  51  18.061  -2.837  -0.159
  440    HE2  LYS  51          2HE       LYS  51  18.154  -0.513  -0.932
  441    HE3  LYS  51          3HE       LYS  51  16.980  -0.675   0.373
  442    HZ1  LYS  51          1HZ       LYS  51  18.303   1.286   0.699
  443    HZ2  LYS  51          2HZ       LYS  51  19.741   0.407   0.585
  444    HZ3  LYS  51          3HZ       LYS  51  18.712   0.165   1.901
  445    H    LYS  52           H        LYS  52  15.615  -1.386   5.499
  446    HA   LYS  52           HA       LYS  52  12.874  -2.396   5.088
  447    HB2  LYS  52          2HB       LYS  52  13.667  -2.184   7.447
  448    HB3  LYS  52          3HB       LYS  52  13.910  -0.455   7.210
  449    HG2  LYS  52          2HG       LYS  52  11.498  -0.163   6.790
  450    HG3  LYS  52          3HG       LYS  52  11.242  -1.896   6.983
  451    HD2  LYS  52          2HD       LYS  52  12.229   0.002   9.144
  452    HD3  LYS  52          3HD       LYS  52  10.592  -0.632   9.009
  453    HE2  LYS  52          2HE       LYS  52  11.572  -2.958   9.261
  454    HE3  LYS  52          3HE       LYS  52  13.123  -2.193   9.629
  455    HZ1  LYS  52          1HZ       LYS  52  11.885  -2.780  11.633
  456    HZ2  LYS  52          2HZ       LYS  52  10.598  -1.794  11.154
  457    HZ3  LYS  52          3HZ       LYS  52  12.100  -1.109  11.529
  458    H    GLU  53           H        GLU  53  12.267  -1.493   3.240
  459    HA   GLU  53           HA       GLU  53  12.508   1.415   2.782
  460    HB2  GLU  53          2HB       GLU  53  11.687  -0.818   0.867
  461    HB3  GLU  53          3HB       GLU  53  11.945   0.874   0.445
  462    HG2  GLU  53          2HG       GLU  53  14.334   0.668   1.000
  463    HG3  GLU  53          3HG       GLU  53  14.083  -1.016   1.465
  464    H    ASN  54           H        ASN  54  10.784   2.537   3.485
  465    HA   ASN  54           HA       ASN  54   8.184   1.230   3.863
  466    HB2  ASN  54          2HB       ASN  54   9.232   3.934   4.795
  467    HB3  ASN  54          3HB       ASN  54   7.595   3.365   5.086
  468   HD21  ASN  54          1HD2      ASN  54  10.651   1.495   5.323
  469   HD22  ASN  54          2HD2      ASN  54  10.486   1.178   7.005
  470    H    TYR  55           H        TYR  55   6.788   1.314   2.233
  471    HA   TYR  55           HA       TYR  55   6.798   3.589   0.332
  472    HB2  TYR  55          2HB       TYR  55   5.765   0.731   0.055
  473    HB3  TYR  55          3HB       TYR  55   5.484   1.990  -1.140
  474    HD1  TYR  55           HD1      TYR  55   7.113   2.438  -2.816
  475    HD2  TYR  55           HD2      TYR  55   8.204   0.030   0.518
  476    HE1  TYR  55           HE1      TYR  55   9.184   1.806  -3.956
  477    HE2  TYR  55           HE2      TYR  55  10.276  -0.595  -0.625
  478    HH   TYR  55           HH       TYR  55  11.193  -0.742  -2.816
  479    H    THR  56           H        THR  56   5.218   5.019   0.730
  480    HA   THR  56           HA       THR  56   2.665   4.235   1.911
  481    HB   THR  56           HB       THR  56   3.633   6.962   0.930
  482    HG1  THR  56           HG1      THR  56   4.385   5.550   3.077
  483   HG21  THR  56          1HG2      THR  56   1.161   6.835   1.098
  484   HG22  THR  56          2HG2      THR  56   1.822   7.874   2.360
  485   HG23  THR  56          3HG2      THR  56   1.299   6.238   2.756
  486    H    VAL  57           H        VAL  57   1.572   3.065   0.426
  487    HA   VAL  57           HA       VAL  57   1.266   3.938  -2.361
  488    HB   VAL  57           HB       VAL  57   0.157   1.446  -0.965
  489   HG11  VAL  57          1HG1      VAL  57   0.406   2.083  -3.925
  490   HG12  VAL  57          2HG1      VAL  57  -1.091   2.066  -2.994
  491   HG13  VAL  57          3HG1      VAL  57  -0.192   0.570  -3.242
  492   HG21  VAL  57          1HG2      VAL  57   1.989   0.179  -2.027
  493   HG22  VAL  57          2HG2      VAL  57   2.621   1.406  -0.926
  494   HG23  VAL  57          3HG2      VAL  57   2.664   1.680  -2.669
  495    H    GLU  58           H        GLU  58  -0.127   5.576  -2.444
  496    HA   GLU  58           HA       GLU  58  -2.411   5.826  -0.646
  497    HB2  GLU  58          2HB       GLU  58  -1.442   7.675  -2.872
  498    HB3  GLU  58          3HB       GLU  58  -2.663   8.066  -1.660
  499    HG2  GLU  58          2HG       GLU  58  -0.914   7.819   0.120
  500    HG3  GLU  58          3HG       GLU  58   0.280   7.526  -1.138
  501    H    VAL  59           H        VAL  59  -3.973   4.457  -1.209
  502    HA   VAL  59           HA       VAL  59  -4.818   4.137  -4.017
  503    HB   VAL  59           HB       VAL  59  -5.553   2.402  -1.611
  504   HG11  VAL  59          1HG1      VAL  59  -6.200   0.730  -3.320
  505   HG12  VAL  59          2HG1      VAL  59  -5.832   1.900  -4.588
  506   HG13  VAL  59          3HG1      VAL  59  -7.144   2.216  -3.452
  507   HG21  VAL  59          1HG2      VAL  59  -3.347   1.909  -3.649
  508   HG22  VAL  59          2HG2      VAL  59  -3.873   0.764  -2.412
  509   HG23  VAL  59          3HG2      VAL  59  -3.117   2.287  -1.938
  510    H    GLU  60           H        GLU  60  -6.535   5.318  -4.583
  511    HA   GLU  60           HA       GLU  60  -8.361   6.478  -2.573
  512    HB2  GLU  60          2HB       GLU  60  -7.192   8.046  -4.032
  513    HB3  GLU  60          3HB       GLU  60  -7.703   7.170  -5.469
  514    HG2  GLU  60          2HG       GLU  60 -10.077   7.818  -4.950
  515    HG3  GLU  60          3HG       GLU  60  -9.477   8.785  -3.605
  516    H    ARG  61           H        ARG  61 -10.579   6.169  -2.699
  517    HA   ARG  61           HA       ARG  61 -11.639   3.887  -4.049
  518    HB2  ARG  61          2HB       ARG  61 -12.531   4.653  -1.881
  519    HB3  ARG  61          3HB       ARG  61 -13.033   6.178  -2.604
  520    HG2  ARG  61          2HG       ARG  61 -15.012   4.900  -2.444
  521    HG3  ARG  61          3HG       ARG  61 -14.546   4.787  -4.140
  522    HD2  ARG  61          2HD       ARG  61 -15.160   2.595  -3.542
  523    HD3  ARG  61          3HD       ARG  61 -13.399   2.560  -3.479
  524    HE   ARG  61           HE       ARG  61 -13.842   3.085  -0.978
  525   HH11  ARG  61          1HH1      ARG  61 -15.741   0.892  -2.967
  526   HH12  ARG  61          2HH1      ARG  61 -16.221  -0.093  -1.627
  527   HH21  ARG  61          1HH2      ARG  61 -14.502   1.834   0.757
  528   HH22  ARG  61          2HH2      ARG  61 -15.513   0.446   0.499
  529    H    GLN  62           H        GLN  62 -12.602   3.759  -5.965
  530    HA   GLN  62           HA       GLN  62 -13.783   6.128  -7.263
  531    HB2  GLN  62          2HB       GLN  62 -11.995   4.049  -8.603
  532    HB3  GLN  62          3HB       GLN  62 -13.020   5.162  -9.497
  533    HG2  GLN  62          2HG       GLN  62 -10.759   5.959  -7.646
  534    HG3  GLN  62          3HG       GLN  62 -10.692   5.951  -9.407
  535   HE21  GLN  62          1HE2      GLN  62 -10.373   8.129  -7.431
  536   HE22  GLN  62          2HE2      GLN  62 -11.481   9.358  -7.922
  537    H    GLY  63           H        GLY  63 -15.774   5.542  -6.563
  538    HA2  GLY  63          2HA       GLY  63 -17.843   4.585  -6.647
  539    HA3  GLY  63          3HA       GLY  63 -17.301   3.672  -8.044
  540    H    ASN  64           H        ASN  64 -17.135   1.521  -7.798
  541    HA   ASN  64           HA       ASN  64 -17.389   0.319  -5.129
  542    HB2  ASN  64          2HB       ASN  64 -17.431  -1.026  -7.864
  543    HB3  ASN  64          3HB       ASN  64 -17.848  -1.783  -6.322
  544   HD21  ASN  64          1HD2      ASN  64 -19.830  -1.065  -5.243
  545   HD22  ASN  64          2HD2      ASN  64 -21.088  -0.329  -6.171
  546    H    THR  65           H        THR  65 -15.001   0.837  -7.595
  547    HA   THR  65           HA       THR  65 -13.179  -1.256  -6.582
  548    HB   THR  65           HB       THR  65 -11.823  -0.627  -8.672
  549    HG1  THR  65           HG1      THR  65 -12.808   1.435  -9.030
  550   HG21  THR  65          1HG2      THR  65 -13.289  -1.834 -10.235
  551   HG22  THR  65          2HG2      THR  65 -14.652  -1.624  -9.134
  552   HG23  THR  65          3HG2      THR  65 -13.276  -2.621  -8.654
  553    H    TRP  66           H        TRP  66 -10.767  -0.536  -6.808
  554    HA   TRP  66           HA       TRP  66 -10.315   2.104  -5.525
  555    HB2  TRP  66          2HB       TRP  66  -9.024  -0.606  -4.947
  556    HB3  TRP  66          3HB       TRP  66  -8.395   0.916  -4.329
  557    HD1  TRP  66           HD1      TRP  66 -11.221  -1.596  -3.759
  558    HE1  TRP  66           HE1      TRP  66 -12.430  -1.000  -1.571
  559    HE3  TRP  66           HE3      TRP  66  -8.990   2.907  -2.784
  560    HZ2  TRP  66           HZ2      TRP  66 -12.440   1.096   0.306
  561    HZ3  TRP  66           HZ3      TRP  66  -9.662   4.152  -0.768
  562    HH2  TRP  66           HH2      TRP  66 -11.366   3.257   0.743
  563    H    THR  67           H        THR  67  -8.133   3.009  -5.962
  564    HA   THR  67           HA       THR  67  -6.635   1.843  -8.199
  565    HB   THR  67           HB       THR  67  -8.269   3.310  -9.332
  566    HG1  THR  67           HG1      THR  67  -6.346   4.946  -9.981
  567   HG21  THR  67          1HG2      THR  67  -7.095   5.591  -7.700
  568   HG22  THR  67          2HG2      THR  67  -8.725   4.937  -7.526
  569   HG23  THR  67          3HG2      THR  67  -8.255   5.758  -9.017
  570    H    VAL  68           H        VAL  68  -4.467   2.137  -7.978
  571    HA   VAL  68           HA       VAL  68  -3.391   3.622  -5.741
  572    HB   VAL  68           HB       VAL  68  -1.941   2.225  -8.038
  573   HG11  VAL  68          1HG1      VAL  68  -0.823   3.246  -5.399
  574   HG12  VAL  68          2HG1      VAL  68  -0.500   3.924  -6.996
  575   HG13  VAL  68          3HG1      VAL  68   0.067   2.302  -6.593
  576   HG21  VAL  68          1HG2      VAL  68  -2.567   1.228  -5.233
  577   HG22  VAL  68          2HG2      VAL  68  -1.564   0.387  -6.415
  578   HG23  VAL  68          3HG2      VAL  68  -3.278   0.638  -6.741
  579    H    LYS  69           H        LYS  69  -3.157   5.766  -5.818
  580    HA   LYS  69           HA       LYS  69  -3.116   7.272  -8.286
  581    HB2  LYS  69          2HB       LYS  69  -2.842   8.236  -5.409
  582    HB3  LYS  69          3HB       LYS  69  -3.146   9.246  -6.818
  583    HG2  LYS  69          2HG       LYS  69  -5.023   7.168  -5.653
  584    HG3  LYS  69          3HG       LYS  69  -5.212   8.918  -5.574
  585    HD2  LYS  69          2HD       LYS  69  -5.306   7.234  -8.106
  586    HD3  LYS  69          3HD       LYS  69  -6.701   7.908  -7.267
  587    HE2  LYS  69          2HE       LYS  69  -4.492   9.511  -8.601
  588    HE3  LYS  69          3HE       LYS  69  -6.114   9.254  -9.240
  589    HZ1  LYS  69          1HZ       LYS  69  -5.436  10.704  -6.740
  590    HZ2  LYS  69          2HZ       LYS  69  -7.003  10.434  -7.316
  591    HZ3  LYS  69          3HZ       LYS  69  -5.928  11.402  -8.197
  592    H    ARG  70           H        ARG  70  -0.873   6.595  -5.625
  593    HA   ARG  70           HA       ARG  70   1.403   6.633  -7.357
  594    HB2  ARG  70          2HB       ARG  70   1.176   9.086  -6.992
  595    HB3  ARG  70          3HB       ARG  70   1.211   8.844  -5.250
  596    HG2  ARG  70          2HG       ARG  70   3.532   7.944  -5.455
  597    HG3  ARG  70          3HG       ARG  70   3.487   8.281  -7.184
  598    HD2  ARG  70          2HD       ARG  70   3.265  10.694  -6.716
  599    HD3  ARG  70          3HD       ARG  70   3.252  10.362  -4.977
  600    HE   ARG  70           HE       ARG  70   5.566   9.268  -6.237
  601   HH11  ARG  70          1HH1      ARG  70   4.291  12.335  -5.030
  602   HH12  ARG  70          2HH1      ARG  70   5.868  13.003  -4.762
  603   HH21  ARG  70          1HH2      ARG  70   7.590  10.151  -5.869
  604   HH22  ARG  70          2HH2      ARG  70   7.742  11.758  -5.240
  605    H    ILE  71           H        ILE  71   3.057   5.483  -6.496
  606    HA   ILE  71           HA       ILE  71   2.973   4.614  -3.672
  607    HB   ILE  71           HB       ILE  71   4.597   3.500  -6.015
  608   HG12  ILE  71          2HG1      ILE  71   2.132   2.394  -4.601
  609   HG13  ILE  71          3HG1      ILE  71   2.228   2.924  -6.273
  610   HG21  ILE  71          1HG2      ILE  71   5.240   1.680  -4.465
  611   HG22  ILE  71          2HG2      ILE  71   4.373   2.493  -3.161
  612   HG23  ILE  71          3HG2      ILE  71   5.792   3.252  -3.880
  613   HD11  ILE  71          1HD1      ILE  71   2.179   0.533  -6.150
  614   HD12  ILE  71          2HD1      ILE  71   3.579   0.508  -5.079
  615   HD13  ILE  71          3HD1      ILE  71   3.753   1.051  -6.751
  616    H    THR  72           H        THR  72   4.084   6.099  -2.458
  617    HA   THR  72           HA       THR  72   6.553   7.345  -3.515
  618    HB   THR  72           HB       THR  72   4.912   8.274  -1.109
  619    HG1  THR  72           HG1      THR  72   3.683   9.430  -2.431
  620   HG21  THR  72          1HG2      THR  72   6.070  10.437  -1.500
  621   HG22  THR  72          2HG2      THR  72   6.966   9.718  -2.838
  622   HG23  THR  72          3HG2      THR  72   7.231   9.143  -1.190
  623    H    ARG  73           H        ARG  73   8.263   6.060  -2.886
  624    HA   ARG  73           HA       ARG  73   8.434   4.801  -0.276
  625    HB2  ARG  73          2HB       ARG  73   9.548   3.763  -2.214
  626    HB3  ARG  73          3HB       ARG  73  10.521   5.202  -2.464
  627    HG2  ARG  73          2HG       ARG  73  11.645   4.806  -0.285
  628    HG3  ARG  73          3HG       ARG  73  10.691   3.337  -0.065
  629    HD2  ARG  73          2HD       ARG  73  13.015   2.930  -0.902
  630    HD3  ARG  73          3HD       ARG  73  11.758   2.287  -1.962
  631    HE   ARG  73           HE       ARG  73  12.588   4.924  -2.722
  632   HH11  ARG  73          1HH1      ARG  73  13.480   1.523  -2.983
  633   HH12  ARG  73          2HH1      ARG  73  14.377   1.751  -4.452
  634   HH21  ARG  73          1HH2      ARG  73  13.741   5.200  -4.659
  635   HH22  ARG  73          2HH2      ARG  73  14.522   3.843  -5.401
  636    H    THR  74           H        THR  74   9.795   5.434   1.411
  637    HA   THR  74           HA       THR  74  10.336   8.190   1.863
  638    HB   THR  74           HB       THR  74   9.928   6.744   3.754
  639    HG1  THR  74           HG1      THR  74  11.437   8.484   4.048
  640   HG21  THR  74          1HG2      THR  74  12.450   5.182   3.076
  641   HG22  THR  74          2HG2      THR  74  10.800   4.582   2.904
  642   HG23  THR  74          3HG2      THR  74  11.439   4.950   4.508
  643    H    VAL  75           H        VAL  75  11.897   9.355   0.912
  644    HA   VAL  75           HA       VAL  75  14.201   8.076  -0.357
  645    HB   VAL  75           HB       VAL  75  13.006   9.657  -1.753
  646   HG11  VAL  75          1HG1      VAL  75  12.793  12.058  -1.269
  647   HG12  VAL  75          2HG1      VAL  75  13.544  11.818   0.309
  648   HG13  VAL  75          3HG1      VAL  75  11.978  11.083  -0.040
  649   HG21  VAL  75          1HG2      VAL  75  15.442   9.524  -2.087
  650   HG22  VAL  75          2HG2      VAL  75  15.686  10.845  -0.945
  651   HG23  VAL  75          3HG2      VAL  75  14.848  11.144  -2.469
  652    H    GLY  76           H        GLY  76  15.731   7.583   1.124
  653    HA2  GLY  76          2HA       GLY  76  16.681   9.550   3.108
  654    HA3  GLY  76          3HA       GLY  76  17.140   7.853   3.002
  655    H    SER  77           H        SER  77  17.649   7.897   0.154
  656    HA   SER  77           HA       SER  77  20.297   9.190   0.154
  657    HB2  SER  77          2HB       SER  77  20.699   7.612  -1.808
  658    HB3  SER  77          3HB       SER  77  20.385   6.813  -0.269
  659    HG   SER  77           HG       SER  77  18.992   6.637  -2.570
  660    H    LEU  78           H        LEU  78  20.330  11.159  -0.793
  661    HA   LEU  78           HA       LEU  78  18.511  11.889  -2.936
  662    HB2  LEU  78          2HB       LEU  78  19.678  14.115  -2.840
  663    HB3  LEU  78          3HB       LEU  78  18.928  13.607  -1.344
  664    HG   LEU  78           HG       LEU  78  21.275  12.915  -0.530
  665   HD11  LEU  78          1HD1      LEU  78  22.209  14.563  -2.901
  666   HD12  LEU  78          2HD1      LEU  78  22.489  12.838  -2.644
  667   HD13  LEU  78          3HD1      LEU  78  23.224  14.018  -1.561
  668   HD21  LEU  78          1HD2      LEU  78  21.892  15.194   0.147
  669   HD22  LEU  78          2HD2      LEU  78  20.156  14.930   0.297
  670   HD23  LEU  78          3HD2      LEU  78  20.790  15.863  -1.062
  671    H    GLU  79           H        GLU  79  19.687  13.248  -4.764
  672    HA   GLU  79           HA       GLU  79  21.936  11.745  -5.937
  673    HB2  GLU  79          2HB       GLU  79  20.706  11.640  -8.115
  674    HB3  GLU  79          3HB       GLU  79  19.898  10.725  -6.848
  675    HG2  GLU  79          2HG       GLU  79  18.346  12.695  -6.511
  676    HG3  GLU  79          3HG       GLU  79  19.088  13.444  -7.920
  677    H    HIS  80           H        HIS  80  22.020  13.117  -8.363
  678    HA   HIS  80           HA       HIS  80  23.255  15.575  -7.548
  679    HB2  HIS  80          2HB       HIS  80  22.703  14.569 -10.379
  680    HB3  HIS  80          3HB       HIS  80  23.788  15.882  -9.945
  681    HD1  HIS  80           HD1      HIS  80  26.111  15.248  -8.986
  682    HD2  HIS  80           HD2      HIS  80  23.735  11.988  -9.991
  683    HE1  HIS  80           HE1      HIS  80  27.647  13.267  -9.018
  684    HE2  HIS  80           HE2      HIS  80  26.150  11.300  -9.411
  685    H    HIS  81           H        HIS  81  21.790  17.147  -6.839
  686    HA   HIS  81           HA       HIS  81  19.584  17.949  -8.590
  687    HB2  HIS  81          2HB       HIS  81  19.011  19.618  -6.892
  688    HB3  HIS  81          3HB       HIS  81  19.241  18.054  -6.123
  689    HD1  HIS  81           HD1      HIS  81  21.444  17.787  -4.667
  690    HD2  HIS  81           HD2      HIS  81  20.586  21.658  -5.906
  691    HE1  HIS  81           HE1      HIS  81  22.843  19.283  -3.222
  692    HE2  HIS  81           HE2      HIS  81  22.420  21.598  -4.090
  693    H    HIS  82           H        HIS  82  19.793  19.446 -10.148
  694    HA   HIS  82           HA       HIS  82  22.428  20.385 -10.833
  695    HB2  HIS  82          2HB       HIS  82  20.782  19.527 -12.513
  696    HB3  HIS  82          3HB       HIS  82  19.767  20.931 -12.215
  697    HD1  HIS  82           HD1      HIS  82  19.929  22.169 -14.367
  698    HD2  HIS  82           HD2      HIS  82  23.662  20.933 -13.024
  699    HE1  HIS  82           HE1      HIS  82  21.583  23.177 -15.954
  700    HE2  HIS  82           HE2      HIS  82  23.832  22.578 -15.009
  701    H    HIS  83           H        HIS  83  19.525  21.800  -9.472
  702    HA   HIS  83           HA       HIS  83  20.916  24.357  -8.976
  703    HB2  HIS  83          2HB       HIS  83  18.084  24.073 -10.084
  704    HB3  HIS  83          3HB       HIS  83  18.757  25.579  -9.466
  705    HD1  HIS  83           HD1      HIS  83  20.984  26.421 -10.826
  706    HD2  HIS  83           HD2      HIS  83  18.524  23.697 -12.779
  707    HE1  HIS  83           HE1      HIS  83  21.577  26.588 -13.252
  708    HE2  HIS  83           HE2      HIS  83  19.904  25.130 -14.425
  709    H    HIS  84           H        HIS  84  19.666  25.684  -7.362
  710    HA   HIS  84           HA       HIS  84  19.016  24.018  -5.033
  711    HB2  HIS  84          2HB       HIS  84  19.658  26.997  -5.322
  712    HB3  HIS  84          3HB       HIS  84  19.269  26.225  -3.791
  713    HD1  HIS  84           HD1      HIS  84  21.706  27.317  -3.244
  714    HD2  HIS  84           HD2      HIS  84  21.684  23.991  -5.738
  715    HE1  HIS  84           HE1      HIS  84  24.047  26.420  -3.198
  716    HE2  HIS  84           HE2      HIS  84  24.022  24.453  -4.759
  717    H    HIS  85           H        HIS  85  16.992  23.990  -6.957
  718    HA   HIS  85           HA       HIS  85  14.880  25.780  -5.911
  719    HB2  HIS  85          2HB       HIS  85  15.230  24.503  -8.654
  720    HB3  HIS  85          3HB       HIS  85  13.695  25.189  -8.132
  721    HD1  HIS  85           HD1      HIS  85  13.366  27.541  -8.802
  722    HD2  HIS  85           HD2      HIS  85  17.402  26.608  -8.513
  723    HE1  HIS  85           HE1      HIS  85  14.589  29.604  -9.528
  724    HE2  HIS  85           HE2      HIS  85  16.997  28.923  -9.586
  Start of MODEL   12
    1    H1   MET   1          1H        MET   1 -21.344  -1.764  -1.688
    2    H2   MET   1          2H        MET   1 -20.658  -0.253  -1.375
    3    H3   MET   1          3H        MET   1 -21.734  -0.937  -0.269
    4    HA   MET   1           HA       MET   1 -19.115  -2.080  -0.996
    5    HB2  MET   1          2HB       MET   1 -18.346  -1.289   1.238
    6    HB3  MET   1          3HB       MET   1 -18.829   0.057   0.217
    7    HG2  MET   1          2HG       MET   1 -21.036   0.093   1.409
    8    HG3  MET   1          3HG       MET   1 -20.411  -1.133   2.511
    9    HE1  MET   1          1HE       MET   1 -21.615   1.812   3.309
   10    HE2  MET   1          2HE       MET   1 -20.501   2.215   4.615
   11    HE3  MET   1          3HE       MET   1 -21.137   0.577   4.479
   12    HA   PRO   2           HA       PRO   2 -20.754  -5.739   1.253
   13    HB2  PRO   2          2HB       PRO   2 -18.310  -6.754   2.147
   14    HB3  PRO   2          3HB       PRO   2 -18.968  -7.042   0.523
   15    HG2  PRO   2          2HG       PRO   2 -16.927  -5.020   1.391
   16    HG3  PRO   2          3HG       PRO   2 -16.939  -6.054  -0.057
   17    HD2  PRO   2          2HD       PRO   2 -17.641  -3.457  -0.193
   18    HD3  PRO   2          3HD       PRO   2 -18.468  -4.680  -1.189
   19    H    SER   3           H        SER   3 -18.019  -4.002   2.733
   20    HA   SER   3           HA       SER   3 -19.585  -2.956   4.896
   21    HB2  SER   3          2HB       SER   3 -19.033  -5.218   5.828
   22    HB3  SER   3          3HB       SER   3 -17.320  -4.908   5.562
   23    HG   SER   3           HG       SER   3 -18.422  -4.457   7.739
   24    H    GLU   4           H        GLU   4 -18.463  -1.193   5.869
   25    HA   GLU   4           HA       GLU   4 -16.725   0.147   4.056
   26    HB2  GLU   4          2HB       GLU   4 -16.926   2.060   5.523
   27    HB3  GLU   4          3HB       GLU   4 -18.489   1.283   5.400
   28    HG2  GLU   4          2HG       GLU   4 -18.518   1.651   7.656
   29    HG3  GLU   4          3HG       GLU   4 -17.650   0.117   7.687
   30    H    GLU   5           H        GLU   5 -16.227  -1.592   7.053
   31    HA   GLU   5           HA       GLU   5 -13.478  -0.839   7.479
   32    HB2  GLU   5          2HB       GLU   5 -13.513  -2.619   9.215
   33    HB3  GLU   5          3HB       GLU   5 -14.909  -1.550   9.356
   34    HG2  GLU   5          2HG       GLU   5 -16.253  -3.261   8.084
   35    HG3  GLU   5          3HG       GLU   5 -14.861  -4.334   8.163
   36    H    GLU   6           H        GLU   6 -15.190  -3.394   5.809
   37    HA   GLU   6           HA       GLU   6 -13.115  -5.259   5.406
   38    HB2  GLU   6          2HB       GLU   6 -15.557  -5.730   5.122
   39    HB3  GLU   6          3HB       GLU   6 -15.575  -4.722   3.684
   40    HG2  GLU   6          2HG       GLU   6 -15.539  -7.126   3.148
   41    HG3  GLU   6          3HG       GLU   6 -14.123  -6.289   2.516
   42    H    GLU   7           H        GLU   7 -14.128  -2.364   3.702
   43    HA   GLU   7           HA       GLU   7 -12.694  -2.481   1.345
   44    HB2  GLU   7          2HB       GLU   7 -13.241  -0.041   3.077
   45    HB3  GLU   7          3HB       GLU   7 -12.761   0.002   1.385
   46    HG2  GLU   7          2HG       GLU   7 -15.323  -1.201   2.455
   47    HG3  GLU   7          3HG       GLU   7 -15.177   0.376   1.683
   48    H    LYS   8           H        LYS   8 -11.556  -1.333   4.558
   49    HA   LYS   8           HA       LYS   8  -9.007  -0.397   3.738
   50    HB2  LYS   8          2HB       LYS   8  -9.918  -1.377   6.478
   51    HB3  LYS   8          3HB       LYS   8  -8.320  -0.708   6.180
   52    HG2  LYS   8          2HG       LYS   8  -9.527   1.065   7.100
   53    HG3  LYS   8          3HG       LYS   8  -9.513   1.410   5.370
   54    HD2  LYS   8          2HD       LYS   8 -11.809   0.661   5.141
   55    HD3  LYS   8          3HD       LYS   8 -11.827   0.049   6.799
   56    HE2  LYS   8          2HE       LYS   8 -11.543   2.381   7.627
   57    HE3  LYS   8          3HE       LYS   8 -11.610   2.958   5.960
   58    HZ1  LYS   8          1HZ       LYS   8 -13.779   1.528   7.406
   59    HZ2  LYS   8          2HZ       LYS   8 -13.833   1.995   5.781
   60    HZ3  LYS   8          3HZ       LYS   8 -13.749   3.165   6.990
   61    H    ARG   9           H        ARG   9 -10.134  -3.568   4.755
   62    HA   ARG   9           HA       ARG   9  -7.648  -4.899   5.046
   63    HB2  ARG   9          2HB       ARG   9 -10.310  -6.132   4.209
   64    HB3  ARG   9          3HB       ARG   9  -8.947  -6.978   4.943
   65    HG2  ARG   9          2HG       ARG   9  -9.267  -5.663   7.025
   66    HG3  ARG   9          3HG       ARG   9 -10.643  -4.843   6.283
   67    HD2  ARG   9          2HD       ARG   9 -11.549  -6.557   7.668
   68    HD3  ARG   9          3HD       ARG   9 -11.720  -7.125   6.007
   69    HE   ARG   9           HE       ARG   9  -9.527  -8.024   7.791
   70   HH11  ARG   9          1HH1      ARG   9 -12.072  -8.829   5.473
   71   HH12  ARG   9          2HH1      ARG   9 -11.680 -10.522   5.476
   72   HH21  ARG   9          1HH2      ARG   9  -9.082 -10.244   7.807
   73   HH22  ARG   9          2HH2      ARG   9  -9.996 -11.317   6.791
   74    H    GLN  10           H        GLN  10  -9.835  -4.398   2.332
   75    HA   GLN  10           HA       GLN  10  -8.477  -5.889   0.339
   76    HB2  GLN  10          2HB       GLN  10 -10.246  -3.427  -0.030
   77    HB3  GLN  10          3HB       GLN  10  -9.850  -4.615  -1.268
   78    HG2  GLN  10          2HG       GLN  10 -11.173  -6.303  -0.202
   79    HG3  GLN  10          3HG       GLN  10 -11.364  -5.325   1.254
   80   HE21  GLN  10          1HE2      GLN  10 -13.599  -5.281   1.193
   81   HE22  GLN  10          2HE2      GLN  10 -14.491  -4.405   0.002
   82    H    VAL  11           H        VAL  11  -8.237  -2.503   1.427
   83    HA   VAL  11           HA       VAL  11  -6.700  -1.451  -0.683
   84    HB   VAL  11           HB       VAL  11  -6.752  -0.511   2.228
   85   HG11  VAL  11          1HG1      VAL  11  -5.898   1.003  -0.264
   86   HG12  VAL  11          2HG1      VAL  11  -4.826   0.438   1.014
   87   HG13  VAL  11          3HG1      VAL  11  -6.024   1.685   1.356
   88   HG21  VAL  11          1HG2      VAL  11  -8.436   1.120   1.468
   89   HG22  VAL  11          2HG2      VAL  11  -8.982  -0.534   1.227
   90   HG23  VAL  11          3HG2      VAL  11  -8.403   0.402  -0.144
   91    H    LYS  12           H        LYS  12  -5.677  -2.853   2.434
   92    HA   LYS  12           HA       LYS  12  -2.904  -2.377   2.235
   93    HB2  LYS  12          2HB       LYS  12  -4.327  -4.656   3.674
   94    HB3  LYS  12          3HB       LYS  12  -2.658  -4.161   3.951
   95    HG2  LYS  12          2HG       LYS  12  -3.451  -1.957   4.743
   96    HG3  LYS  12          3HG       LYS  12  -5.120  -2.467   4.491
   97    HD2  LYS  12          2HD       LYS  12  -3.183  -3.836   6.400
   98    HD3  LYS  12          3HD       LYS  12  -4.320  -2.581   6.885
   99    HE2  LYS  12          2HE       LYS  12  -5.349  -4.635   7.476
  100    HE3  LYS  12          3HE       LYS  12  -6.176  -4.121   6.006
  101    HZ1  LYS  12          1HZ       LYS  12  -4.904  -5.703   4.738
  102    HZ2  LYS  12          2HZ       LYS  12  -5.594  -6.504   6.053
  103    HZ3  LYS  12          3HZ       LYS  12  -3.958  -6.105   6.085
  104    H    GLN  13           H        GLN  13  -4.961  -4.928   0.970
  105    HA   GLN  13           HA       GLN  13  -2.884  -6.642   0.012
  106    HB2  GLN  13          2HB       GLN  13  -5.135  -7.512   0.436
  107    HB3  GLN  13          3HB       GLN  13  -5.827  -6.425  -0.762
  108    HG2  GLN  13          2HG       GLN  13  -4.656  -7.612  -2.553
  109    HG3  GLN  13          3HG       GLN  13  -3.863  -8.651  -1.370
  110   HE21  GLN  13          1HE2      GLN  13  -7.260  -7.687  -1.170
  111   HE22  GLN  13          2HE2      GLN  13  -7.900  -9.260  -1.483
  112    H    VAL  14           H        VAL  14  -5.056  -4.294  -1.666
  113    HA   VAL  14           HA       VAL  14  -4.020  -4.451  -4.250
  114    HB   VAL  14           HB       VAL  14  -5.176  -1.970  -2.863
  115   HG11  VAL  14          1HG1      VAL  14  -4.907  -2.519  -5.849
  116   HG12  VAL  14          2HG1      VAL  14  -3.996  -1.321  -4.927
  117   HG13  VAL  14          3HG1      VAL  14  -5.738  -1.137  -5.130
  118   HG21  VAL  14          1HG2      VAL  14  -6.734  -3.878  -2.805
  119   HG22  VAL  14          2HG2      VAL  14  -6.590  -4.075  -4.551
  120   HG23  VAL  14          3HG2      VAL  14  -7.337  -2.620  -3.885
  121    H    ALA  15           H        ALA  15  -2.903  -2.640  -1.472
  122    HA   ALA  15           HA       ALA  15  -0.947  -1.012  -2.695
  123    HB1  ALA  15          1HB       ALA  15  -1.947  -0.531  -0.493
  124    HB2  ALA  15          2HB       ALA  15  -0.185  -0.608  -0.390
  125    HB3  ALA  15          3HB       ALA  15  -1.170  -1.960   0.185
  126    H    LYS  16           H        LYS  16  -0.713  -4.139  -0.942
  127    HA   LYS  16           HA       LYS  16   2.126  -4.298  -1.145
  128    HB2  LYS  16          2HB       LYS  16   1.982  -6.483  -0.159
  129    HB3  LYS  16          3HB       LYS  16   0.821  -5.445   0.648
  130    HG2  LYS  16          2HG       LYS  16  -1.020  -6.508  -0.429
  131    HG3  LYS  16          3HG       LYS  16   0.027  -7.361  -1.553
  132    HD2  LYS  16          2HD       LYS  16   0.006  -7.832   1.454
  133    HD3  LYS  16          3HD       LYS  16  -0.895  -8.799   0.283
  134    HE2  LYS  16          2HE       LYS  16   1.256  -9.385  -0.837
  135    HE3  LYS  16          3HE       LYS  16   2.121  -8.491   0.416
  136    HZ1  LYS  16          1HZ       LYS  16   0.345 -10.817   0.922
  137    HZ2  LYS  16          2HZ       LYS  16   1.279  -9.998   2.064
  138    HZ3  LYS  16          3HZ       LYS  16   2.035 -10.884   0.843
  139    H    GLU  17           H        GLU  17  -0.509  -5.500  -3.161
  140    HA   GLU  17           HA       GLU  17   0.912  -7.414  -4.670
  141    HB2  GLU  17          2HB       GLU  17  -1.451  -5.690  -5.553
  142    HB3  GLU  17          3HB       GLU  17  -0.865  -7.111  -6.408
  143    HG2  GLU  17          2HG       GLU  17  -2.188  -7.026  -3.691
  144    HG3  GLU  17          3HG       GLU  17  -2.840  -7.702  -5.173
  145    H    LYS  18           H        LYS  18   0.412  -3.940  -5.109
  146    HA   LYS  18           HA       LYS  18   1.788  -3.770  -7.619
  147    HB2  LYS  18          2HB       LYS  18   1.008  -1.565  -5.678
  148    HB3  LYS  18          3HB       LYS  18   1.498  -1.332  -7.354
  149    HG2  LYS  18          2HG       LYS  18  -1.002  -2.750  -6.380
  150    HG3  LYS  18          3HG       LYS  18  -0.929  -1.167  -7.150
  151    HD2  LYS  18          2HD       LYS  18  -0.166  -3.797  -8.488
  152    HD3  LYS  18          3HD       LYS  18  -1.712  -2.970  -8.686
  153    HE2  LYS  18          2HE       LYS  18   0.995  -1.837  -9.470
  154    HE3  LYS  18          3HE       LYS  18  -0.186  -2.532 -10.578
  155    HZ1  LYS  18          1HZ       LYS  18  -1.727  -0.781 -10.015
  156    HZ2  LYS  18          2HZ       LYS  18  -0.264  -0.112 -10.538
  157    HZ3  LYS  18          3HZ       LYS  18  -0.646  -0.129  -8.893
  158    H    LEU  19           H        LEU  19   2.757  -3.601  -4.259
  159    HA   LEU  19           HA       LEU  19   5.430  -2.661  -4.727
  160    HB2  LEU  19          2HB       LEU  19   4.202  -4.209  -2.416
  161    HB3  LEU  19          3HB       LEU  19   5.880  -3.686  -2.432
  162    HG   LEU  19           HG       LEU  19   3.433  -1.884  -2.448
  163   HD11  LEU  19          1HD1      LEU  19   5.584  -2.286  -0.350
  164   HD12  LEU  19          2HD1      LEU  19   3.919  -2.869  -0.264
  165   HD13  LEU  19          3HD1      LEU  19   4.243  -1.138  -0.265
  166   HD21  LEU  19          1HD2      LEU  19   5.016   0.000  -2.350
  167   HD22  LEU  19          2HD2      LEU  19   5.160  -0.895  -3.858
  168   HD23  LEU  19          3HD2      LEU  19   6.367  -1.113  -2.584
  169    H    LEU  20           H        LEU  20   3.902  -5.845  -4.665
  170    HA   LEU  20           HA       LEU  20   6.237  -7.451  -4.791
  171    HB2  LEU  20          2HB       LEU  20   3.386  -8.008  -5.699
  172    HB3  LEU  20          3HB       LEU  20   4.642  -9.235  -5.629
  173    HG   LEU  20           HG       LEU  20   3.665  -7.683  -3.202
  174   HD11  LEU  20          1HD1      LEU  20   2.869 -10.486  -4.038
  175   HD12  LEU  20          2HD1      LEU  20   1.838  -9.051  -4.085
  176   HD13  LEU  20          3HD1      LEU  20   2.414  -9.665  -2.538
  177   HD21  LEU  20          1HD2      LEU  20   5.940  -8.516  -2.952
  178   HD22  LEU  20          2HD2      LEU  20   5.421 -10.145  -3.395
  179   HD23  LEU  20          3HD2      LEU  20   4.833  -9.404  -1.904
  180    H    GLU  21           H        GLU  21   4.277  -5.850  -7.229
  181    HA   GLU  21           HA       GLU  21   5.274  -6.905  -9.614
  182    HB2  GLU  21          2HB       GLU  21   4.431  -4.038  -8.999
  183    HB3  GLU  21          3HB       GLU  21   4.631  -4.694 -10.620
  184    HG2  GLU  21          2HG       GLU  21   2.619  -5.696  -8.588
  185    HG3  GLU  21          3HG       GLU  21   2.258  -4.548  -9.874
  186    H    GLN  22           H        GLN  22   6.572  -4.375  -7.516
  187    HA   GLN  22           HA       GLN  22   8.747  -3.635  -9.285
  188    HB2  GLN  22          2HB       GLN  22   8.146  -2.829  -6.405
  189    HB3  GLN  22          3HB       GLN  22   9.377  -2.091  -7.432
  190    HG2  GLN  22          2HG       GLN  22   7.643  -1.282  -8.969
  191    HG3  GLN  22          3HG       GLN  22   6.394  -2.064  -7.996
  192   HE21  GLN  22          1HE2      GLN  22   5.910  -1.210  -5.939
  193   HE22  GLN  22          2HE2      GLN  22   6.340   0.404  -5.510
  194    H    SER  23           H        SER  23   8.460  -5.227  -6.096
  195    HA   SER  23           HA       SER  23  11.118  -6.466  -6.453
  196    HB2  SER  23          2HB       SER  23  11.332  -4.490  -4.933
  197    HB3  SER  23          3HB       SER  23  10.135  -5.205  -3.851
  198    HG   SER  23           HG       SER  23  11.810  -6.135  -2.977
  199    HA   PRO  24           HA       PRO  24   8.219  -9.874  -5.259
  200    HB2  PRO  24          2HB       PRO  24   9.032 -11.677  -7.118
  201    HB3  PRO  24          3HB       PRO  24   7.928 -10.352  -7.540
  202    HG2  PRO  24          2HG       PRO  24  10.885 -10.557  -8.015
  203    HG3  PRO  24          3HG       PRO  24   9.607  -9.972  -9.105
  204    HD2  PRO  24          2HD       PRO  24  11.221  -8.300  -7.599
  205    HD3  PRO  24          3HD       PRO  24   9.596  -7.859  -8.171
  206    H    ASN  25           H        ASN  25  11.499  -9.239  -5.050
  207    HA   ASN  25           HA       ASN  25  12.432 -11.839  -4.111
  208    HB2  ASN  25          2HB       ASN  25  13.845  -9.138  -4.243
  209    HB3  ASN  25          3HB       ASN  25  14.622 -10.677  -3.868
  210   HD21  ASN  25          1HD2      ASN  25  14.750 -12.271  -5.533
  211   HD22  ASN  25          2HD2      ASN  25  14.710 -11.812  -7.196
  212    H    SER  26           H        SER  26  10.462  -9.799  -2.676
  213    HA   SER  26           HA       SER  26  11.575 -10.056   0.032
  214    HB2  SER  26          2HB       SER  26  10.996  -7.591   0.395
  215    HB3  SER  26          3HB       SER  26  12.379  -7.885  -0.663
  216    HG   SER  26           HG       SER  26   9.874  -7.726  -1.882
  217    H    LYS  27           H        LYS  27  10.020 -10.274   1.601
  218    HA   LYS  27           HA       LYS  27   7.225 -10.530   0.777
  219    HB2  LYS  27          2HB       LYS  27   8.210 -12.260   2.267
  220    HB3  LYS  27          3HB       LYS  27   8.525 -11.035   3.488
  221    HG2  LYS  27          2HG       LYS  27   6.074 -10.634   3.705
  222    HG3  LYS  27          3HG       LYS  27   5.772 -11.897   2.511
  223    HD2  LYS  27          2HD       LYS  27   7.086 -12.285   5.230
  224    HD3  LYS  27          3HD       LYS  27   5.423 -12.711   4.824
  225    HE2  LYS  27          2HE       LYS  27   7.934 -13.961   3.648
  226    HE3  LYS  27          3HE       LYS  27   6.840 -14.708   4.812
  227    HZ1  LYS  27          1HZ       LYS  27   6.186 -13.958   2.016
  228    HZ2  LYS  27          2HZ       LYS  27   5.082 -14.572   3.127
  229    HZ3  LYS  27          3HZ       LYS  27   6.376 -15.527   2.624
  230    H    VAL  28           H        VAL  28   5.608  -9.126   1.427
  231    HA   VAL  28           HA       VAL  28   6.523  -6.485   2.346
  232    HB   VAL  28           HB       VAL  28   3.883  -7.219   0.991
  233   HG11  VAL  28          1HG1      VAL  28   3.690  -4.786   0.589
  234   HG12  VAL  28          2HG1      VAL  28   5.191  -4.518   1.478
  235   HG13  VAL  28          3HG1      VAL  28   3.772  -5.150   2.315
  236   HG21  VAL  28          1HG2      VAL  28   5.776  -7.692  -0.523
  237   HG22  VAL  28          2HG2      VAL  28   6.396  -6.057  -0.275
  238   HG23  VAL  28          3HG2      VAL  28   4.848  -6.300  -1.090
  239    H    GLN  29           H        GLN  29   6.207  -6.056   4.398
  240    HA   GLN  29           HA       GLN  29   4.098  -7.249   6.046
  241    HB2  GLN  29          2HB       GLN  29   6.373  -7.159   6.965
  242    HB3  GLN  29          3HB       GLN  29   6.490  -5.433   6.635
  243    HG2  GLN  29          2HG       GLN  29   6.166  -5.850   9.026
  244    HG3  GLN  29          3HG       GLN  29   4.793  -4.972   8.351
  245   HE21  GLN  29          1HE2      GLN  29   3.361  -5.618   9.969
  246   HE22  GLN  29          2HE2      GLN  29   2.795  -7.245  10.125
  247    H    VAL  30           H        VAL  30   2.405  -5.971   6.963
  248    HA   VAL  30           HA       VAL  30   1.953  -3.281   5.885
  249    HB   VAL  30           HB       VAL  30   0.261  -4.901   7.851
  250   HG11  VAL  30          1HG1      VAL  30  -0.443  -2.348   6.349
  251   HG12  VAL  30          2HG1      VAL  30  -0.130  -2.477   8.082
  252   HG13  VAL  30          3HG1      VAL  30  -1.539  -3.275   7.380
  253   HG21  VAL  30          1HG2      VAL  30  -0.135  -4.513   4.859
  254   HG22  VAL  30          2HG2      VAL  30  -1.240  -5.358   5.946
  255   HG23  VAL  30          3HG2      VAL  30   0.374  -6.007   5.653
  256    H    ARG  31           H        ARG  31   2.699  -1.516   6.925
  257    HA   ARG  31           HA       ARG  31   3.790  -1.777   9.644
  258    HB2  ARG  31          2HB       ARG  31   5.245  -0.846   7.813
  259    HB3  ARG  31          3HB       ARG  31   4.144   0.521   7.669
  260    HG2  ARG  31          2HG       ARG  31   6.080   1.172   8.994
  261    HG3  ARG  31          3HG       ARG  31   4.649   1.152  10.030
  262    HD2  ARG  31          2HD       ARG  31   5.353  -1.169  10.788
  263    HD3  ARG  31          3HD       ARG  31   6.858  -0.935   9.892
  264    HE   ARG  31           HE       ARG  31   6.169   1.092  11.867
  265   HH11  ARG  31          1HH1      ARG  31   8.058  -1.816  11.198
  266   HH12  ARG  31          2HH1      ARG  31   9.138  -1.550  12.531
  267   HH21  ARG  31          1HH2      ARG  31   7.579   1.419  13.574
  268   HH22  ARG  31          2HH2      ARG  31   8.864   0.291  13.882
  269    H    ARG  32           H        ARG  32   1.880   0.660   7.810
  270    HA   ARG  32           HA       ARG  32   0.025   1.070  10.032
  271    HB2  ARG  32          2HB       ARG  32   1.831   3.277   8.945
  272    HB3  ARG  32          3HB       ARG  32   0.320   3.634   9.777
  273    HG2  ARG  32          2HG       ARG  32   1.156   2.569  11.817
  274    HG3  ARG  32          3HG       ARG  32   2.646   2.114  10.991
  275    HD2  ARG  32          2HD       ARG  32   3.249   4.470  10.728
  276    HD3  ARG  32          3HD       ARG  32   1.725   4.970  11.466
  277    HE   ARG  32           HE       ARG  32   3.747   3.376  12.934
  278   HH11  ARG  32          1HH1      ARG  32   1.638   6.185  12.762
  279   HH12  ARG  32          2HH1      ARG  32   1.976   6.685  14.389
  280   HH21  ARG  32          1HH2      ARG  32   4.161   4.031  15.073
  281   HH22  ARG  32          2HH2      ARG  32   3.406   5.462  15.698
  282    H    VAL  33           H        VAL  33  -1.769   2.540   9.385
  283    HA   VAL  33           HA       VAL  33  -2.309   2.714   6.487
  284    HB   VAL  33           HB       VAL  33  -4.292   1.581   8.537
  285   HG11  VAL  33          1HG1      VAL  33  -4.646   2.006   5.550
  286   HG12  VAL  33          2HG1      VAL  33  -5.436   2.925   6.833
  287   HG13  VAL  33          3HG1      VAL  33  -5.807   1.214   6.621
  288   HG21  VAL  33          1HG2      VAL  33  -2.919   0.146   6.234
  289   HG22  VAL  33          2HG2      VAL  33  -4.158  -0.544   7.286
  290   HG23  VAL  33          3HG2      VAL  33  -2.586  -0.096   7.950
  291    H    GLN  34           H        GLN  34  -3.297   4.644   5.949
  292    HA   GLN  34           HA       GLN  34  -4.258   6.471   8.081
  293    HB2  GLN  34          2HB       GLN  34  -2.714   7.354   5.587
  294    HB3  GLN  34          3HB       GLN  34  -3.194   8.358   6.952
  295    HG2  GLN  34          2HG       GLN  34  -1.111   6.165   6.954
  296    HG3  GLN  34          3HG       GLN  34  -0.812   7.898   7.039
  297   HE21  GLN  34          1HE2      GLN  34  -0.142   5.615   8.860
  298   HE22  GLN  34          2HE2      GLN  34  -0.722   6.101  10.415
  299    H    LYS  35           H        LYS  35  -6.403   6.635   7.716
  300    HA   LYS  35           HA       LYS  35  -7.520   6.336   5.013
  301    HB2  LYS  35          2HB       LYS  35  -8.328   5.052   7.115
  302    HB3  LYS  35          3HB       LYS  35  -9.028   6.565   7.664
  303    HG2  LYS  35          2HG       LYS  35  -9.785   5.210   5.053
  304    HG3  LYS  35          3HG       LYS  35 -10.624   4.931   6.577
  305    HD2  LYS  35          2HD       LYS  35 -11.155   7.390   6.660
  306    HD3  LYS  35          3HD       LYS  35 -10.440   7.559   5.054
  307    HE2  LYS  35          2HE       LYS  35 -12.127   6.050   4.125
  308    HE3  LYS  35          3HE       LYS  35 -12.814   5.786   5.731
  309    HZ1  LYS  35          1HZ       LYS  35 -12.705   8.397   4.320
  310    HZ2  LYS  35          2HZ       LYS  35 -13.397   8.123   5.834
  311    HZ3  LYS  35          3HZ       LYS  35 -14.068   7.416   4.454
  312    H    GLN  36           H        GLN  36  -7.482   8.247   3.916
  313    HA   GLN  36           HA       GLN  36  -8.420  10.737   5.242
  314    HB2  GLN  36          2HB       GLN  36  -6.342  10.456   3.020
  315    HB3  GLN  36          3HB       GLN  36  -6.948  11.989   3.639
  316    HG2  GLN  36          2HG       GLN  36  -5.397   9.932   5.243
  317    HG3  GLN  36          3HG       GLN  36  -4.729  11.419   4.569
  318   HE21  GLN  36          1HE2      GLN  36  -4.971  10.465   7.381
  319   HE22  GLN  36          2HE2      GLN  36  -5.785  11.733   8.223
  320    H    GLY  37           H        GLY  37 -10.559  10.395   4.670
  321    HA2  GLY  37          2HA       GLY  37 -12.447  10.688   3.422
  322    HA3  GLY  37          3HA       GLY  37 -11.436  11.399   2.173
  323    H    ASN  38           H        ASN  38 -10.918  10.204   0.399
  324    HA   ASN  38           HA       ASN  38 -11.928   7.424   0.167
  325    HB2  ASN  38          2HB       ASN  38 -11.289   9.486  -1.996
  326    HB3  ASN  38          3HB       ASN  38 -11.764   7.818  -2.320
  327   HD21  ASN  38          1HD2      ASN  38 -13.920   7.201  -1.977
  328   HD22  ASN  38          2HD2      ASN  38 -15.184   8.349  -1.741
  329    H    THR  39           H        THR  39  -9.063   9.401   0.130
  330    HA   THR  39           HA       THR  39  -7.365   7.379  -1.118
  331    HB   THR  39           HB       THR  39  -6.555  10.064   0.088
  332    HG1  THR  39           HG1      THR  39  -7.792   9.434  -2.293
  333   HG21  THR  39          1HG2      THR  39  -4.552   9.837  -1.354
  334   HG22  THR  39          2HG2      THR  39  -5.105   8.246  -1.882
  335   HG23  THR  39          3HG2      THR  39  -4.648   8.507  -0.195
  336    H    ILE  40           H        ILE  40  -7.277   5.676   0.327
  337    HA   ILE  40           HA       ILE  40  -6.254   6.089   3.030
  338    HB   ILE  40           HB       ILE  40  -6.905   3.506   1.546
  339   HG12  ILE  40          2HG1      ILE  40  -8.482   5.090   3.626
  340   HG13  ILE  40          3HG1      ILE  40  -8.940   4.806   1.953
  341   HG21  ILE  40          1HG2      ILE  40  -6.718   2.399   3.751
  342   HG22  ILE  40          2HG2      ILE  40  -6.206   3.924   4.475
  343   HG23  ILE  40          3HG2      ILE  40  -5.186   3.135   3.270
  344   HD11  ILE  40          1HD1      ILE  40  -8.778   2.716   4.125
  345   HD12  ILE  40          2HD1      ILE  40  -9.220   2.424   2.441
  346   HD13  ILE  40          3HD1      ILE  40 -10.239   3.439   3.457
  347    H    ARG  41           H        ARG  41  -4.168   6.619   3.098
  348    HA   ARG  41           HA       ARG  41  -2.096   5.536   1.373
  349    HB2  ARG  41          2HB       ARG  41  -2.010   7.383   3.799
  350    HB3  ARG  41          3HB       ARG  41  -0.580   6.895   2.897
  351    HG2  ARG  41          2HG       ARG  41  -1.505   7.996   0.877
  352    HG3  ARG  41          3HG       ARG  41  -2.894   8.538   1.824
  353    HD2  ARG  41          2HD       ARG  41  -1.553   9.973   3.169
  354    HD3  ARG  41          3HD       ARG  41  -0.051   9.202   2.648
  355    HE   ARG  41           HE       ARG  41  -1.085  10.223   0.345
  356   HH11  ARG  41          1HH1      ARG  41  -0.323  11.684   3.464
  357   HH12  ARG  41          2HH1      ARG  41   0.054  13.229   2.772
  358   HH21  ARG  41          1HH2      ARG  41  -0.502  12.201  -0.545
  359   HH22  ARG  41          2HH2      ARG  41  -0.047  13.525   0.489
  360    H    VAL  42           H        VAL  42  -1.677   3.383   1.809
  361    HA   VAL  42           HA       VAL  42  -1.357   2.494   4.601
  362    HB   VAL  42           HB       VAL  42  -1.130   0.824   2.051
  363   HG11  VAL  42          1HG1      VAL  42  -1.411  -1.125   3.533
  364   HG12  VAL  42          2HG1      VAL  42  -1.473  -0.058   4.942
  365   HG13  VAL  42          3HG1      VAL  42   0.013  -0.184   3.999
  366   HG21  VAL  42          1HG2      VAL  42  -3.411   0.013   2.547
  367   HG22  VAL  42          2HG2      VAL  42  -3.393   1.748   2.223
  368   HG23  VAL  42          3HG2      VAL  42  -3.527   1.161   3.885
  369    H    GLU  43           H        GLU  43   0.633   2.841   5.465
  370    HA   GLU  43           HA       GLU  43   3.060   2.760   3.859
  371    HB2  GLU  43          2HB       GLU  43   2.719   2.897   6.890
  372    HB3  GLU  43          3HB       GLU  43   4.260   2.984   6.040
  373    HG2  GLU  43          2HG       GLU  43   3.754   5.216   6.547
  374    HG3  GLU  43          3HG       GLU  43   3.334   5.046   4.847
  375    H    LEU  44           H        LEU  44   3.750   0.854   3.203
  376    HA   LEU  44           HA       LEU  44   3.567  -1.506   4.964
  377    HB2  LEU  44          2HB       LEU  44   4.146  -1.550   1.985
  378    HB3  LEU  44          3HB       LEU  44   3.747  -2.902   3.029
  379    HG   LEU  44           HG       LEU  44   1.462  -1.479   3.364
  380   HD11  LEU  44          1HD1      LEU  44   2.316  -0.702   0.570
  381   HD12  LEU  44          2HD1      LEU  44   2.170   0.384   1.954
  382   HD13  LEU  44          3HD1      LEU  44   0.737  -0.408   1.307
  383   HD21  LEU  44          1HD2      LEU  44   1.942  -3.271   0.972
  384   HD22  LEU  44          2HD2      LEU  44   0.368  -2.861   1.668
  385   HD23  LEU  44          3HD2      LEU  44   1.531  -3.801   2.604
  386    H    GLU  45           H        GLU  45   5.524  -3.041   4.394
  387    HA   GLU  45           HA       GLU  45   7.995  -1.488   4.706
  388    HB2  GLU  45          2HB       GLU  45   6.882  -1.782   6.921
  389    HB3  GLU  45          3HB       GLU  45   6.914  -3.528   6.709
  390    HG2  GLU  45          2HG       GLU  45   9.271  -3.623   6.936
  391    HG3  GLU  45          3HG       GLU  45   9.450  -1.888   6.676
  392    H    LEU  46           H        LEU  46   9.284  -2.311   3.225
  393    HA   LEU  46           HA       LEU  46   9.196  -5.173   2.456
  394    HB2  LEU  46          2HB       LEU  46   7.844  -3.752   0.937
  395    HB3  LEU  46          3HB       LEU  46   9.212  -2.702   0.666
  396    HG   LEU  46           HG       LEU  46   9.358  -5.623  -0.161
  397   HD11  LEU  46          1HD1      LEU  46   7.291  -4.759  -1.175
  398   HD12  LEU  46          2HD1      LEU  46   8.531  -5.047  -2.393
  399   HD13  LEU  46          3HD1      LEU  46   8.183  -3.398  -1.861
  400   HD21  LEU  46          1HD2      LEU  46  10.922  -4.778  -1.859
  401   HD22  LEU  46          2HD2      LEU  46  11.452  -4.340  -0.239
  402   HD23  LEU  46          3HD2      LEU  46  10.690  -3.127  -1.272
  403    H    ARG  47           H        ARG  47  11.225  -6.055   2.001
  404    HA   ARG  47           HA       ARG  47  13.553  -4.393   2.772
  405    HB2  ARG  47          2HB       ARG  47  13.114  -7.411   2.828
  406    HB3  ARG  47          3HB       ARG  47  14.649  -6.630   3.227
  407    HG2  ARG  47          2HG       ARG  47  13.548  -5.451   5.109
  408    HG3  ARG  47          3HG       ARG  47  12.027  -6.257   4.720
  409    HD2  ARG  47          2HD       ARG  47  14.600  -7.637   5.589
  410    HD3  ARG  47          3HD       ARG  47  13.185  -7.353   6.603
  411    HE   ARG  47           HE       ARG  47  11.935  -8.860   5.148
  412   HH11  ARG  47          1HH1      ARG  47  15.444  -9.118   4.947
  413   HH12  ARG  47          2HH1      ARG  47  15.405 -10.742   4.339
  414   HH21  ARG  47          1HH2      ARG  47  11.907 -10.976   4.360
  415   HH22  ARG  47          2HH2      ARG  47  13.397 -11.794   4.009
  416    H    THR  48           H        THR  48  14.307  -3.505   0.892
  417    HA   THR  48           HA       THR  48  14.716  -5.147  -1.521
  418    HB   THR  48           HB       THR  48  15.299  -2.161  -1.347
  419    HG1  THR  48           HG1      THR  48  13.272  -1.726  -1.096
  420   HG21  THR  48          1HG2      THR  48  14.292  -3.934  -3.606
  421   HG22  THR  48          2HG2      THR  48  15.949  -3.350  -3.415
  422   HG23  THR  48          3HG2      THR  48  14.638  -2.208  -3.726
  423    H    ASN  49           H        ASN  49  16.681  -6.138  -1.665
  424    HA   ASN  49           HA       ASN  49  18.915  -6.525  -1.785
  425    HB2  ASN  49          2HB       ASN  49  19.014  -3.480  -1.840
  426    HB3  ASN  49          3HB       ASN  49  20.446  -4.479  -2.063
  427   HD21  ASN  49          1HD2      ASN  49  19.181  -2.598  -3.914
  428   HD22  ASN  49          2HD2      ASN  49  18.837  -3.512  -5.342
  429    H    GLY  50           H        GLY  50  17.670  -6.465   0.831
  430    HA2  GLY  50          2HA       GLY  50  18.471  -6.996   2.952
  431    HA3  GLY  50          3HA       GLY  50  20.065  -6.431   2.488
  432    H    LYS  51           H        LYS  51  17.831  -4.082   1.672
  433    HA   LYS  51           HA       LYS  51  18.162  -2.610   4.224
  434    HB2  LYS  51          2HB       LYS  51  17.709  -1.552   1.395
  435    HB3  LYS  51          3HB       LYS  51  17.765  -0.544   2.831
  436    HG2  LYS  51          2HG       LYS  51  20.124  -2.251   1.995
  437    HG3  LYS  51          3HG       LYS  51  19.849  -0.646   1.329
  438    HD2  LYS  51          2HD       LYS  51  21.407  -0.322   3.085
  439    HD3  LYS  51          3HD       LYS  51  19.866   0.223   3.741
  440    HE2  LYS  51          2HE       LYS  51  19.645  -1.874   4.996
  441    HE3  LYS  51          3HE       LYS  51  21.134  -2.485   4.274
  442    HZ1  LYS  51          1HZ       LYS  51  20.917  -0.123   6.067
  443    HZ2  LYS  51          2HZ       LYS  51  22.340  -0.688   5.350
  444    HZ3  LYS  51          3HZ       LYS  51  21.532  -1.639   6.486
  445    H    LYS  52           H        LYS  52  16.379  -2.250   5.375
  446    HA   LYS  52           HA       LYS  52  13.741  -2.953   4.434
  447    HB2  LYS  52          2HB       LYS  52  14.538  -3.438   6.761
  448    HB3  LYS  52          3HB       LYS  52  14.667  -1.718   7.079
  449    HG2  LYS  52          2HG       LYS  52  12.014  -2.955   6.301
  450    HG3  LYS  52          3HG       LYS  52  12.593  -3.040   7.962
  451    HD2  LYS  52          2HD       LYS  52  12.067  -0.479   6.394
  452    HD3  LYS  52          3HD       LYS  52  11.027  -1.165   7.641
  453    HE2  LYS  52          2HE       LYS  52  12.800  -0.840   9.319
  454    HE3  LYS  52          3HE       LYS  52  13.857  -0.163   8.073
  455    HZ1  LYS  52          1HZ       LYS  52  12.303   1.629   7.751
  456    HZ2  LYS  52          2HZ       LYS  52  12.728   1.550   9.385
  457    HZ3  LYS  52          3HZ       LYS  52  11.227   0.967   8.866
  458    H    GLU  53           H        GLU  53  12.681  -1.575   3.188
  459    HA   GLU  53           HA       GLU  53  12.777   1.354   3.620
  460    HB2  GLU  53          2HB       GLU  53  12.407  -0.152   0.984
  461    HB3  GLU  53          3HB       GLU  53  12.264   1.594   1.175
  462    HG2  GLU  53          2HG       GLU  53  14.657   1.632   1.962
  463    HG3  GLU  53          3HG       GLU  53  14.759  -0.085   1.571
  464    H    ASN  54           H        ASN  54  10.851   2.211   4.169
  465    HA   ASN  54           HA       ASN  54   8.379   0.651   4.025
  466    HB2  ASN  54          2HB       ASN  54   8.968   3.391   5.254
  467    HB3  ASN  54          3HB       ASN  54   7.395   2.594   5.322
  468   HD21  ASN  54          1HD2      ASN  54   7.168   0.714   6.615
  469   HD22  ASN  54          2HD2      ASN  54   8.301   0.334   7.865
  470    H    TYR  55           H        TYR  55   6.864   0.965   2.475
  471    HA   TYR  55           HA       TYR  55   7.101   3.299   0.648
  472    HB2  TYR  55          2HB       TYR  55   5.939   0.526   0.100
  473    HB3  TYR  55          3HB       TYR  55   5.960   1.859  -1.046
  474    HD1  TYR  55           HD1      TYR  55   7.879   2.231  -2.445
  475    HD2  TYR  55           HD2      TYR  55   8.188  -0.477   0.850
  476    HE1  TYR  55           HE1      TYR  55  10.062   1.442  -3.276
  477    HE2  TYR  55           HE2      TYR  55  10.342  -1.258   0.016
  478    HH   TYR  55           HH       TYR  55  11.570  -1.365  -2.039
  479    H    THR  56           H        THR  56   5.548   4.746   1.056
  480    HA   THR  56           HA       THR  56   2.955   4.044   2.160
  481    HB   THR  56           HB       THR  56   3.997   6.732   1.152
  482    HG1  THR  56           HG1      THR  56   4.365   5.351   3.537
  483   HG21  THR  56          1HG2      THR  56   1.535   6.664   1.278
  484   HG22  THR  56          2HG2      THR  56   2.194   7.695   2.548
  485   HG23  THR  56          3HG2      THR  56   1.629   6.074   2.947
  486    H    VAL  57           H        VAL  57   1.822   2.927   0.671
  487    HA   VAL  57           HA       VAL  57   1.634   3.813  -2.111
  488    HB   VAL  57           HB       VAL  57   0.388   1.363  -0.769
  489   HG11  VAL  57          1HG1      VAL  57   0.621   2.088  -3.716
  490   HG12  VAL  57          2HG1      VAL  57  -0.864   2.069  -2.766
  491   HG13  VAL  57          3HG1      VAL  57  -0.005   0.562  -3.086
  492   HG21  VAL  57          1HG2      VAL  57   2.852   1.229  -0.762
  493   HG22  VAL  57          2HG2      VAL  57   2.884   1.543  -2.499
  494   HG23  VAL  57          3HG2      VAL  57   2.160   0.054  -1.885
  495    H    GLU  58           H        GLU  58   0.325   5.467  -2.324
  496    HA   GLU  58           HA       GLU  58  -2.027   5.995  -0.736
  497    HB2  GLU  58          2HB       GLU  58  -1.114   7.299  -3.346
  498    HB3  GLU  58          3HB       GLU  58  -2.273   7.964  -2.194
  499    HG2  GLU  58          2HG       GLU  58  -0.450   8.162  -0.511
  500    HG3  GLU  58          3HG       GLU  58   0.690   7.517  -1.689
  501    H    VAL  59           H        VAL  59  -3.697   4.584  -1.062
  502    HA   VAL  59           HA       VAL  59  -4.556   3.924  -3.828
  503    HB   VAL  59           HB       VAL  59  -5.335   2.466  -1.261
  504   HG11  VAL  59          1HG1      VAL  59  -5.712   1.678  -4.168
  505   HG12  VAL  59          2HG1      VAL  59  -6.977   2.240  -3.075
  506   HG13  VAL  59          3HG1      VAL  59  -6.170   0.700  -2.769
  507   HG21  VAL  59          1HG2      VAL  59  -3.774   0.666  -1.908
  508   HG22  VAL  59          2HG2      VAL  59  -2.914   2.186  -1.639
  509   HG23  VAL  59          3HG2      VAL  59  -3.227   1.631  -3.285
  510    H    GLU  60           H        GLU  60  -6.425   4.875  -4.487
  511    HA   GLU  60           HA       GLU  60  -8.171   6.211  -2.506
  512    HB2  GLU  60          2HB       GLU  60  -6.902   7.717  -4.021
  513    HB3  GLU  60          3HB       GLU  60  -7.633   6.924  -5.413
  514    HG2  GLU  60          2HG       GLU  60  -9.870   7.713  -4.651
  515    HG3  GLU  60          3HG       GLU  60  -9.095   8.557  -3.306
  516    H    ARG  61           H        ARG  61 -10.372   6.071  -2.787
  517    HA   ARG  61           HA       ARG  61 -11.405   3.646  -3.912
  518    HB2  ARG  61          2HB       ARG  61 -12.217   4.678  -1.776
  519    HB3  ARG  61          3HB       ARG  61 -12.874   6.024  -2.702
  520    HG2  ARG  61          2HG       ARG  61 -14.693   4.578  -2.227
  521    HG3  ARG  61          3HG       ARG  61 -14.321   4.345  -3.933
  522    HD2  ARG  61          2HD       ARG  61 -13.179   2.255  -3.448
  523    HD3  ARG  61          3HD       ARG  61 -13.340   2.516  -1.713
  524    HE   ARG  61           HE       ARG  61 -15.188   1.255  -3.373
  525   HH11  ARG  61          1HH1      ARG  61 -15.247   3.612  -0.764
  526   HH12  ARG  61          2HH1      ARG  61 -16.850   3.178  -0.284
  527   HH21  ARG  61          1HH2      ARG  61 -17.254   0.722  -2.679
  528   HH22  ARG  61          2HH2      ARG  61 -17.961   1.573  -1.348
  529    H    GLN  62           H        GLN  62 -11.538   3.570  -6.082
  530    HA   GLN  62           HA       GLN  62 -12.618   5.778  -7.683
  531    HB2  GLN  62          2HB       GLN  62 -10.604   4.379  -8.449
  532    HB3  GLN  62          3HB       GLN  62 -11.709   3.021  -8.641
  533    HG2  GLN  62          2HG       GLN  62 -11.321   4.078 -10.798
  534    HG3  GLN  62          3HG       GLN  62 -12.998   4.331 -10.316
  535   HE21  GLN  62          1HE2      GLN  62 -13.673   6.464  -9.766
  536   HE22  GLN  62          2HE2      GLN  62 -12.720   7.847 -10.159
  537    H    GLY  63           H        GLY  63 -14.670   5.683  -6.605
  538    HA2  GLY  63          2HA       GLY  63 -16.925   5.300  -6.672
  539    HA3  GLY  63          3HA       GLY  63 -16.667   4.155  -7.979
  540    H    ASN  64           H        ASN  64 -16.670   2.031  -7.544
  541    HA   ASN  64           HA       ASN  64 -17.291   1.080  -4.829
  542    HB2  ASN  64          2HB       ASN  64 -17.514  -0.222  -7.584
  543    HB3  ASN  64          3HB       ASN  64 -17.795  -1.099  -6.084
  544   HD21  ASN  64          1HD2      ASN  64 -18.942   1.613  -8.039
  545   HD22  ASN  64          2HD2      ASN  64 -20.553   1.597  -7.422
  546    H    THR  65           H        THR  65 -14.811   0.943  -7.298
  547    HA   THR  65           HA       THR  65 -13.319  -1.212  -5.950
  548    HB   THR  65           HB       THR  65 -11.889  -1.123  -8.042
  549    HG1  THR  65           HG1      THR  65 -12.192   0.871  -8.893
  550   HG21  THR  65          1HG2      THR  65 -14.861  -1.552  -8.525
  551   HG22  THR  65          2HG2      THR  65 -13.749  -2.749  -7.858
  552   HG23  THR  65          3HG2      THR  65 -13.547  -2.195  -9.520
  553    H    TRP  66           H        TRP  66 -10.815  -0.837  -6.181
  554    HA   TRP  66           HA       TRP  66 -10.056   1.828  -5.126
  555    HB2  TRP  66          2HB       TRP  66  -9.038  -0.955  -4.362
  556    HB3  TRP  66          3HB       TRP  66  -8.256   0.539  -3.856
  557    HD1  TRP  66           HD1      TRP  66 -11.308  -1.640  -3.075
  558    HE1  TRP  66           HE1      TRP  66 -12.457  -0.721  -0.959
  559    HE3  TRP  66           HE3      TRP  66  -8.676   2.718  -2.530
  560    HZ2  TRP  66           HZ2      TRP  66 -12.272   1.548   0.703
  561    HZ3  TRP  66           HZ3      TRP  66  -9.234   4.212  -0.657
  562    HH2  TRP  66           HH2      TRP  66 -11.000   3.633   0.928
  563    H    THR  67           H        THR  67  -8.008   2.640  -5.793
  564    HA   THR  67           HA       THR  67  -6.433   1.204  -7.790
  565    HB   THR  67           HB       THR  67  -8.183   2.382  -9.128
  566    HG1  THR  67           HG1      THR  67  -6.441   2.186 -10.334
  567   HG21  THR  67          1HG2      THR  67  -8.180   4.846  -9.334
  568   HG22  THR  67          2HG2      THR  67  -6.965   4.967  -8.060
  569   HG23  THR  67          3HG2      THR  67  -8.578   4.361  -7.681
  570    H    VAL  68           H        VAL  68  -4.287   1.846  -7.833
  571    HA   VAL  68           HA       VAL  68  -3.363   3.356  -5.535
  572    HB   VAL  68           HB       VAL  68  -1.816   1.884  -7.712
  573   HG11  VAL  68          1HG1      VAL  68   0.190   2.129  -6.265
  574   HG12  VAL  68          2HG1      VAL  68  -0.727   3.176  -5.180
  575   HG13  VAL  68          3HG1      VAL  68  -0.401   3.693  -6.835
  576   HG21  VAL  68          1HG2      VAL  68  -2.404   1.140  -4.824
  577   HG22  VAL  68          2HG2      VAL  68  -1.399   0.208  -5.937
  578   HG23  VAL  68          3HG2      VAL  68  -3.124   0.400  -6.257
  579    H    LYS  69           H        LYS  69  -3.271   5.480  -5.621
  580    HA   LYS  69           HA       LYS  69  -3.097   7.172  -7.873
  581    HB2  LYS  69          2HB       LYS  69  -2.405   7.765  -4.949
  582    HB3  LYS  69          3HB       LYS  69  -2.694   8.980  -6.192
  583    HG2  LYS  69          2HG       LYS  69  -4.734   6.985  -5.164
  584    HG3  LYS  69          3HG       LYS  69  -4.636   8.684  -4.702
  585    HD2  LYS  69          2HD       LYS  69  -5.147   7.690  -7.533
  586    HD3  LYS  69          3HD       LYS  69  -6.398   8.222  -6.411
  587    HE2  LYS  69          2HE       LYS  69  -5.404  10.471  -6.340
  588    HE3  LYS  69          3HE       LYS  69  -4.125   9.948  -7.441
  589    HZ1  LYS  69          1HZ       LYS  69  -7.024  10.080  -8.046
  590    HZ2  LYS  69          2HZ       LYS  69  -5.846   9.486  -9.097
  591    HZ3  LYS  69          3HZ       LYS  69  -5.818  11.107  -8.643
  592    H    ARG  70           H        ARG  70  -0.673   6.348  -5.389
  593    HA   ARG  70           HA       ARG  70   1.521   6.353  -7.251
  594    HB2  ARG  70          2HB       ARG  70   1.143   8.829  -6.832
  595    HB3  ARG  70          3HB       ARG  70   1.470   8.555  -5.129
  596    HG2  ARG  70          2HG       ARG  70   3.460   9.457  -6.046
  597    HG3  ARG  70          3HG       ARG  70   3.785   7.738  -5.816
  598    HD2  ARG  70          2HD       ARG  70   2.965   8.986  -8.466
  599    HD3  ARG  70          3HD       ARG  70   4.637   8.697  -7.989
  600    HE   ARG  70           HE       ARG  70   3.979   6.274  -7.849
  601   HH11  ARG  70          1HH1      ARG  70   2.354   8.440 -10.111
  602   HH12  ARG  70          2HH1      ARG  70   1.935   7.158 -11.205
  603   HH21  ARG  70          1HH2      ARG  70   3.385   4.611  -9.279
  604   HH22  ARG  70          2HH2      ARG  70   2.517   4.999 -10.733
  605    H    ILE  71           H        ILE  71   2.956   4.893  -6.497
  606    HA   ILE  71           HA       ILE  71   3.055   4.202  -3.661
  607    HB   ILE  71           HB       ILE  71   4.744   3.141  -5.976
  608   HG12  ILE  71          2HG1      ILE  71   2.367   1.899  -4.513
  609   HG13  ILE  71          3HG1      ILE  71   2.352   2.511  -6.162
  610   HG21  ILE  71          1HG2      ILE  71   4.610   2.267  -3.065
  611   HG22  ILE  71          2HG2      ILE  71   6.003   2.961  -3.898
  612   HG23  ILE  71          3HG2      ILE  71   5.419   1.358  -4.337
  613   HD11  ILE  71          1HD1      ILE  71   3.892   0.126  -5.152
  614   HD12  ILE  71          2HD1      ILE  71   3.958   0.765  -6.798
  615   HD13  ILE  71          3HD1      ILE  71   2.448   0.124  -6.161
  616    H    THR  72           H        THR  72   4.039   5.625  -2.458
  617    HA   THR  72           HA       THR  72   6.323   7.222  -3.385
  618    HB   THR  72           HB       THR  72   4.665   7.496  -0.826
  619    HG1  THR  72           HG1      THR  72   3.257   7.873  -2.502
  620   HG21  THR  72          1HG2      THR  72   6.469   9.511  -2.231
  621   HG22  THR  72          2HG2      THR  72   6.884   8.629  -0.752
  622   HG23  THR  72          3HG2      THR  72   5.552   9.794  -0.761
  623    H    ARG  73           H        ARG  73   8.276   6.257  -2.948
  624    HA   ARG  73           HA       ARG  73   8.791   4.424  -0.808
  625    HB2  ARG  73          2HB       ARG  73  10.181   4.572  -2.898
  626    HB3  ARG  73          3HB       ARG  73  10.748   6.158  -2.388
  627    HG2  ARG  73          2HG       ARG  73  11.662   4.957  -0.284
  628    HG3  ARG  73          3HG       ARG  73  11.368   3.454  -1.163
  629    HD2  ARG  73          2HD       ARG  73  13.208   5.724  -1.973
  630    HD3  ARG  73          3HD       ARG  73  13.683   4.110  -1.444
  631    HE   ARG  73           HE       ARG  73  12.215   4.627  -3.972
  632   HH11  ARG  73          1HH1      ARG  73  14.816   2.970  -2.257
  633   HH12  ARG  73          2HH1      ARG  73  15.309   2.073  -3.655
  634   HH21  ARG  73          1HH2      ARG  73  12.866   3.422  -5.778
  635   HH22  ARG  73          2HH2      ARG  73  14.206   2.330  -5.644
  636    H    THR  74           H        THR  74   9.832   4.858   1.208
  637    HA   THR  74           HA       THR  74   9.396   7.287   2.559
  638    HB   THR  74           HB       THR  74   9.738   5.199   3.803
  639    HG1  THR  74           HG1      THR  74  11.918   6.936   4.405
  640   HG21  THR  74          1HG2      THR  74  11.394   4.079   2.369
  641   HG22  THR  74          2HG2      THR  74  11.962   4.141   4.039
  642   HG23  THR  74          3HG2      THR  74  12.622   5.257   2.840
  643    H    VAL  75           H        VAL  75  10.880   8.917   3.232
  644    HA   VAL  75           HA       VAL  75  12.698   9.866   1.307
  645    HB   VAL  75           HB       VAL  75  11.599  11.408   2.841
  646   HG11  VAL  75          1HG1      VAL  75  13.233  10.205   5.104
  647   HG12  VAL  75          2HG1      VAL  75  11.493  10.031   4.871
  648   HG13  VAL  75          3HG1      VAL  75  12.178  11.618   5.222
  649   HG21  VAL  75          1HG2      VAL  75  14.616  11.502   3.229
  650   HG22  VAL  75          2HG2      VAL  75  13.507  12.860   3.437
  651   HG23  VAL  75          3HG2      VAL  75  13.728  12.139   1.843
  652    H    GLY  76           H        GLY  76  14.719   9.339   0.920
  653    HA2  GLY  76          2HA       GLY  76  16.837   8.711   2.537
  654    HA3  GLY  76          3HA       GLY  76  16.011   7.170   2.300
  655    H    SER  77           H        SER  77  16.000   6.198   0.266
  656    HA   SER  77           HA       SER  77  18.068   7.028  -1.591
  657    HB2  SER  77          2HB       SER  77  17.770   4.621  -1.033
  658    HB3  SER  77          3HB       SER  77  16.139   4.657  -1.702
  659    HG   SER  77           HG       SER  77  17.645   5.580  -3.608
  660    H    LEU  78           H        LEU  78  17.125   9.058  -2.172
  661    HA   LEU  78           HA       LEU  78  14.632   9.092  -3.716
  662    HB2  LEU  78          2HB       LEU  78  15.001  10.912  -2.099
  663    HB3  LEU  78          3HB       LEU  78  16.520  11.329  -2.872
  664    HG   LEU  78           HG       LEU  78  15.253  11.989  -4.941
  665   HD11  LEU  78          1HD1      LEU  78  12.772  11.528  -3.274
  666   HD12  LEU  78          2HD1      LEU  78  13.273  10.614  -4.699
  667   HD13  LEU  78          3HD1      LEU  78  12.824  12.310  -4.856
  668   HD21  LEU  78          1HD2      LEU  78  14.434  13.473  -2.427
  669   HD22  LEU  78          2HD2      LEU  78  14.373  14.112  -4.073
  670   HD23  LEU  78          3HD2      LEU  78  15.925  13.703  -3.346
  671    H    GLU  79           H        GLU  79  14.563   9.232  -5.886
  672    HA   GLU  79           HA       GLU  79  16.803   8.814  -7.576
  673    HB2  GLU  79          2HB       GLU  79  14.501   8.128  -8.192
  674    HB3  GLU  79          3HB       GLU  79  13.988   9.814  -8.221
  675    HG2  GLU  79          2HG       GLU  79  15.446  10.266 -10.136
  676    HG3  GLU  79          3HG       GLU  79  16.076   8.623 -10.082
  677    H    HIS  80           H        HIS  80  18.189  10.266  -8.467
  678    HA   HIS  80           HA       HIS  80  17.955  13.100  -7.841
  679    HB2  HIS  80          2HB       HIS  80  20.250  13.315  -8.665
  680    HB3  HIS  80          3HB       HIS  80  20.143  11.930  -7.597
  681    HD1  HIS  80           HD1      HIS  80  21.253  12.931 -10.932
  682    HD2  HIS  80           HD2      HIS  80  20.260   9.370  -9.036
  683    HE1  HIS  80           HE1      HIS  80  22.179  11.105 -12.383
  684    HE2  HIS  80           HE2      HIS  80  21.640   8.973 -11.171
  685    H    HIS  81           H        HIS  81  15.921  13.047  -9.150
  686    HA   HIS  81           HA       HIS  81  15.924  12.751 -11.986
  687    HB2  HIS  81          2HB       HIS  81  13.585  13.691 -11.846
  688    HB3  HIS  81          3HB       HIS  81  13.871  12.327 -10.772
  689    HD1  HIS  81           HD1      HIS  81  13.260  16.049 -10.718
  690    HD2  HIS  81           HD2      HIS  81  13.578  12.882  -8.047
  691    HE1  HIS  81           HE1      HIS  81  12.532  16.959  -8.499
  692    HE2  HIS  81           HE2      HIS  81  12.954  15.090  -6.881
  693    H    HIS  82           H        HIS  82  16.225  14.212 -13.588
  694    HA   HIS  82           HA       HIS  82  16.436  17.102 -12.970
  695    HB2  HIS  82          2HB       HIS  82  18.712  16.112 -13.267
  696    HB3  HIS  82          3HB       HIS  82  18.244  15.514 -14.857
  697    HD1  HIS  82           HD1      HIS  82  19.452  18.548 -13.094
  698    HD2  HIS  82           HD2      HIS  82  17.944  17.603 -16.843
  699    HE1  HIS  82           HE1      HIS  82  19.963  20.519 -14.555
  700    HE2  HIS  82           HE2      HIS  82  19.170  19.859 -16.842
  701    H    HIS  83           H        HIS  83  14.894  18.131 -14.048
  702    HA   HIS  83           HA       HIS  83  14.162  17.337 -16.813
  703    HB2  HIS  83          2HB       HIS  83  12.199  18.197 -14.620
  704    HB3  HIS  83          3HB       HIS  83  11.780  17.909 -16.306
  705    HD1  HIS  83           HD1      HIS  83  11.092  15.567 -16.903
  706    HD2  HIS  83           HD2      HIS  83  13.065  15.733 -13.245
  707    HE1  HIS  83           HE1      HIS  83  10.922  13.264 -15.922
  708    HE2  HIS  83           HE2      HIS  83  12.048  13.415 -13.685
  709    H    HIS  84           H        HIS  84  13.983  19.046 -18.201
  710    HA   HIS  84           HA       HIS  84  15.415  21.386 -17.594
  711    HB2  HIS  84          2HB       HIS  84  15.011  22.080 -19.873
  712    HB3  HIS  84          3HB       HIS  84  15.189  20.333 -19.902
  713    HD1  HIS  84           HD1      HIS  84  12.956  23.028 -20.934
  714    HD2  HIS  84           HD2      HIS  84  12.582  18.958 -20.177
  715    HE1  HIS  84           HE1      HIS  84  10.797  22.327 -22.010
  716    HE2  HIS  84           HE2      HIS  84  10.701  19.838 -21.694
  717    H    HIS  85           H        HIS  85  14.825  23.462 -17.126
  718    HA   HIS  85           HA       HIS  85  12.097  24.024 -16.297
  719    HB2  HIS  85          2HB       HIS  85  13.089  26.352 -15.736
  720    HB3  HIS  85          3HB       HIS  85  13.671  24.979 -14.811
  721    HD1  HIS  85           HD1      HIS  85  16.132  24.400 -14.957
  722    HD2  HIS  85           HD2      HIS  85  15.042  27.488 -17.507
  723    HE1  HIS  85           HE1      HIS  85  18.282  25.403 -15.761
  724    HE2  HIS  85           HE2      HIS  85  17.588  27.114 -17.455
  Start of MODEL   13
    1    H1   MET   1          1H        MET   1 -19.598  -9.351   9.188
    2    H2   MET   1          2H        MET   1 -19.405 -10.485   7.955
    3    H3   MET   1          3H        MET   1 -20.111  -8.989   7.619
    4    HA   MET   1           HA       MET   1 -17.325  -9.412   8.507
    5    HB2  MET   1          2HB       MET   1 -18.505  -8.848   5.749
    6    HB3  MET   1          3HB       MET   1 -16.808  -8.550   6.113
    7    HG2  MET   1          2HG       MET   1 -18.182 -11.245   6.311
    8    HG3  MET   1          3HG       MET   1 -17.137 -10.708   4.988
    9    HE1  MET   1          1HE       MET   1 -14.796 -13.280   6.811
   10    HE2  MET   1          2HE       MET   1 -15.425 -12.759   5.249
   11    HE3  MET   1          3HE       MET   1 -16.521 -13.419   6.467
   12    HA   PRO   2           HA       PRO   2 -17.606  -4.997   9.446
   13    HB2  PRO   2          2HB       PRO   2 -14.978  -4.388   9.777
   14    HB3  PRO   2          3HB       PRO   2 -15.812  -5.466  10.918
   15    HG2  PRO   2          2HG       PRO   2 -14.024  -6.197   8.610
   16    HG3  PRO   2          3HG       PRO   2 -14.014  -6.830  10.272
   17    HD2  PRO   2          2HD       PRO   2 -15.232  -8.135   8.197
   18    HD3  PRO   2          3HD       PRO   2 -15.793  -8.271   9.879
   19    H    SER   3           H        SER   3 -18.465  -4.805   7.170
   20    HA   SER   3           HA       SER   3 -16.828  -4.726   4.888
   21    HB2  SER   3          2HB       SER   3 -19.243  -5.278   4.862
   22    HB3  SER   3          3HB       SER   3 -19.635  -3.594   5.219
   23    HG   SER   3           HG       SER   3 -18.306  -4.604   2.917
   24    H    GLU   4           H        GLU   4 -17.834  -2.114   7.044
   25    HA   GLU   4           HA       GLU   4 -16.954   0.089   5.483
   26    HB2  GLU   4          2HB       GLU   4 -18.401   0.439   7.437
   27    HB3  GLU   4          3HB       GLU   4 -17.167  -0.204   8.512
   28    HG2  GLU   4          2HG       GLU   4 -15.701   1.709   8.009
   29    HG3  GLU   4          3HG       GLU   4 -16.890   2.342   6.875
   30    H    GLU   5           H        GLU   5 -15.355  -1.839   7.996
   31    HA   GLU   5           HA       GLU   5 -12.784  -0.556   7.819
   32    HB2  GLU   5          2HB       GLU   5 -13.693  -1.547   9.919
   33    HB3  GLU   5          3HB       GLU   5 -13.618  -3.150   9.196
   34    HG2  GLU   5          2HG       GLU   5 -11.178  -3.013   9.073
   35    HG3  GLU   5          3HG       GLU   5 -11.209  -1.365   9.700
   36    H    GLU   6           H        GLU   6 -14.363  -3.013   6.031
   37    HA   GLU   6           HA       GLU   6 -12.264  -4.823   5.463
   38    HB2  GLU   6          2HB       GLU   6 -14.766  -5.229   5.210
   39    HB3  GLU   6          3HB       GLU   6 -14.695  -4.301   3.716
   40    HG2  GLU   6          2HG       GLU   6 -13.059  -5.946   2.803
   41    HG3  GLU   6          3HG       GLU   6 -13.200  -6.884   4.290
   42    H    GLU   7           H        GLU   7 -12.957  -1.683   4.229
   43    HA   GLU   7           HA       GLU   7 -11.602  -1.414   1.874
   44    HB2  GLU   7          2HB       GLU   7 -11.244   0.370   4.329
   45    HB3  GLU   7          3HB       GLU   7 -10.828   0.806   2.677
   46    HG2  GLU   7          2HG       GLU   7 -13.218   0.611   2.054
   47    HG3  GLU   7          3HG       GLU   7 -13.611   0.305   3.748
   48    H    LYS   8           H        LYS   8 -10.157  -1.483   5.130
   49    HA   LYS   8           HA       LYS   8  -7.444  -1.375   4.439
   50    HB2  LYS   8          2HB       LYS   8  -8.854  -2.506   6.897
   51    HB3  LYS   8          3HB       LYS   8  -7.103  -2.512   6.748
   52    HG2  LYS   8          2HG       LYS   8  -7.717  -0.643   8.105
   53    HG3  LYS   8          3HG       LYS   8  -7.137  -0.028   6.558
   54    HD2  LYS   8          2HD       LYS   8  -9.473   0.390   5.846
   55    HD3  LYS   8          3HD       LYS   8 -10.061  -0.272   7.375
   56    HE2  LYS   8          2HE       LYS   8  -8.362   2.227   7.039
   57    HE3  LYS   8          3HE       LYS   8 -10.072   2.174   7.463
   58    HZ1  LYS   8          1HZ       LYS   8  -7.825   1.137   9.107
   59    HZ2  LYS   8          2HZ       LYS   8  -9.457   0.980   9.504
   60    HZ3  LYS   8          3HZ       LYS   8  -8.749   2.512   9.424
   61    H    ARG   9           H        ARG   9  -9.575  -4.178   4.960
   62    HA   ARG   9           HA       ARG   9  -7.720  -6.276   4.887
   63    HB2  ARG   9          2HB       ARG   9 -10.601  -6.354   3.854
   64    HB3  ARG   9          3HB       ARG   9  -9.634  -7.752   4.311
   65    HG2  ARG   9          2HG       ARG   9 -10.591  -5.566   6.185
   66    HG3  ARG   9          3HG       ARG   9 -11.281  -7.184   6.038
   67    HD2  ARG   9          2HD       ARG   9  -8.465  -6.532   6.974
   68    HD3  ARG   9          3HD       ARG   9  -9.819  -7.012   8.002
   69    HE   ARG   9           HE       ARG   9  -9.520  -8.990   6.080
   70   HH11  ARG   9          1HH1      ARG   9  -7.686  -7.755   8.825
   71   HH12  ARG   9          2HH1      ARG   9  -6.897  -9.270   9.116
   72   HH21  ARG   9          1HH2      ARG   9  -8.428 -10.933   6.432
   73   HH22  ARG   9          2HH2      ARG   9  -7.317 -11.071   7.757
   74    H    GLN  10           H        GLN  10  -9.439  -4.657   2.278
   75    HA   GLN  10           HA       GLN  10  -8.472  -6.318   0.132
   76    HB2  GLN  10          2HB       GLN  10  -9.953  -3.649   0.130
   77    HB3  GLN  10          3HB       GLN  10  -9.658  -4.632  -1.301
   78    HG2  GLN  10          2HG       GLN  10 -11.048  -6.426  -0.412
   79    HG3  GLN  10          3HG       GLN  10 -11.272  -5.544   1.098
   80   HE21  GLN  10          1HE2      GLN  10 -13.539  -5.544   0.843
   81   HE22  GLN  10          2HE2      GLN  10 -14.330  -4.547  -0.323
   82    H    VAL  11           H        VAL  11  -7.874  -2.967   1.189
   83    HA   VAL  11           HA       VAL  11  -6.386  -2.194  -1.077
   84    HB   VAL  11           HB       VAL  11  -6.809  -0.833   1.618
   85   HG11  VAL  11          1HG1      VAL  11  -5.961   1.262   0.624
   86   HG12  VAL  11          2HG1      VAL  11  -5.509   0.382  -0.838
   87   HG13  VAL  11          3HG1      VAL  11  -4.698   0.026   0.683
   88   HG21  VAL  11          1HG2      VAL  11  -7.983  -0.262  -1.124
   89   HG22  VAL  11          2HG2      VAL  11  -8.352   0.621   0.362
   90   HG23  VAL  11          3HG2      VAL  11  -8.815  -1.075   0.200
   91    H    LYS  12           H        LYS  12  -5.310  -3.274   2.173
   92    HA   LYS  12           HA       LYS  12  -2.560  -2.592   1.874
   93    HB2  LYS  12          2HB       LYS  12  -3.640  -4.947   3.473
   94    HB3  LYS  12          3HB       LYS  12  -2.075  -4.170   3.681
   95    HG2  LYS  12          2HG       LYS  12  -3.213  -2.116   4.466
   96    HG3  LYS  12          3HG       LYS  12  -4.772  -2.915   4.275
   97    HD2  LYS  12          2HD       LYS  12  -2.592  -3.468   6.297
   98    HD3  LYS  12          3HD       LYS  12  -4.292  -3.119   6.584
   99    HE2  LYS  12          2HE       LYS  12  -3.126  -5.710   5.503
  100    HE3  LYS  12          3HE       LYS  12  -3.834  -5.453   7.092
  101    HZ1  LYS  12          1HZ       LYS  12  -5.278  -5.378   4.494
  102    HZ2  LYS  12          2HZ       LYS  12  -5.970  -5.012   5.987
  103    HZ3  LYS  12          3HZ       LYS  12  -5.392  -6.569   5.692
  104    H    GLN  13           H        GLN  13  -4.464  -5.437   1.003
  105    HA   GLN  13           HA       GLN  13  -2.317  -7.087   0.129
  106    HB2  GLN  13          2HB       GLN  13  -4.536  -8.011   0.774
  107    HB3  GLN  13          3HB       GLN  13  -5.278  -7.221  -0.612
  108    HG2  GLN  13          2HG       GLN  13  -3.887  -8.611  -2.126
  109    HG3  GLN  13          3HG       GLN  13  -3.170  -9.401  -0.726
  110   HE21  GLN  13          1HE2      GLN  13  -6.607  -8.573  -1.073
  111   HE22  GLN  13          2HE2      GLN  13  -7.163 -10.207  -1.126
  112    H    VAL  14           H        VAL  14  -4.601  -4.950  -1.602
  113    HA   VAL  14           HA       VAL  14  -3.675  -5.349  -4.234
  114    HB   VAL  14           HB       VAL  14  -4.952  -2.846  -3.006
  115   HG11  VAL  14          1HG1      VAL  14  -5.606  -2.215  -5.315
  116   HG12  VAL  14          2HG1      VAL  14  -4.681  -3.574  -5.952
  117   HG13  VAL  14          3HG1      VAL  14  -3.849  -2.256  -5.126
  118   HG21  VAL  14          1HG2      VAL  14  -7.083  -3.705  -3.949
  119   HG22  VAL  14          2HG2      VAL  14  -6.387  -4.834  -2.786
  120   HG23  VAL  14          3HG2      VAL  14  -6.246  -5.157  -4.512
  121    H    ALA  15           H        ALA  15  -2.637  -3.158  -1.670
  122    HA   ALA  15           HA       ALA  15  -0.844  -1.544  -3.184
  123    HB1  ALA  15          1HB       ALA  15  -0.164  -0.655  -0.988
  124    HB2  ALA  15          2HB       ALA  15  -1.030  -1.964  -0.176
  125    HB3  ALA  15          3HB       ALA  15  -1.919  -0.760  -1.113
  126    H    LYS  16           H        LYS  16  -0.414  -4.443  -1.143
  127    HA   LYS  16           HA       LYS  16   2.450  -4.367  -1.225
  128    HB2  LYS  16          2HB       LYS  16   2.464  -6.480  -0.101
  129    HB3  LYS  16          3HB       LYS  16   1.176  -5.519   0.601
  130    HG2  LYS  16          2HG       LYS  16  -0.488  -6.813  -0.658
  131    HG3  LYS  16          3HG       LYS  16   0.794  -7.767  -1.400
  132    HD2  LYS  16          2HD       LYS  16   0.186  -7.662   1.588
  133    HD3  LYS  16          3HD       LYS  16  -0.311  -8.950   0.490
  134    HE2  LYS  16          2HE       LYS  16   2.066  -9.469   0.030
  135    HE3  LYS  16          3HE       LYS  16   2.557  -8.194   1.148
  136    HZ1  LYS  16          1HZ       LYS  16   1.390  -9.400   2.924
  137    HZ2  LYS  16          2HZ       LYS  16   2.633 -10.318   2.245
  138    HZ3  LYS  16          3HZ       LYS  16   1.023 -10.647   1.849
  139    H    GLU  17           H        GLU  17  -0.042  -5.856  -3.244
  140    HA   GLU  17           HA       GLU  17   1.605  -7.496  -4.843
  141    HB2  GLU  17          2HB       GLU  17  -0.930  -5.988  -5.636
  142    HB3  GLU  17          3HB       GLU  17  -0.164  -7.236  -6.615
  143    HG2  GLU  17          2HG       GLU  17  -1.427  -7.608  -3.895
  144    HG3  GLU  17          3HG       GLU  17  -2.083  -8.133  -5.437
  145    H    LYS  18           H        LYS  18   0.741  -4.060  -5.078
  146    HA   LYS  18           HA       LYS  18   2.008  -3.426  -7.513
  147    HB2  LYS  18          2HB       LYS  18   1.633  -1.564  -5.127
  148    HB3  LYS  18          3HB       LYS  18   1.868  -1.080  -6.802
  149    HG2  LYS  18          2HG       LYS  18  -0.544  -2.466  -5.630
  150    HG3  LYS  18          3HG       LYS  18  -0.451  -0.792  -6.146
  151    HD2  LYS  18          2HD       LYS  18  -0.149  -3.152  -8.051
  152    HD3  LYS  18          3HD       LYS  18  -1.689  -2.375  -7.698
  153    HE2  LYS  18          2HE       LYS  18  -0.887  -1.459  -9.765
  154    HE3  LYS  18          3HE       LYS  18  -0.707  -0.206  -8.541
  155    HZ1  LYS  18          1HZ       LYS  18   1.491  -1.979  -9.460
  156    HZ2  LYS  18          2HZ       LYS  18   1.632  -0.650  -8.427
  157    HZ3  LYS  18          3HZ       LYS  18   1.209  -0.430 -10.053
  158    H    LEU  19           H        LEU  19   3.203  -3.563  -4.191
  159    HA   LEU  19           HA       LEU  19   5.858  -2.603  -4.738
  160    HB2  LEU  19          2HB       LEU  19   4.688  -4.072  -2.343
  161    HB3  LEU  19          3HB       LEU  19   6.334  -3.450  -2.395
  162    HG   LEU  19           HG       LEU  19   3.764  -1.826  -2.439
  163   HD11  LEU  19          1HD1      LEU  19   6.037  -1.920  -0.437
  164   HD12  LEU  19          2HD1      LEU  19   4.418  -2.594  -0.223
  165   HD13  LEU  19          3HD1      LEU  19   4.633  -0.852  -0.362
  166   HD21  LEU  19          1HD2      LEU  19   5.183   0.178  -2.545
  167   HD22  LEU  19          2HD2      LEU  19   5.319  -0.802  -4.001
  168   HD23  LEU  19          3HD2      LEU  19   6.607  -0.834  -2.790
  169    H    LEU  20           H        LEU  20   4.354  -5.786  -4.648
  170    HA   LEU  20           HA       LEU  20   6.794  -7.298  -4.692
  171    HB2  LEU  20          2HB       LEU  20   3.922  -8.088  -5.326
  172    HB3  LEU  20          3HB       LEU  20   5.257  -9.230  -5.342
  173    HG   LEU  20           HG       LEU  20   4.296  -7.685  -2.898
  174   HD11  LEU  20          1HD1      LEU  20   3.953 -10.623  -3.558
  175   HD12  LEU  20          2HD1      LEU  20   2.686  -9.391  -3.560
  176   HD13  LEU  20          3HD1      LEU  20   3.481  -9.830  -2.050
  177   HD21  LEU  20          1HD2      LEU  20   5.830  -9.108  -1.602
  178   HD22  LEU  20          2HD2      LEU  20   6.687  -8.077  -2.741
  179   HD23  LEU  20          3HD2      LEU  20   6.468  -9.792  -3.098
  180    H    GLU  21           H        GLU  21   4.772  -5.817  -7.156
  181    HA   GLU  21           HA       GLU  21   5.906  -7.035  -9.463
  182    HB2  GLU  21          2HB       GLU  21   4.801  -4.207  -9.144
  183    HB3  GLU  21          3HB       GLU  21   5.134  -5.000 -10.683
  184    HG2  GLU  21          2HG       GLU  21   3.432  -6.721 -10.149
  185    HG3  GLU  21          3HG       GLU  21   3.076  -5.881  -8.644
  186    H    GLN  22           H        GLN  22   6.793  -4.199  -7.553
  187    HA   GLN  22           HA       GLN  22   9.059  -3.387  -9.100
  188    HB2  GLN  22          2HB       GLN  22   8.301  -2.742  -6.213
  189    HB3  GLN  22          3HB       GLN  22   9.561  -1.922  -7.133
  190    HG2  GLN  22          2HG       GLN  22   7.855  -1.119  -8.737
  191    HG3  GLN  22          3HG       GLN  22   6.601  -1.919  -7.792
  192   HE21  GLN  22          1HE2      GLN  22   7.691  -1.212  -5.188
  193   HE22  GLN  22          2HE2      GLN  22   7.421   0.479  -4.987
  194    H    SER  23           H        SER  23   8.584  -5.529  -6.349
  195    HA   SER  23           HA       SER  23  11.309  -6.518  -6.521
  196    HB2  SER  23          2HB       SER  23  11.451  -4.565  -4.941
  197    HB3  SER  23          3HB       SER  23  10.284  -5.361  -3.887
  198    HG   SER  23           HG       SER  23  11.872  -6.482  -3.106
  199    HA   PRO  24           HA       PRO  24   8.396 -10.012  -5.611
  200    HB2  PRO  24          2HB       PRO  24  10.233 -11.511  -7.410
  201    HB3  PRO  24          3HB       PRO  24   8.480 -11.275  -7.547
  202    HG2  PRO  24          2HG       PRO  24  10.211 -10.095  -9.259
  203    HG3  PRO  24          3HG       PRO  24   8.680  -9.330  -8.777
  204    HD2  PRO  24          2HD       PRO  24  11.465  -8.777  -7.760
  205    HD3  PRO  24          3HD       PRO  24  10.167  -7.634  -8.188
  206    H    ASN  25           H        ASN  25  11.748  -9.357  -5.340
  207    HA   ASN  25           HA       ASN  25  12.603 -11.792  -4.046
  208    HB2  ASN  25          2HB       ASN  25  14.022  -9.107  -4.329
  209    HB3  ASN  25          3HB       ASN  25  14.773 -10.632  -3.860
  210   HD21  ASN  25          1HD2      ASN  25  15.024 -12.282  -5.449
  211   HD22  ASN  25          2HD2      ASN  25  14.946 -11.925  -7.139
  212    H    SER  26           H        SER  26  10.930  -9.074  -2.974
  213    HA   SER  26           HA       SER  26  11.955  -9.215  -0.202
  214    HB2  SER  26          2HB       SER  26  10.760  -7.042   0.110
  215    HB3  SER  26          3HB       SER  26  11.972  -6.966  -1.164
  216    HG   SER  26           HG       SER  26   9.460  -7.666  -2.057
  217    H    LYS  27           H        LYS  27  10.523  -9.395   1.547
  218    HA   LYS  27           HA       LYS  27   7.733 -10.178   0.983
  219    HB2  LYS  27          2HB       LYS  27   9.370 -10.414   3.533
  220    HB3  LYS  27          3HB       LYS  27   7.665 -10.822   3.421
  221    HG2  LYS  27          2HG       LYS  27   9.799 -12.206   1.767
  222    HG3  LYS  27          3HG       LYS  27   9.318 -12.742   3.369
  223    HD2  LYS  27          2HD       LYS  27   8.100 -14.130   1.912
  224    HD3  LYS  27          3HD       LYS  27   6.925 -12.930   2.439
  225    HE2  LYS  27          2HE       LYS  27   6.774 -13.476   0.012
  226    HE3  LYS  27          3HE       LYS  27   7.109 -11.768   0.302
  227    HZ1  LYS  27          1HZ       LYS  27   9.142 -13.815  -0.411
  228    HZ2  LYS  27          2HZ       LYS  27   9.429 -12.167  -0.193
  229    HZ3  LYS  27          3HZ       LYS  27   8.473 -12.696  -1.477
  230    H    VAL  28           H        VAL  28   6.212  -8.736   1.241
  231    HA   VAL  28           HA       VAL  28   6.804  -6.129   2.478
  232    HB   VAL  28           HB       VAL  28   4.525  -6.869   0.574
  233   HG11  VAL  28          1HG1      VAL  28   5.462  -4.149   1.558
  234   HG12  VAL  28          2HG1      VAL  28   3.983  -4.973   2.058
  235   HG13  VAL  28          3HG1      VAL  28   4.173  -4.433   0.387
  236   HG21  VAL  28          1HG2      VAL  28   7.111  -5.378  -0.048
  237   HG22  VAL  28          2HG2      VAL  28   5.781  -5.655  -1.177
  238   HG23  VAL  28          3HG2      VAL  28   6.720  -7.020  -0.569
  239    H    GLN  29           H        GLN  29   6.177  -6.028   4.531
  240    HA   GLN  29           HA       GLN  29   3.706  -7.255   5.543
  241    HB2  GLN  29          2HB       GLN  29   5.837  -7.394   6.848
  242    HB3  GLN  29          3HB       GLN  29   5.938  -5.641   6.889
  243    HG2  GLN  29          2HG       GLN  29   5.186  -6.534   9.037
  244    HG3  GLN  29          3HG       GLN  29   3.933  -5.542   8.295
  245   HE21  GLN  29          1HE2      GLN  29   4.871  -8.803   9.132
  246   HE22  GLN  29          2HE2      GLN  29   3.306  -9.511   8.944
  247    H    VAL  30           H        VAL  30   2.110  -5.779   6.685
  248    HA   VAL  30           HA       VAL  30   1.895  -3.075   5.611
  249    HB   VAL  30           HB       VAL  30  -0.210  -4.231   6.008
  250   HG11  VAL  30          1HG1      VAL  30   0.443  -5.790   7.779
  251   HG12  VAL  30          2HG1      VAL  30  -1.015  -4.907   8.240
  252   HG13  VAL  30          3HG1      VAL  30   0.545  -4.462   8.937
  253   HG21  VAL  30          1HG2      VAL  30  -0.245  -1.798   6.315
  254   HG22  VAL  30          2HG2      VAL  30   0.154  -1.979   8.024
  255   HG23  VAL  30          3HG2      VAL  30  -1.399  -2.557   7.416
  256    H    ARG  31           H        ARG  31   2.583  -1.256   6.589
  257    HA   ARG  31           HA       ARG  31   4.097  -1.447   9.124
  258    HB2  ARG  31          2HB       ARG  31   5.348  -0.635   7.160
  259    HB3  ARG  31          3HB       ARG  31   4.145   0.615   6.878
  260    HG2  ARG  31          2HG       ARG  31   6.028   1.678   7.863
  261    HG3  ARG  31          3HG       ARG  31   4.779   1.621   9.104
  262    HD2  ARG  31          2HD       ARG  31   5.923  -0.294  10.172
  263    HD3  ARG  31          3HD       ARG  31   7.153  -0.276   8.897
  264    HE   ARG  31           HE       ARG  31   6.869   2.246  10.247
  265   HH11  ARG  31          1HH1      ARG  31   8.510  -0.878  10.444
  266   HH12  ARG  31          2HH1      ARG  31   9.793  -0.255  11.435
  267   HH21  ARG  31          1HH2      ARG  31   8.566   3.024  11.516
  268   HH22  ARG  31          2HH2      ARG  31   9.824   1.948  12.037
  269    H    ARG  32           H        ARG  32   1.608   0.455   7.443
  270    HA   ARG  32           HA       ARG  32   0.208   1.255   9.806
  271    HB2  ARG  32          2HB       ARG  32   2.455   2.783   9.465
  272    HB3  ARG  32          3HB       ARG  32   1.380   3.684   8.418
  273    HG2  ARG  32          2HG       ARG  32   0.823   3.099  11.344
  274    HG3  ARG  32          3HG       ARG  32   1.611   4.563  10.762
  275    HD2  ARG  32          2HD       ARG  32  -0.429   5.170   9.513
  276    HD3  ARG  32          3HD       ARG  32  -1.218   3.687  10.074
  277    HE   ARG  32           HE       ARG  32  -0.244   5.738  11.977
  278   HH11  ARG  32          1HH1      ARG  32  -2.894   3.772  10.760
  279   HH12  ARG  32          2HH1      ARG  32  -3.977   4.238  12.030
  280   HH21  ARG  32          1HH2      ARG  32  -1.678   6.347  13.625
  281   HH22  ARG  32          2HH2      ARG  32  -3.288   5.700  13.654
  282    H    VAL  33           H        VAL  33  -1.837   2.248   9.195
  283    HA   VAL  33           HA       VAL  33  -2.368   2.607   6.292
  284    HB   VAL  33           HB       VAL  33  -4.300   1.312   8.300
  285   HG11  VAL  33          1HG1      VAL  33  -5.509   2.638   6.625
  286   HG12  VAL  33          2HG1      VAL  33  -5.774   0.915   6.353
  287   HG13  VAL  33          3HG1      VAL  33  -4.654   1.807   5.321
  288   HG21  VAL  33          1HG2      VAL  33  -2.840   0.015   5.972
  289   HG22  VAL  33          2HG2      VAL  33  -4.049  -0.763   6.998
  290   HG23  VAL  33          3HG2      VAL  33  -2.505  -0.253   7.686
  291    H    GLN  34           H        GLN  34  -3.286   4.559   5.837
  292    HA   GLN  34           HA       GLN  34  -4.619   6.146   7.978
  293    HB2  GLN  34          2HB       GLN  34  -2.846   7.067   5.653
  294    HB3  GLN  34          3HB       GLN  34  -3.817   8.177   6.611
  295    HG2  GLN  34          2HG       GLN  34  -1.682   6.395   7.817
  296    HG3  GLN  34          3HG       GLN  34  -1.367   8.024   7.228
  297   HE21  GLN  34          1HE2      GLN  34  -2.988   6.144   9.682
  298   HE22  GLN  34          2HE2      GLN  34  -3.276   7.452  10.772
  299    H    LYS  35           H        LYS  35  -6.811   5.877   7.507
  300    HA   LYS  35           HA       LYS  35  -7.780   6.182   4.739
  301    HB2  LYS  35          2HB       LYS  35  -8.917   4.438   5.966
  302    HB3  LYS  35          3HB       LYS  35  -9.164   5.474   7.365
  303    HG2  LYS  35          2HG       LYS  35 -11.268   5.134   6.169
  304    HG3  LYS  35          3HG       LYS  35 -10.784   6.829   6.108
  305    HD2  LYS  35          2HD       LYS  35  -9.885   6.415   3.782
  306    HD3  LYS  35          3HD       LYS  35 -10.551   4.781   3.870
  307    HE2  LYS  35          2HE       LYS  35 -12.137   7.365   4.018
  308    HE3  LYS  35          3HE       LYS  35 -12.053   6.273   2.635
  309    HZ1  LYS  35          1HZ       LYS  35 -13.190   4.600   3.851
  310    HZ2  LYS  35          2HZ       LYS  35 -14.070   6.025   4.035
  311    HZ3  LYS  35          3HZ       LYS  35 -13.095   5.469   5.293
  312    H    GLN  36           H        GLN  36  -7.878   8.221   4.057
  313    HA   GLN  36           HA       GLN  36  -8.815  10.395   5.843
  314    HB2  GLN  36          2HB       GLN  36  -6.370  10.564   5.342
  315    HB3  GLN  36          3HB       GLN  36  -6.724  10.591   3.624
  316    HG2  GLN  36          2HG       GLN  36  -7.929  12.711   3.878
  317    HG3  GLN  36          3HG       GLN  36  -7.662  12.672   5.620
  318   HE21  GLN  36          1HE2      GLN  36  -5.560  13.091   6.426
  319   HE22  GLN  36          2HE2      GLN  36  -4.372  13.888   5.454
  320    H    GLY  37           H        GLY  37 -10.952  10.107   5.126
  321    HA2  GLY  37          2HA       GLY  37 -12.782  10.838   3.982
  322    HA3  GLY  37          3HA       GLY  37 -11.710  11.841   3.023
  323    H    ASN  38           H        ASN  38 -10.749  10.913   1.123
  324    HA   ASN  38           HA       ASN  38 -12.352   8.757  -0.134
  325    HB2  ASN  38          2HB       ASN  38 -11.283  11.327  -1.376
  326    HB3  ASN  38          3HB       ASN  38 -11.956   9.998  -2.315
  327   HD21  ASN  38          1HD2      ASN  38 -13.627  11.227  -3.148
  328   HD22  ASN  38          2HD2      ASN  38 -14.952  11.802  -2.204
  329    H    THR  39           H        THR  39  -9.378   9.158   1.109
  330    HA   THR  39           HA       THR  39  -8.040   7.472  -0.917
  331    HB   THR  39           HB       THR  39  -6.785  10.022   0.212
  332    HG1  THR  39           HG1      THR  39  -8.237   9.491  -2.095
  333   HG21  THR  39          1HG2      THR  39  -5.693   8.044  -1.842
  334   HG22  THR  39          2HG2      THR  39  -5.079   8.266  -0.197
  335   HG23  THR  39          3HG2      THR  39  -4.938   9.566  -1.386
  336    H    ILE  40           H        ILE  40  -7.368   5.722   0.157
  337    HA   ILE  40           HA       ILE  40  -6.403   5.865   2.923
  338    HB   ILE  40           HB       ILE  40  -6.642   3.386   1.157
  339   HG12  ILE  40          2HG1      ILE  40  -8.612   4.533   3.170
  340   HG13  ILE  40          3HG1      ILE  40  -8.864   4.368   1.437
  341   HG21  ILE  40          1HG2      ILE  40  -6.332   3.647   4.176
  342   HG22  ILE  40          2HG2      ILE  40  -5.059   3.163   3.053
  343   HG23  ILE  40          3HG2      ILE  40  -6.476   2.136   3.276
  344   HD11  ILE  40          1HD1      ILE  40  -8.608   2.122   3.434
  345   HD12  ILE  40          2HD1      ILE  40  -8.807   1.931   1.688
  346   HD13  ILE  40          3HD1      ILE  40 -10.078   2.691   2.643
  347    H    ARG  41           H        ARG  41  -4.353   6.594   3.018
  348    HA   ARG  41           HA       ARG  41  -2.274   5.760   1.123
  349    HB2  ARG  41          2HB       ARG  41  -1.963   7.474   3.629
  350    HB3  ARG  41          3HB       ARG  41  -0.861   7.371   2.259
  351    HG2  ARG  41          2HG       ARG  41  -2.471   8.530   0.833
  352    HG3  ARG  41          3HG       ARG  41  -3.656   8.544   2.148
  353    HD2  ARG  41          2HD       ARG  41  -1.046  10.076   1.967
  354    HD3  ARG  41          3HD       ARG  41  -2.684  10.714   2.143
  355    HE   ARG  41           HE       ARG  41  -1.368   9.126   4.275
  356   HH11  ARG  41          1HH1      ARG  41  -3.099  12.075   3.351
  357   HH12  ARG  41          2HH1      ARG  41  -3.221  12.631   4.993
  358   HH21  ARG  41          1HH2      ARG  41  -1.513   9.887   6.370
  359   HH22  ARG  41          2HH2      ARG  41  -2.319  11.388   6.700
  360    H    VAL  42           H        VAL  42  -1.865   3.601   1.534
  361    HA   VAL  42           HA       VAL  42  -1.494   2.640   4.284
  362    HB   VAL  42           HB       VAL  42  -1.232   1.038   1.686
  363   HG11  VAL  42          1HG1      VAL  42  -1.563   0.081   4.558
  364   HG12  VAL  42          2HG1      VAL  42  -0.080  -0.010   3.604
  365   HG13  VAL  42          3HG1      VAL  42  -1.494  -0.953   3.124
  366   HG21  VAL  42          1HG2      VAL  42  -3.494   0.162   2.178
  367   HG22  VAL  42          2HG2      VAL  42  -3.507   1.897   1.852
  368   HG23  VAL  42          3HG2      VAL  42  -3.637   1.309   3.516
  369    H    GLU  43           H        GLU  43   0.440   3.056   5.141
  370    HA   GLU  43           HA       GLU  43   2.942   3.004   3.692
  371    HB2  GLU  43          2HB       GLU  43   2.330   2.938   6.686
  372    HB3  GLU  43          3HB       GLU  43   3.944   3.077   6.006
  373    HG2  GLU  43          2HG       GLU  43   3.199   5.247   6.774
  374    HG3  GLU  43          3HG       GLU  43   3.343   5.259   5.020
  375    H    LEU  44           H        LEU  44   4.035   1.153   3.204
  376    HA   LEU  44           HA       LEU  44   3.465  -1.314   4.756
  377    HB2  LEU  44          2HB       LEU  44   4.168  -1.282   1.792
  378    HB3  LEU  44          3HB       LEU  44   3.755  -2.667   2.781
  379    HG   LEU  44           HG       LEU  44   1.435  -1.264   3.066
  380   HD11  LEU  44          1HD1      LEU  44   2.138   0.607   1.672
  381   HD12  LEU  44          2HD1      LEU  44   0.765  -0.234   0.955
  382   HD13  LEU  44          3HD1      LEU  44   2.389  -0.479   0.302
  383   HD21  LEU  44          1HD2      LEU  44   1.582  -3.597   2.320
  384   HD22  LEU  44          2HD2      LEU  44   2.022  -3.060   0.698
  385   HD23  LEU  44          3HD2      LEU  44   0.425  -2.682   1.352
  386    H    GLU  45           H        GLU  45   5.229  -2.777   4.904
  387    HA   GLU  45           HA       GLU  45   7.859  -1.441   4.925
  388    HB2  GLU  45          2HB       GLU  45   6.913  -2.061   7.114
  389    HB3  GLU  45          3HB       GLU  45   6.699  -3.725   6.585
  390    HG2  GLU  45          2HG       GLU  45   9.101  -4.065   6.493
  391    HG3  GLU  45          3HG       GLU  45   9.398  -2.361   6.836
  392    H    LEU  46           H        LEU  46   8.857  -1.996   3.067
  393    HA   LEU  46           HA       LEU  46   8.715  -4.734   1.968
  394    HB2  LEU  46          2HB       LEU  46   8.085  -2.880   0.472
  395    HB3  LEU  46          3HB       LEU  46   9.614  -2.081   0.751
  396    HG   LEU  46           HG       LEU  46   9.611  -4.837  -0.520
  397   HD11  LEU  46          1HD1      LEU  46   7.960  -3.592  -1.838
  398   HD12  LEU  46          2HD1      LEU  46   9.432  -3.869  -2.765
  399   HD13  LEU  46          3HD1      LEU  46   9.115  -2.275  -2.070
  400   HD21  LEU  46          1HD2      LEU  46  11.630  -3.997  -1.657
  401   HD22  LEU  46          2HD2      LEU  46  11.779  -3.875   0.093
  402   HD23  LEU  46          3HD2      LEU  46  11.432  -2.432  -0.864
  403    H    ARG  47           H        ARG  47  10.488  -6.055   2.157
  404    HA   ARG  47           HA       ARG  47  13.038  -4.903   3.172
  405    HB2  ARG  47          2HB       ARG  47  11.669  -7.461   4.108
  406    HB3  ARG  47          3HB       ARG  47  13.237  -6.881   4.665
  407    HG2  ARG  47          2HG       ARG  47  12.209  -4.935   5.707
  408    HG3  ARG  47          3HG       ARG  47  10.627  -5.367   5.050
  409    HD2  ARG  47          2HD       ARG  47  10.749  -5.978   7.398
  410    HD3  ARG  47          3HD       ARG  47  10.655  -7.441   6.414
  411    HE   ARG  47           HE       ARG  47  13.351  -6.918   6.845
  412   HH11  ARG  47          1HH1      ARG  47  10.554  -7.752   8.832
  413   HH12  ARG  47          2HH1      ARG  47  11.508  -8.557  10.038
  414   HH21  ARG  47          1HH2      ARG  47  14.582  -7.999   8.436
  415   HH22  ARG  47          2HH2      ARG  47  13.782  -8.694   9.811
  416    H    THR  48           H        THR  48  14.377  -5.101   1.401
  417    HA   THR  48           HA       THR  48  14.449  -7.688  -0.077
  418    HB   THR  48           HB       THR  48  15.504  -5.004  -1.095
  419    HG1  THR  48           HG1      THR  48  13.515  -5.249  -2.477
  420   HG21  THR  48          1HG2      THR  48  16.490  -6.983  -2.212
  421   HG22  THR  48          2HG2      THR  48  15.425  -6.108  -3.312
  422   HG23  THR  48          3HG2      THR  48  14.870  -7.604  -2.560
  423    H    ASN  49           H        ASN  49  16.146  -8.917   0.496
  424    HA   ASN  49           HA       ASN  49  18.216  -9.685   0.908
  425    HB2  ASN  49          2HB       ASN  49  18.639  -8.424  -1.246
  426    HB3  ASN  49          3HB       ASN  49  19.196  -7.051  -0.303
  427   HD21  ASN  49          1HD2      ASN  49  19.866 -10.431  -1.088
  428   HD22  ASN  49          2HD2      ASN  49  21.561 -10.363  -0.759
  429    H    GLY  50           H        GLY  50  16.822  -8.003   2.951
  430    HA2  GLY  50          2HA       GLY  50  17.395  -7.921   5.243
  431    HA3  GLY  50          3HA       GLY  50  19.084  -7.699   4.829
  432    H    LYS  51           H        LYS  51  17.936  -5.528   2.768
  433    HA   LYS  51           HA       LYS  51  17.982  -3.303   4.650
  434    HB2  LYS  51          2HB       LYS  51  18.252  -1.858   2.839
  435    HB3  LYS  51          3HB       LYS  51  18.987  -3.316   2.216
  436    HG2  LYS  51          2HG       LYS  51  17.809  -2.602   0.368
  437    HG3  LYS  51          3HG       LYS  51  16.620  -3.684   1.090
  438    HD2  LYS  51          2HD       LYS  51  15.427  -1.749   2.061
  439    HD3  LYS  51          3HD       LYS  51  16.668  -0.651   1.457
  440    HE2  LYS  51          2HE       LYS  51  14.948  -2.375  -0.359
  441    HE3  LYS  51          3HE       LYS  51  14.540  -0.720   0.097
  442    HZ1  LYS  51          1HZ       LYS  51  16.473   0.095  -0.972
  443    HZ2  LYS  51          2HZ       LYS  51  15.738  -0.957  -2.068
  444    HZ3  LYS  51          3HZ       LYS  51  17.100  -1.448  -1.206
  445    H    LYS  52           H        LYS  52  16.234  -1.889   5.060
  446    HA   LYS  52           HA       LYS  52  13.527  -2.862   4.333
  447    HB2  LYS  52          2HB       LYS  52  13.978  -3.148   6.733
  448    HB3  LYS  52          3HB       LYS  52  14.454  -1.459   6.883
  449    HG2  LYS  52          2HG       LYS  52  12.140  -0.769   6.301
  450    HG3  LYS  52          3HG       LYS  52  11.670  -2.468   6.179
  451    HD2  LYS  52          2HD       LYS  52  12.666  -1.054   8.684
  452    HD3  LYS  52          3HD       LYS  52  10.995  -1.510   8.343
  453    HE2  LYS  52          2HE       LYS  52  11.826  -3.935   8.231
  454    HE3  LYS  52          3HE       LYS  52  13.344  -3.345   8.915
  455    HZ1  LYS  52          1HZ       LYS  52  11.955  -4.127  10.664
  456    HZ2  LYS  52          2HZ       LYS  52  10.651  -3.184  10.156
  457    HZ3  LYS  52          3HZ       LYS  52  12.033  -2.449  10.794
  458    H    GLU  53           H        GLU  53  12.234  -1.425   3.334
  459    HA   GLU  53           HA       GLU  53  12.644   1.444   3.643
  460    HB2  GLU  53          2HB       GLU  53  13.909   0.621   1.547
  461    HB3  GLU  53          3HB       GLU  53  12.337   0.277   0.841
  462    HG2  GLU  53          2HG       GLU  53  11.716   2.583   0.828
  463    HG3  GLU  53          3HG       GLU  53  13.041   3.029   1.906
  464    H    ASN  54           H        ASN  54  10.767   2.411   3.911
  465    HA   ASN  54           HA       ASN  54   8.281   0.895   3.807
  466    HB2  ASN  54          2HB       ASN  54   8.963   3.655   4.911
  467    HB3  ASN  54          3HB       ASN  54   7.363   2.931   4.997
  468   HD21  ASN  54          1HD2      ASN  54  10.335   1.027   5.539
  469   HD22  ASN  54          2HD2      ASN  54  10.070   0.814   7.227
  470    H    TYR  55           H        TYR  55   6.525   1.444   2.488
  471    HA   TYR  55           HA       TYR  55   6.861   3.640   0.526
  472    HB2  TYR  55          2HB       TYR  55   5.962   0.780  -0.052
  473    HB3  TYR  55          3HB       TYR  55   5.728   2.112  -1.174
  474    HD1  TYR  55           HD1      TYR  55   7.490   2.804  -2.641
  475    HD2  TYR  55           HD2      TYR  55   8.366   0.050   0.505
  476    HE1  TYR  55           HE1      TYR  55   9.673   2.342  -3.658
  477    HE2  TYR  55           HE2      TYR  55  10.571  -0.404  -0.496
  478    HH   TYR  55           HH       TYR  55  11.952   1.500  -2.840
  479    H    THR  56           H        THR  56   5.224   5.030   0.835
  480    HA   THR  56           HA       THR  56   2.609   4.214   1.806
  481    HB   THR  56           HB       THR  56   3.686   6.913   0.872
  482    HG1  THR  56           HG1      THR  56   2.967   6.174   3.518
  483   HG21  THR  56          1HG2      THR  56   1.005   6.315   2.186
  484   HG22  THR  56          2HG2      THR  56   1.247   6.889   0.532
  485   HG23  THR  56          3HG2      THR  56   1.670   7.922   1.899
  486    H    VAL  57           H        VAL  57   1.646   2.946   0.271
  487    HA   VAL  57           HA       VAL  57   1.396   3.881  -2.503
  488    HB   VAL  57           HB       VAL  57   0.341   1.307  -1.219
  489   HG11  VAL  57          1HG1      VAL  57   0.447   2.087  -4.163
  490   HG12  VAL  57          2HG1      VAL  57  -1.012   1.976  -3.176
  491   HG13  VAL  57          3HG1      VAL  57  -0.075   0.522  -3.528
  492   HG21  VAL  57          1HG2      VAL  57   2.768   1.690  -3.015
  493   HG22  VAL  57          2HG2      VAL  57   2.166   0.146  -2.403
  494   HG23  VAL  57          3HG2      VAL  57   2.810   1.349  -1.282
  495    H    GLU  58           H        GLU  58   0.001   5.492  -2.595
  496    HA   GLU  58           HA       GLU  58  -2.318   5.776  -0.901
  497    HB2  GLU  58          2HB       GLU  58  -1.456   7.382  -3.345
  498    HB3  GLU  58          3HB       GLU  58  -2.699   7.858  -2.186
  499    HG2  GLU  58          2HG       GLU  58  -0.949   7.979  -0.408
  500    HG3  GLU  58          3HG       GLU  58   0.268   7.548  -1.610
  501    H    VAL  59           H        VAL  59  -4.057   4.600  -1.321
  502    HA   VAL  59           HA       VAL  59  -4.912   4.040  -4.097
  503    HB   VAL  59           HB       VAL  59  -5.603   2.442  -1.584
  504   HG11  VAL  59          1HG1      VAL  59  -6.116   1.828  -4.510
  505   HG12  VAL  59          2HG1      VAL  59  -7.327   2.297  -3.313
  506   HG13  VAL  59          3HG1      VAL  59  -6.483   0.754  -3.155
  507   HG21  VAL  59          1HG2      VAL  59  -3.566   1.753  -3.744
  508   HG22  VAL  59          2HG2      VAL  59  -4.069   0.685  -2.429
  509   HG23  VAL  59          3HG2      VAL  59  -3.205   2.179  -2.065
  510    H    GLU  60           H        GLU  60  -6.729   5.049  -4.668
  511    HA   GLU  60           HA       GLU  60  -8.259   6.631  -2.725
  512    HB2  GLU  60          2HB       GLU  60  -7.122   7.795  -4.594
  513    HB3  GLU  60          3HB       GLU  60  -7.980   6.801  -5.760
  514    HG2  GLU  60          2HG       GLU  60 -10.138   7.833  -4.902
  515    HG3  GLU  60          3HG       GLU  60  -9.153   8.933  -3.941
  516    H    ARG  61           H        ARG  61 -10.478   6.452  -2.600
  517    HA   ARG  61           HA       ARG  61 -11.800   4.120  -3.658
  518    HB2  ARG  61          2HB       ARG  61 -12.208   5.041  -1.339
  519    HB3  ARG  61          3HB       ARG  61 -12.981   6.445  -2.071
  520    HG2  ARG  61          2HG       ARG  61 -14.638   4.806  -1.289
  521    HG3  ARG  61          3HG       ARG  61 -14.726   5.009  -3.039
  522    HD2  ARG  61          2HD       ARG  61 -13.579   2.921  -3.412
  523    HD3  ARG  61          3HD       ARG  61 -13.192   2.758  -1.696
  524    HE   ARG  61           HE       ARG  61 -15.971   2.906  -1.983
  525   HH11  ARG  61          1HH1      ARG  61 -13.390   0.658  -2.825
  526   HH12  ARG  61          2HH1      ARG  61 -14.419  -0.732  -2.726
  527   HH21  ARG  61          1HH2      ARG  61 -17.276   1.064  -1.760
  528   HH22  ARG  61          2HH2      ARG  61 -16.625  -0.505  -2.120
  529    H    GLN  62           H        GLN  62 -12.257   4.211  -5.750
  530    HA   GLN  62           HA       GLN  62 -13.461   6.614  -7.000
  531    HB2  GLN  62          2HB       GLN  62 -11.328   5.825  -8.006
  532    HB3  GLN  62          3HB       GLN  62 -12.007   4.223  -8.255
  533    HG2  GLN  62          2HG       GLN  62 -13.603   5.131  -9.878
  534    HG3  GLN  62          3HG       GLN  62 -12.998   6.764  -9.589
  535   HE21  GLN  62          1HE2      GLN  62 -10.965   7.350 -10.448
  536   HE22  GLN  62          2HE2      GLN  62 -10.159   6.390 -11.637
  537    H    GLY  63           H        GLY  63 -15.578   6.235  -6.325
  538    HA2  GLY  63          2HA       GLY  63 -17.720   5.407  -6.431
  539    HA3  GLY  63          3HA       GLY  63 -17.204   4.319  -7.712
  540    H    ASN  64           H        ASN  64 -17.063   2.202  -7.236
  541    HA   ASN  64           HA       ASN  64 -16.938   1.303  -4.410
  542    HB2  ASN  64          2HB       ASN  64 -19.041   0.733  -5.875
  543    HB3  ASN  64          3HB       ASN  64 -17.997  -0.427  -6.686
  544   HD21  ASN  64          1HD2      ASN  64 -20.373  -0.987  -5.176
  545   HD22  ASN  64          2HD2      ASN  64 -19.926  -2.024  -3.869
  546    H    THR  65           H        THR  65 -15.088   1.636  -7.177
  547    HA   THR  65           HA       THR  65 -13.410  -0.743  -6.644
  548    HB   THR  65           HB       THR  65 -12.150   0.005  -8.726
  549    HG1  THR  65           HG1      THR  65 -13.296   2.228  -8.487
  550   HG21  THR  65          1HG2      THR  65 -13.832  -1.783  -8.860
  551   HG22  THR  65          2HG2      THR  65 -13.850  -0.802 -10.324
  552   HG23  THR  65          3HG2      THR  65 -15.107  -0.584  -9.104
  553    H    TRP  66           H        TRP  66 -11.020  -0.282  -6.921
  554    HA   TRP  66           HA       TRP  66 -10.150   2.042  -5.302
  555    HB2  TRP  66          2HB       TRP  66  -9.091  -0.830  -5.327
  556    HB3  TRP  66          3HB       TRP  66  -8.338   0.499  -4.457
  557    HD1  TRP  66           HD1      TRP  66 -10.921  -2.155  -4.016
  558    HE1  TRP  66           HE1      TRP  66 -12.130  -1.851  -1.768
  559    HE3  TRP  66           HE3      TRP  66  -9.313   2.573  -2.849
  560    HZ2  TRP  66           HZ2      TRP  66 -12.384   0.118   0.219
  561    HZ3  TRP  66           HZ3      TRP  66 -10.099   3.597  -0.752
  562    HH2  TRP  66           HH2      TRP  66 -11.606   2.389   0.748
  563    H    THR  67           H        THR  67  -8.319   3.148  -6.044
  564    HA   THR  67           HA       THR  67  -6.917   2.151  -8.440
  565    HB   THR  67           HB       THR  67  -8.738   3.511  -9.346
  566    HG1  THR  67           HG1      THR  67  -6.553   3.599 -10.255
  567   HG21  THR  67          1HG2      THR  67  -7.647   5.854  -7.735
  568   HG22  THR  67          2HG2      THR  67  -9.180   5.029  -7.438
  569   HG23  THR  67          3HG2      THR  67  -8.937   5.938  -8.933
  570    H    VAL  68           H        VAL  68  -4.796   2.381  -8.234
  571    HA   VAL  68           HA       VAL  68  -3.646   3.634  -5.915
  572    HB   VAL  68           HB       VAL  68  -2.289   2.250  -8.277
  573   HG11  VAL  68          1HG1      VAL  68  -1.093   3.059  -5.599
  574   HG12  VAL  68          2HG1      VAL  68  -0.702   3.764  -7.170
  575   HG13  VAL  68          3HG1      VAL  68  -0.285   2.083  -6.828
  576   HG21  VAL  68          1HG2      VAL  68  -3.775   0.743  -7.020
  577   HG22  VAL  68          2HG2      VAL  68  -2.977   1.188  -5.508
  578   HG23  VAL  68          3HG2      VAL  68  -2.085   0.311  -6.755
  579    H    LYS  69           H        LYS  69  -3.340   5.741  -5.831
  580    HA   LYS  69           HA       LYS  69  -3.142   7.603  -7.934
  581    HB2  LYS  69          2HB       LYS  69  -2.160   7.902  -5.048
  582    HB3  LYS  69          3HB       LYS  69  -2.498   9.219  -6.165
  583    HG2  LYS  69          2HG       LYS  69  -4.536   7.285  -5.024
  584    HG3  LYS  69          3HG       LYS  69  -4.289   8.954  -4.506
  585    HD2  LYS  69          2HD       LYS  69  -5.199   8.096  -7.281
  586    HD3  LYS  69          3HD       LYS  69  -6.251   8.683  -5.997
  587    HE2  LYS  69          2HE       LYS  69  -5.052  10.854  -6.022
  588    HE3  LYS  69          3HE       LYS  69  -4.052  10.267  -7.356
  589    HZ1  LYS  69          1HZ       LYS  69  -7.008  10.528  -7.429
  590    HZ2  LYS  69          2HZ       LYS  69  -6.017  10.047  -8.707
  591    HZ3  LYS  69          3HZ       LYS  69  -5.917  11.622  -8.117
  592    H    ARG  70           H        ARG  70  -0.686   6.288  -5.730
  593    HA   ARG  70           HA       ARG  70   1.285   5.912  -7.729
  594    HB2  ARG  70          2HB       ARG  70   2.951   7.545  -7.181
  595    HB3  ARG  70          3HB       ARG  70   1.456   8.449  -7.372
  596    HG2  ARG  70          2HG       ARG  70   1.214   8.574  -4.906
  597    HG3  ARG  70          3HG       ARG  70   2.711   7.658  -4.717
  598    HD2  ARG  70          2HD       ARG  70   3.210   9.989  -4.378
  599    HD3  ARG  70          3HD       ARG  70   3.924   9.497  -5.918
  600    HE   ARG  70           HE       ARG  70   1.309  10.590  -6.242
  601   HH11  ARG  70          1HH1      ARG  70   4.684  11.547  -5.834
  602   HH12  ARG  70          2HH1      ARG  70   4.454  13.095  -6.582
  603   HH21  ARG  70          1HH2      ARG  70   1.020  12.630  -7.177
  604   HH22  ARG  70          2HH2      ARG  70   2.371  13.704  -7.341
  605    H    ILE  71           H        ILE  71   3.255   5.014  -6.845
  606    HA   ILE  71           HA       ILE  71   3.111   3.991  -4.080
  607    HB   ILE  71           HB       ILE  71   5.016   3.270  -6.363
  608   HG12  ILE  71          2HG1      ILE  71   2.726   1.638  -5.166
  609   HG13  ILE  71          3HG1      ILE  71   2.686   2.448  -6.728
  610   HG21  ILE  71          1HG2      ILE  71   5.822   1.453  -4.898
  611   HG22  ILE  71          2HG2      ILE  71   4.792   2.043  -3.592
  612   HG23  ILE  71          3HG2      ILE  71   6.124   3.040  -4.184
  613   HD11  ILE  71          1HD1      ILE  71   4.615   0.996  -7.422
  614   HD12  ILE  71          2HD1      ILE  71   3.088   0.173  -7.134
  615   HD13  ILE  71          3HD1      ILE  71   4.368   0.087  -5.924
  616    H    THR  72           H        THR  72   3.917   5.510  -2.726
  617    HA   THR  72           HA       THR  72   6.060   7.341  -3.515
  618    HB   THR  72           HB       THR  72   4.535   7.255  -0.864
  619    HG1  THR  72           HG1      THR  72   2.961   7.593  -2.354
  620   HG21  THR  72          1HG2      THR  72   5.155   9.647  -0.720
  621   HG22  THR  72          2HG2      THR  72   6.048   9.518  -2.235
  622   HG23  THR  72          3HG2      THR  72   6.593   8.624  -0.813
  623    H    ARG  73           H        ARG  73   8.081   6.506  -3.238
  624    HA   ARG  73           HA       ARG  73   8.903   4.657  -1.227
  625    HB2  ARG  73          2HB       ARG  73  10.217   5.001  -3.289
  626    HB3  ARG  73          3HB       ARG  73  10.498   6.690  -2.869
  627    HG2  ARG  73          2HG       ARG  73  11.793   5.929  -0.866
  628    HG3  ARG  73          3HG       ARG  73  11.569   4.257  -1.392
  629    HD2  ARG  73          2HD       ARG  73  13.030   6.434  -2.924
  630    HD3  ARG  73          3HD       ARG  73  13.780   5.104  -2.038
  631    HE   ARG  73           HE       ARG  73  12.037   4.707  -4.402
  632   HH11  ARG  73          1HH1      ARG  73  14.960   3.896  -2.625
  633   HH12  ARG  73          2HH1      ARG  73  15.457   2.686  -3.763
  634   HH21  ARG  73          1HH2      ARG  73  12.673   3.090  -5.856
  635   HH22  ARG  73          2HH2      ARG  73  14.154   2.231  -5.598
  636    H    THR  74           H        THR  74   9.712   5.059   0.879
  637    HA   THR  74           HA       THR  74   9.144   7.522   2.164
  638    HB   THR  74           HB       THR  74   9.305   5.409   3.463
  639    HG1  THR  74           HG1      THR  74   9.718   7.586   4.401
  640   HG21  THR  74          1HG2      THR  74  12.313   5.613   3.043
  641   HG22  THR  74          2HG2      THR  74  11.262   4.357   2.390
  642   HG23  THR  74          3HG2      THR  74  11.497   4.485   4.132
  643    H    VAL  75           H        VAL  75  10.423   9.228   2.639
  644    HA   VAL  75           HA       VAL  75  13.054   9.425   1.321
  645    HB   VAL  75           HB       VAL  75  11.243  10.607   0.064
  646   HG11  VAL  75          1HG1      VAL  75  10.207  12.663   0.910
  647   HG12  VAL  75          2HG1      VAL  75  10.964  12.412   2.485
  648   HG13  VAL  75          3HG1      VAL  75   9.760  11.265   1.895
  649   HG21  VAL  75          1HG2      VAL  75  13.545  11.375  -0.137
  650   HG22  VAL  75          2HG2      VAL  75  13.331  12.452   1.242
  651   HG23  VAL  75          3HG2      VAL  75  12.426  12.736  -0.244
  652    H    GLY  76           H        GLY  76  14.641  10.249   2.550
  653    HA2  GLY  76          2HA       GLY  76  14.263  11.797   4.979
  654    HA3  GLY  76          3HA       GLY  76  14.758  10.126   5.268
  655    H    SER  77           H        SER  77  15.789  13.247   4.378
  656    HA   SER  77           HA       SER  77  17.675  14.229   3.619
  657    HB2  SER  77          2HB       SER  77  19.066  11.716   4.658
  658    HB3  SER  77          3HB       SER  77  19.844  13.267   4.323
  659    HG   SER  77           HG       SER  77  18.155  14.078   5.908
  660    H    LEU  78           H        LEU  78  16.123  12.446   1.856
  661    HA   LEU  78           HA       LEU  78  18.129  11.579  -0.145
  662    HB2  LEU  78          2HB       LEU  78  16.534   9.870   0.918
  663    HB3  LEU  78          3HB       LEU  78  15.220  10.676   0.092
  664    HG   LEU  78           HG       LEU  78  17.560   9.389  -1.393
  665   HD11  LEU  78          1HD1      LEU  78  16.144   7.423  -1.775
  666   HD12  LEU  78          2HD1      LEU  78  14.882   8.106  -0.747
  667   HD13  LEU  78          3HD1      LEU  78  16.443   7.660  -0.052
  668   HD21  LEU  78          1HD2      LEU  78  16.287  11.005  -2.741
  669   HD22  LEU  78          2HD2      LEU  78  14.790  10.143  -2.385
  670   HD23  LEU  78          3HD2      LEU  78  16.058   9.358  -3.331
  671    H    GLU  79           H        GLU  79  18.146  12.659  -2.032
  672    HA   GLU  79           HA       GLU  79  16.558  14.998  -2.429
  673    HB2  GLU  79          2HB       GLU  79  18.937  14.816  -3.191
  674    HB3  GLU  79          3HB       GLU  79  18.448  13.619  -4.383
  675    HG2  GLU  79          2HG       GLU  79  16.938  15.374  -5.406
  676    HG3  GLU  79          3HG       GLU  79  17.658  16.556  -4.314
  677    H    HIS  80           H        HIS  80  14.423  14.318  -2.570
  678    HA   HIS  80           HA       HIS  80  13.460  12.602  -4.686
  679    HB2  HIS  80          2HB       HIS  80  11.176  13.596  -4.037
  680    HB3  HIS  80          3HB       HIS  80  12.015  12.694  -2.786
  681    HD1  HIS  80           HD1      HIS  80  13.157  14.156  -0.867
  682    HD2  HIS  80           HD2      HIS  80  10.522  16.205  -3.338
  683    HE1  HIS  80           HE1      HIS  80  12.546  16.236   0.383
  684    HE2  HIS  80           HE2      HIS  80  11.066  17.524  -1.189
  685    H    HIS  81           H        HIS  81  14.454  13.382  -6.480
  686    HA   HIS  81           HA       HIS  81  14.829  16.089  -7.159
  687    HB2  HIS  81          2HB       HIS  81  16.263  14.143  -7.926
  688    HB3  HIS  81          3HB       HIS  81  14.973  13.673  -9.029
  689    HD1  HIS  81           HD1      HIS  81  17.754  16.112  -8.590
  690    HD2  HIS  81           HD2      HIS  81  14.709  15.385 -11.319
  691    HE1  HIS  81           HE1      HIS  81  18.305  17.506 -10.596
  692    HE2  HIS  81           HE2      HIS  81  16.501  16.986 -12.266
  693    H    HIS  82           H        HIS  82  13.461  17.482  -7.995
  694    HA   HIS  82           HA       HIS  82  10.726  16.881  -8.462
  695    HB2  HIS  82          2HB       HIS  82  12.264  19.478  -8.889
  696    HB3  HIS  82          3HB       HIS  82  10.506  19.330  -8.870
  697    HD1  HIS  82           HD1      HIS  82  13.374  19.872  -6.676
  698    HD2  HIS  82           HD2      HIS  82   9.470  18.512  -6.261
  699    HE1  HIS  82           HE1      HIS  82  12.873  20.013  -4.223
  700    HE2  HIS  82           HE2      HIS  82  10.503  19.195  -4.004
  701    H    HIS  83           H        HIS  83  10.289  15.702 -10.229
  702    HA   HIS  83           HA       HIS  83  10.945  16.835 -12.901
  703    HB2  HIS  83          2HB       HIS  83  11.942  14.566 -12.472
  704    HB3  HIS  83          3HB       HIS  83  10.333  13.922 -12.181
  705    HD1  HIS  83           HD1      HIS  83   9.517  12.676 -14.147
  706    HD2  HIS  83           HD2      HIS  83  11.942  15.842 -15.296
  707    HE1  HIS  83           HE1      HIS  83   9.708  12.506 -16.637
  708    HE2  HIS  83           HE2      HIS  83  11.045  14.521 -17.319
  709    H    HIS  84           H        HIS  84   9.205  17.581 -13.990
  710    HA   HIS  84           HA       HIS  84   6.676  17.766 -12.699
  711    HB2  HIS  84          2HB       HIS  84   7.648  19.566 -14.162
  712    HB3  HIS  84          3HB       HIS  84   7.380  18.544 -15.573
  713    HD1  HIS  84           HD1      HIS  84   5.700  20.946 -13.322
  714    HD2  HIS  84           HD2      HIS  84   4.533  18.191 -16.213
  715    HE1  HIS  84           HE1      HIS  84   3.325  21.516 -13.885
  716    HE2  HIS  84           HE2      HIS  84   2.627  19.814 -15.602
  717    H    HIS  85           H        HIS  85   4.807  16.731 -13.033
  718    HA   HIS  85           HA       HIS  85   4.437  14.805 -15.224
  719    HB2  HIS  85          2HB       HIS  85   3.562  13.079 -13.705
  720    HB3  HIS  85          3HB       HIS  85   5.214  13.476 -13.273
  721    HD1  HIS  85           HD1      HIS  85   1.924  13.075 -11.858
  722    HD2  HIS  85           HD2      HIS  85   5.347  15.207 -10.870
  723    HE1  HIS  85           HE1      HIS  85   1.655  13.693  -9.451
  724    HE2  HIS  85           HE2      HIS  85   3.604  15.211  -8.973
  Start of MODEL   14
    1    H1   MET   1          1H        MET   1 -25.215  -4.564   4.425
    2    H2   MET   1          2H        MET   1 -25.152  -4.879   6.083
    3    H3   MET   1          3H        MET   1 -25.613  -6.100   5.012
    4    HA   MET   1           HA       MET   1 -23.381  -6.456   5.757
    5    HB2  MET   1          2HB       MET   1 -24.003  -7.155   3.471
    6    HB3  MET   1          3HB       MET   1 -23.586  -5.569   2.844
    7    HG2  MET   1          2HG       MET   1 -21.228  -5.957   3.372
    8    HG3  MET   1          3HG       MET   1 -21.629  -7.516   4.094
    9    HE1  MET   1          1HE       MET   1 -23.910  -8.536   1.926
   10    HE2  MET   1          2HE       MET   1 -22.684  -9.558   2.682
   11    HE3  MET   1          3HE       MET   1 -22.858  -9.542   0.927
   12    HA   PRO   2           HA       PRO   2 -21.130  -2.478   6.232
   13    HB2  PRO   2          2HB       PRO   2 -19.634  -3.151   8.388
   14    HB3  PRO   2          3HB       PRO   2 -21.359  -2.771   8.554
   15    HG2  PRO   2          2HG       PRO   2 -20.007  -5.437   8.581
   16    HG3  PRO   2          3HG       PRO   2 -21.407  -4.867   9.514
   17    HD2  PRO   2          2HD       PRO   2 -21.543  -6.427   7.179
   18    HD3  PRO   2          3HD       PRO   2 -22.884  -5.510   7.895
   19    H    SER   3           H        SER   3 -19.665  -2.242   4.652
   20    HA   SER   3           HA       SER   3 -17.589  -4.287   4.123
   21    HB2  SER   3          2HB       SER   3 -17.407  -3.144   1.907
   22    HB3  SER   3          3HB       SER   3 -19.038  -3.725   2.234
   23    HG   SER   3           HG       SER   3 -19.362  -1.464   3.082
   24    H    GLU   4           H        GLU   4 -17.715  -1.818   6.097
   25    HA   GLU   4           HA       GLU   4 -15.874   0.144   5.305
   26    HB2  GLU   4          2HB       GLU   4 -17.516   0.475   7.104
   27    HB3  GLU   4          3HB       GLU   4 -16.714  -0.736   8.097
   28    HG2  GLU   4          2HG       GLU   4 -14.707   0.711   8.226
   29    HG3  GLU   4          3HG       GLU   4 -15.523   1.932   7.249
   30    H    GLU   5           H        GLU   5 -15.426  -2.639   7.498
   31    HA   GLU   5           HA       GLU   5 -12.629  -2.217   7.873
   32    HB2  GLU   5          2HB       GLU   5 -14.150  -3.421   9.489
   33    HB3  GLU   5          3HB       GLU   5 -14.219  -4.771   8.359
   34    HG2  GLU   5          2HG       GLU   5 -12.616  -5.121  10.233
   35    HG3  GLU   5          3HG       GLU   5 -11.859  -5.218   8.644
   36    H    GLU   6           H        GLU   6 -14.556  -3.953   5.571
   37    HA   GLU   6           HA       GLU   6 -12.589  -5.630   4.425
   38    HB2  GLU   6          2HB       GLU   6 -15.038  -5.976   4.198
   39    HB3  GLU   6          3HB       GLU   6 -15.148  -4.544   3.176
   40    HG2  GLU   6          2HG       GLU   6 -13.764  -5.607   1.476
   41    HG3  GLU   6          3HG       GLU   6 -13.502  -7.008   2.517
   42    H    GLU   7           H        GLU   7 -13.478  -2.256   3.913
   43    HA   GLU   7           HA       GLU   7 -12.154  -1.676   1.511
   44    HB2  GLU   7          2HB       GLU   7 -12.413   0.095   3.979
   45    HB3  GLU   7          3HB       GLU   7 -11.918   0.660   2.383
   46    HG2  GLU   7          2HG       GLU   7 -14.128  -0.046   1.480
   47    HG3  GLU   7          3HG       GLU   7 -14.617  -0.511   3.112
   48    H    LYS   8           H        LYS   8 -10.932  -1.800   4.828
   49    HA   LYS   8           HA       LYS   8  -8.237  -1.068   4.295
   50    HB2  LYS   8          2HB       LYS   8  -9.361  -2.736   6.598
   51    HB3  LYS   8          3HB       LYS   8  -7.706  -2.154   6.511
   52    HG2  LYS   8          2HG       LYS   8  -8.851  -0.716   8.018
   53    HG3  LYS   8          3HG       LYS   8  -8.623   0.215   6.539
   54    HD2  LYS   8          2HD       LYS   8 -10.926   0.043   5.949
   55    HD3  LYS   8          3HD       LYS   8 -11.206  -1.271   7.091
   56    HE2  LYS   8          2HE       LYS   8 -10.594   1.603   7.858
   57    HE3  LYS   8          3HE       LYS   8 -12.198   0.864   7.851
   58    HZ1  LYS   8          1HZ       LYS   8  -9.899   0.074   9.554
   59    HZ2  LYS   8          2HZ       LYS   8 -11.375  -0.749   9.499
   60    HZ3  LYS   8          3HZ       LYS   8 -11.317   0.845  10.060
   61    H    ARG   9           H        ARG   9  -9.933  -4.206   4.539
   62    HA   ARG   9           HA       ARG   9  -7.747  -5.957   4.264
   63    HB2  ARG   9          2HB       ARG   9 -10.622  -6.454   3.369
   64    HB3  ARG   9          3HB       ARG   9  -9.398  -7.698   3.621
   65    HG2  ARG   9          2HG       ARG   9  -9.259  -6.902   6.039
   66    HG3  ARG   9          3HG       ARG   9 -10.691  -5.928   5.710
   67    HD2  ARG   9          2HD       ARG   9 -10.522  -8.944   5.432
   68    HD3  ARG   9          3HD       ARG   9 -11.218  -8.094   6.805
   69    HE   ARG   9           HE       ARG   9 -12.365  -7.754   4.098
   70   HH11  ARG   9          1HH1      ARG   9 -12.760  -8.799   7.424
   71   HH12  ARG   9          2HH1      ARG   9 -14.474  -9.030   7.288
   72   HH21  ARG   9          1HH2      ARG   9 -14.634  -8.132   3.911
   73   HH22  ARG   9          2HH2      ARG   9 -15.531  -8.651   5.299
   74    H    GLN  10           H        GLN  10  -9.759  -4.426   1.827
   75    HA   GLN  10           HA       GLN  10  -8.695  -5.679  -0.497
   76    HB2  GLN  10          2HB       GLN  10 -10.194  -3.047  -0.132
   77    HB3  GLN  10          3HB       GLN  10  -9.758  -3.710  -1.706
   78    HG2  GLN  10          2HG       GLN  10 -11.197  -5.607  -1.418
   79    HG3  GLN  10          3HG       GLN  10 -11.480  -5.215   0.283
   80   HE21  GLN  10          1HE2      GLN  10 -12.854  -3.489   0.793
   81   HE22  GLN  10          2HE2      GLN  10 -13.946  -2.817  -0.351
   82    H    VAL  11           H        VAL  11  -8.113  -2.487   1.000
   83    HA   VAL  11           HA       VAL  11  -6.295  -1.573  -0.966
   84    HB   VAL  11           HB       VAL  11  -6.909  -0.552   1.843
   85   HG11  VAL  11          1HG1      VAL  11  -5.771   1.560   1.223
   86   HG12  VAL  11          2HG1      VAL  11  -5.206   0.819  -0.274
   87   HG13  VAL  11          3HG1      VAL  11  -4.640   0.210   1.278
   88   HG21  VAL  11          1HG2      VAL  11  -7.723   0.424  -0.921
   89   HG22  VAL  11          2HG2      VAL  11  -8.133   1.211   0.600
   90   HG23  VAL  11          3HG2      VAL  11  -8.759  -0.396   0.253
   91    H    LYS  12           H        LYS  12  -5.749  -3.194   2.155
   92    HA   LYS  12           HA       LYS  12  -2.915  -2.900   2.256
   93    HB2  LYS  12          2HB       LYS  12  -4.663  -5.114   3.410
   94    HB3  LYS  12          3HB       LYS  12  -2.955  -4.903   3.782
   95    HG2  LYS  12          2HG       LYS  12  -3.454  -2.723   4.821
   96    HG3  LYS  12          3HG       LYS  12  -5.164  -2.940   4.450
   97    HD2  LYS  12          2HD       LYS  12  -3.557  -4.839   6.209
   98    HD3  LYS  12          3HD       LYS  12  -4.508  -3.497   6.836
   99    HE2  LYS  12          2HE       LYS  12  -5.797  -5.504   7.096
  100    HE3  LYS  12          3HE       LYS  12  -6.552  -4.553   5.823
  101    HZ1  LYS  12          1HZ       LYS  12  -6.434  -6.934   5.328
  102    HZ2  LYS  12          2HZ       LYS  12  -4.750  -6.872   5.372
  103    HZ3  LYS  12          3HZ       LYS  12  -5.594  -6.020   4.185
  104    H    GLN  13           H        GLN  13  -5.066  -5.381   0.892
  105    HA   GLN  13           HA       GLN  13  -3.049  -7.193   0.053
  106    HB2  GLN  13          2HB       GLN  13  -5.425  -7.867   0.343
  107    HB3  GLN  13          3HB       GLN  13  -5.888  -6.857  -1.024
  108    HG2  GLN  13          2HG       GLN  13  -4.491  -8.264  -2.521
  109    HG3  GLN  13          3HG       GLN  13  -4.066  -9.288  -1.149
  110   HE21  GLN  13          1HE2      GLN  13  -7.307  -7.946  -1.757
  111   HE22  GLN  13          2HE2      GLN  13  -8.054  -9.465  -2.084
  112    H    VAL  14           H        VAL  14  -4.873  -4.684  -1.709
  113    HA   VAL  14           HA       VAL  14  -3.670  -4.958  -4.223
  114    HB   VAL  14           HB       VAL  14  -4.878  -2.455  -2.931
  115   HG11  VAL  14          1HG1      VAL  14  -5.093  -1.529  -5.224
  116   HG12  VAL  14          2HG1      VAL  14  -4.199  -2.909  -5.868
  117   HG13  VAL  14          3HG1      VAL  14  -3.403  -1.773  -4.779
  118   HG21  VAL  14          1HG2      VAL  14  -6.483  -4.312  -3.167
  119   HG22  VAL  14          2HG2      VAL  14  -6.104  -4.449  -4.885
  120   HG23  VAL  14          3HG2      VAL  14  -6.888  -2.993  -4.266
  121    H    ALA  15           H        ALA  15  -2.799  -2.961  -1.424
  122    HA   ALA  15           HA       ALA  15  -0.667  -1.497  -2.515
  123    HB1  ALA  15          1HB       ALA  15  -0.050  -1.032  -0.199
  124    HB2  ALA  15          2HB       ALA  15  -1.085  -2.350   0.364
  125    HB3  ALA  15          3HB       ALA  15  -1.797  -0.933  -0.411
  126    H    LYS  16           H        LYS  16  -0.609  -4.482  -0.549
  127    HA   LYS  16           HA       LYS  16   2.192  -4.807  -0.574
  128    HB2  LYS  16          2HB       LYS  16   1.854  -7.011   0.375
  129    HB3  LYS  16          3HB       LYS  16   0.724  -5.888   1.106
  130    HG2  LYS  16          2HG       LYS  16  -1.088  -6.796  -0.261
  131    HG3  LYS  16          3HG       LYS  16   0.034  -7.903  -1.044
  132    HD2  LYS  16          2HD       LYS  16  -0.514  -7.907   1.955
  133    HD3  LYS  16          3HD       LYS  16  -1.377  -8.930   0.804
  134    HE2  LYS  16          2HE       LYS  16   1.630  -8.973   1.231
  135    HE3  LYS  16          3HE       LYS  16   0.494 -10.112   1.952
  136    HZ1  LYS  16          1HZ       LYS  16   1.526 -11.001  -0.042
  137    HZ2  LYS  16          2HZ       LYS  16   0.902  -9.732  -0.972
  138    HZ3  LYS  16          3HZ       LYS  16  -0.142 -10.840  -0.243
  139    H    GLU  17           H        GLU  17  -0.355  -6.036  -2.722
  140    HA   GLU  17           HA       GLU  17   1.308  -7.718  -4.284
  141    HB2  GLU  17          2HB       GLU  17  -1.337  -6.397  -5.023
  142    HB3  GLU  17          3HB       GLU  17  -0.515  -7.594  -6.019
  143    HG2  GLU  17          2HG       GLU  17  -1.753  -8.003  -3.296
  144    HG3  GLU  17          3HG       GLU  17  -2.259  -8.700  -4.822
  145    H    LYS  18           H        LYS  18   0.381  -4.300  -4.583
  146    HA   LYS  18           HA       LYS  18   1.520  -3.791  -7.132
  147    HB2  LYS  18          2HB       LYS  18   0.902  -1.896  -4.829
  148    HB3  LYS  18          3HB       LYS  18   1.495  -1.345  -6.389
  149    HG2  LYS  18          2HG       LYS  18  -1.133  -2.760  -5.880
  150    HG3  LYS  18          3HG       LYS  18  -0.919  -1.045  -6.220
  151    HD2  LYS  18          2HD       LYS  18  -0.017  -1.645  -8.475
  152    HD3  LYS  18          3HD       LYS  18  -0.323  -3.347  -8.118
  153    HE2  LYS  18          2HE       LYS  18  -2.747  -2.868  -7.917
  154    HE3  LYS  18          3HE       LYS  18  -2.437  -1.165  -8.274
  155    HZ1  LYS  18          1HZ       LYS  18  -1.854  -3.438 -10.093
  156    HZ2  LYS  18          2HZ       LYS  18  -1.591  -1.804 -10.438
  157    HZ3  LYS  18          3HZ       LYS  18  -3.166  -2.386 -10.231
  158    H    LEU  19           H        LEU  19   2.824  -3.672  -3.865
  159    HA   LEU  19           HA       LEU  19   5.426  -2.679  -4.596
  160    HB2  LEU  19          2HB       LEU  19   4.345  -3.985  -2.076
  161    HB3  LEU  19          3HB       LEU  19   6.006  -3.432  -2.224
  162    HG   LEU  19           HG       LEU  19   3.518  -1.688  -2.361
  163   HD11  LEU  19          1HD1      LEU  19   4.078  -2.382  -0.084
  164   HD12  LEU  19          2HD1      LEU  19   4.376  -0.661  -0.302
  165   HD13  LEU  19          3HD1      LEU  19   5.730  -1.795  -0.288
  166   HD21  LEU  19          1HD2      LEU  19   5.065   0.236  -2.532
  167   HD22  LEU  19          2HD2      LEU  19   5.169  -0.822  -3.935
  168   HD23  LEU  19          3HD2      LEU  19   6.427  -0.877  -2.696
  169    H    LEU  20           H        LEU  20   3.976  -5.850  -4.270
  170    HA   LEU  20           HA       LEU  20   6.387  -7.374  -4.563
  171    HB2  LEU  20          2HB       LEU  20   3.447  -8.086  -4.842
  172    HB3  LEU  20          3HB       LEU  20   4.722  -9.270  -5.096
  173    HG   LEU  20           HG       LEU  20   4.379  -7.736  -2.485
  174   HD11  LEU  20          1HD1      LEU  20   2.374  -9.091  -2.854
  175   HD12  LEU  20          2HD1      LEU  20   3.338  -9.734  -1.528
  176   HD13  LEU  20          3HD1      LEU  20   3.371 -10.528  -3.105
  177   HD21  LEU  20          1HD2      LEU  20   6.003 -10.216  -3.127
  178   HD22  LEU  20          2HD2      LEU  20   5.847  -9.461  -1.537
  179   HD23  LEU  20          3HD2      LEU  20   6.640  -8.593  -2.847
  180    H    GLU  21           H        GLU  21   4.105  -5.901  -6.829
  181    HA   GLU  21           HA       GLU  21   4.845  -7.159  -9.250
  182    HB2  GLU  21          2HB       GLU  21   4.147  -4.196  -8.910
  183    HB3  GLU  21          3HB       GLU  21   4.087  -5.101 -10.416
  184    HG2  GLU  21          2HG       GLU  21   2.284  -5.434  -8.019
  185    HG3  GLU  21          3HG       GLU  21   1.859  -4.693  -9.549
  186    H    GLN  22           H        GLN  22   6.318  -4.630  -7.363
  187    HA   GLN  22           HA       GLN  22   8.363  -3.953  -9.346
  188    HB2  GLN  22          2HB       GLN  22   7.811  -2.801  -6.576
  189    HB3  GLN  22          3HB       GLN  22   8.904  -2.123  -7.783
  190    HG2  GLN  22          2HG       GLN  22   7.031  -1.604  -9.263
  191    HG3  GLN  22          3HG       GLN  22   5.907  -2.422  -8.172
  192   HE21  GLN  22          1HE2      GLN  22   5.355  -1.407  -6.199
  193   HE22  GLN  22          2HE2      GLN  22   5.620   0.279  -5.934
  194    H    SER  23           H        SER  23   8.020  -5.717  -6.324
  195    HA   SER  23           HA       SER  23  10.781  -6.632  -6.433
  196    HB2  SER  23          2HB       SER  23  10.803  -4.508  -5.068
  197    HB3  SER  23          3HB       SER  23   9.737  -5.291  -3.901
  198    HG   SER  23           HG       SER  23  11.557  -5.923  -3.056
  199    HA   PRO  24           HA       PRO  24   7.918 -10.064  -5.130
  200    HB2  PRO  24          2HB       PRO  24   9.025 -12.009  -6.696
  201    HB3  PRO  24          3HB       PRO  24   7.887 -10.811  -7.341
  202    HG2  PRO  24          2HG       PRO  24  10.882 -10.833  -7.513
  203    HG3  PRO  24          3HG       PRO  24   9.686 -10.479  -8.782
  204    HD2  PRO  24          2HD       PRO  24  11.001  -8.516  -7.407
  205    HD3  PRO  24          3HD       PRO  24   9.362  -8.304  -8.060
  206    H    ASN  25           H        ASN  25  11.367  -9.682  -5.081
  207    HA   ASN  25           HA       ASN  25  12.009 -12.111  -3.661
  208    HB2  ASN  25          2HB       ASN  25  13.692  -9.638  -4.233
  209    HB3  ASN  25          3HB       ASN  25  14.307 -11.148  -3.567
  210   HD21  ASN  25          1HD2      ASN  25  12.747 -12.905  -5.280
  211   HD22  ASN  25          2HD2      ASN  25  13.406 -12.759  -6.867
  212    H    SER  26           H        SER  26  10.813  -9.070  -2.739
  213    HA   SER  26           HA       SER  26  11.723  -9.326   0.064
  214    HB2  SER  26          2HB       SER  26  10.868  -6.968   0.268
  215    HB3  SER  26          3HB       SER  26  12.158  -7.140  -0.924
  216    HG   SER  26           HG       SER  26   9.472  -7.346  -1.750
  217    H    LYS  27           H        LYS  27  10.270  -9.937   1.597
  218    HA   LYS  27           HA       LYS  27   7.469 -10.316   1.097
  219    HB2  LYS  27          2HB       LYS  27   8.690 -11.679   2.757
  220    HB3  LYS  27          3HB       LYS  27   9.054 -10.240   3.707
  221    HG2  LYS  27          2HG       LYS  27   6.635  -9.915   4.140
  222    HG3  LYS  27          3HG       LYS  27   6.269 -11.360   3.193
  223    HD2  LYS  27          2HD       LYS  27   7.862 -11.252   5.786
  224    HD3  LYS  27          3HD       LYS  27   6.217 -11.861   5.602
  225    HE2  LYS  27          2HE       LYS  27   8.733 -13.064   4.400
  226    HE3  LYS  27          3HE       LYS  27   7.785 -13.722   5.730
  227    HZ1  LYS  27          1HZ       LYS  27   5.941 -14.045   4.236
  228    HZ2  LYS  27          2HZ       LYS  27   7.309 -14.835   3.641
  229    HZ3  LYS  27          3HZ       LYS  27   6.810 -13.377   2.949
  230    H    VAL  28           H        VAL  28   5.925  -8.775   1.231
  231    HA   VAL  28           HA       VAL  28   6.621  -6.107   2.289
  232    HB   VAL  28           HB       VAL  28   4.283  -6.907   0.480
  233   HG11  VAL  28          1HG1      VAL  28   5.288  -4.161   1.337
  234   HG12  VAL  28          2HG1      VAL  28   3.774  -4.923   1.830
  235   HG13  VAL  28          3HG1      VAL  28   4.016  -4.458   0.148
  236   HG21  VAL  28          1HG2      VAL  28   6.468  -7.166  -0.664
  237   HG22  VAL  28          2HG2      VAL  28   6.896  -5.507  -0.246
  238   HG23  VAL  28          3HG2      VAL  28   5.552  -5.822  -1.348
  239    H    GLN  29           H        GLN  29   6.024  -5.786   4.299
  240    HA   GLN  29           HA       GLN  29   3.757  -7.177   5.564
  241    HB2  GLN  29          2HB       GLN  29   6.114  -5.591   6.707
  242    HB3  GLN  29          3HB       GLN  29   4.856  -6.326   7.691
  243    HG2  GLN  29          2HG       GLN  29   6.751  -7.840   5.878
  244    HG3  GLN  29          3HG       GLN  29   6.956  -7.640   7.619
  245   HE21  GLN  29          1HE2      GLN  29   5.520  -8.725   9.017
  246   HE22  GLN  29          2HE2      GLN  29   4.573 -10.072   8.494
  247    H    VAL  30           H        VAL  30   1.867  -6.011   5.774
  248    HA   VAL  30           HA       VAL  30   1.654  -3.217   5.288
  249    HB   VAL  30           HB       VAL  30  -0.337  -4.538   4.942
  250   HG11  VAL  30          1HG1      VAL  30  -1.586  -5.691   6.735
  251   HG12  VAL  30          2HG1      VAL  30  -0.315  -5.287   7.890
  252   HG13  VAL  30          3HG1      VAL  30   0.034  -6.366   6.540
  253   HG21  VAL  30          1HG2      VAL  30  -0.697  -2.205   5.648
  254   HG22  VAL  30          2HG2      VAL  30  -0.744  -2.698   7.341
  255   HG23  VAL  30          3HG2      VAL  30  -2.006  -3.227   6.234
  256    H    ARG  31           H        ARG  31   2.301  -1.613   6.558
  257    HA   ARG  31           HA       ARG  31   3.148  -2.206   9.319
  258    HB2  ARG  31          2HB       ARG  31   4.661  -1.174   7.390
  259    HB3  ARG  31          3HB       ARG  31   3.871   0.335   7.824
  260    HG2  ARG  31          2HG       ARG  31   5.982   0.192   8.996
  261    HG3  ARG  31          3HG       ARG  31   4.678   0.039  10.175
  262    HD2  ARG  31          2HD       ARG  31   4.968  -2.452  10.109
  263    HD3  ARG  31          3HD       ARG  31   6.345  -2.235   9.024
  264    HE   ARG  31           HE       ARG  31   6.912  -0.703  11.229
  265   HH11  ARG  31          1HH1      ARG  31   6.263  -4.113  10.675
  266   HH12  ARG  31          2HH1      ARG  31   7.237  -4.640  12.010
  267   HH21  ARG  31          1HH2      ARG  31   8.179  -1.403  12.984
  268   HH22  ARG  31          2HH2      ARG  31   8.324  -3.099  13.325
  269    H    ARG  32           H        ARG  32   1.240   0.159   7.460
  270    HA   ARG  32           HA       ARG  32  -0.467   0.700   9.755
  271    HB2  ARG  32          2HB       ARG  32   1.425   2.309  10.004
  272    HB3  ARG  32          3HB       ARG  32   1.124   2.918   8.385
  273    HG2  ARG  32          2HG       ARG  32  -1.112   3.745   9.137
  274    HG3  ARG  32          3HG       ARG  32  -0.753   3.171  10.767
  275    HD2  ARG  32          2HD       ARG  32   1.235   4.687  10.819
  276    HD3  ARG  32          3HD       ARG  32   0.772   5.298   9.231
  277    HE   ARG  32           HE       ARG  32  -1.204   5.565  11.373
  278   HH11  ARG  32          1HH1      ARG  32   1.319   7.091   9.446
  279   HH12  ARG  32          2HH1      ARG  32   0.836   8.708   9.868
  280   HH21  ARG  32          1HH2      ARG  32  -1.769   7.682  11.986
  281   HH22  ARG  32          2HH2      ARG  32  -0.922   9.042  11.314
  282    H    VAL  33           H        VAL  33  -2.504   1.315   9.129
  283    HA   VAL  33           HA       VAL  33  -3.079   1.837   6.255
  284    HB   VAL  33           HB       VAL  33  -4.987   0.715   8.390
  285   HG11  VAL  33          1HG1      VAL  33  -6.523   0.259   6.493
  286   HG12  VAL  33          2HG1      VAL  33  -5.394   1.048   5.388
  287   HG13  VAL  33          3HG1      VAL  33  -6.184   1.983   6.659
  288   HG21  VAL  33          1HG2      VAL  33  -4.805  -1.448   7.210
  289   HG22  VAL  33          2HG2      VAL  33  -3.240  -0.927   7.834
  290   HG23  VAL  33          3HG2      VAL  33  -3.604  -0.758   6.115
  291    H    GLN  34           H        GLN  34  -3.365   4.055   5.985
  292    HA   GLN  34           HA       GLN  34  -4.719   5.550   8.173
  293    HB2  GLN  34          2HB       GLN  34  -2.284   5.953   8.197
  294    HB3  GLN  34          3HB       GLN  34  -2.329   6.441   6.507
  295    HG2  GLN  34          2HG       GLN  34  -2.175   8.350   8.080
  296    HG3  GLN  34          3HG       GLN  34  -3.598   8.424   7.041
  297   HE21  GLN  34          1HE2      GLN  34  -5.632   8.257   7.972
  298   HE22  GLN  34          2HE2      GLN  34  -5.902   8.292   9.674
  299    H    LYS  35           H        LYS  35  -6.588   6.339   7.502
  300    HA   LYS  35           HA       LYS  35  -7.317   6.674   4.727
  301    HB2  LYS  35          2HB       LYS  35  -8.940   5.887   6.423
  302    HB3  LYS  35          3HB       LYS  35  -8.765   7.388   7.321
  303    HG2  LYS  35          2HG       LYS  35 -10.831   7.544   6.141
  304    HG3  LYS  35          3HG       LYS  35  -9.705   8.606   5.295
  305    HD2  LYS  35          2HD       LYS  35 -10.922   7.407   3.606
  306    HD3  LYS  35          3HD       LYS  35  -9.302   6.709   3.649
  307    HE2  LYS  35          2HE       LYS  35 -10.926   4.914   3.479
  308    HE3  LYS  35          3HE       LYS  35 -10.197   4.849   5.084
  309    HZ1  LYS  35          1HZ       LYS  35 -12.602   4.547   5.124
  310    HZ2  LYS  35          2HZ       LYS  35 -12.813   6.075   4.435
  311    HZ3  LYS  35          3HZ       LYS  35 -12.141   5.936   5.980
  312    H    GLN  36           H        GLN  36  -7.238   8.521   3.559
  313    HA   GLN  36           HA       GLN  36  -7.212  11.178   4.886
  314    HB2  GLN  36          2HB       GLN  36  -5.679  10.410   2.353
  315    HB3  GLN  36          3HB       GLN  36  -5.817  12.046   2.994
  316    HG2  GLN  36          2HG       GLN  36  -4.473   9.708   4.392
  317    HG3  GLN  36          3HG       GLN  36  -3.640  11.011   3.550
  318   HE21  GLN  36          1HE2      GLN  36  -3.578  10.116   6.389
  319   HE22  GLN  36          2HE2      GLN  36  -3.916  11.528   7.316
  320    H    GLY  37           H        GLY  37  -9.480  11.201   4.695
  321    HA2  GLY  37          2HA       GLY  37 -11.476  11.794   3.711
  322    HA3  GLY  37          3HA       GLY  37 -10.605  12.105   2.215
  323    H    ASN  38           H        ASN  38 -10.480  10.511   0.651
  324    HA   ASN  38           HA       ASN  38 -11.797   7.884   1.164
  325    HB2  ASN  38          2HB       ASN  38 -11.793   9.580  -1.370
  326    HB3  ASN  38          3HB       ASN  38 -12.244   7.878  -1.368
  327   HD21  ASN  38          1HD2      ASN  38 -14.328   8.270  -2.034
  328   HD22  ASN  38          2HD2      ASN  38 -15.530   9.009  -1.034
  329    H    THR  39           H        THR  39  -8.910   9.475   0.393
  330    HA   THR  39           HA       THR  39  -7.683   7.266  -1.072
  331    HB   THR  39           HB       THR  39  -6.444   9.904  -0.174
  332    HG1  THR  39           HG1      THR  39  -8.317   9.459  -2.060
  333   HG21  THR  39          1HG2      THR  39  -4.804   9.476  -2.006
  334   HG22  THR  39          2HG2      THR  39  -5.570   7.921  -2.330
  335   HG23  THR  39          3HG2      THR  39  -4.753   8.199  -0.790
  336    H    ILE  40           H        ILE  40  -7.388   5.594   0.402
  337    HA   ILE  40           HA       ILE  40  -6.232   6.008   3.008
  338    HB   ILE  40           HB       ILE  40  -6.464   3.377   1.452
  339   HG12  ILE  40          2HG1      ILE  40  -8.393   4.641   3.459
  340   HG13  ILE  40          3HG1      ILE  40  -8.694   4.409   1.740
  341   HG21  ILE  40          1HG2      ILE  40  -6.058   3.910   4.433
  342   HG22  ILE  40          2HG2      ILE  40  -4.830   3.309   3.316
  343   HG23  ILE  40          3HG2      ILE  40  -6.239   2.318   3.688
  344   HD11  ILE  40          1HD1      ILE  40  -8.363   2.224   3.799
  345   HD12  ILE  40          2HD1      ILE  40  -8.676   1.983   2.081
  346   HD13  ILE  40          3HD1      ILE  40  -9.877   2.780   3.089
  347    H    ARG  41           H        ARG  41  -4.220   6.833   2.982
  348    HA   ARG  41           HA       ARG  41  -2.095   5.785   1.290
  349    HB2  ARG  41          2HB       ARG  41  -1.985   7.702   3.669
  350    HB3  ARG  41          3HB       ARG  41  -0.639   7.326   2.591
  351    HG2  ARG  41          2HG       ARG  41  -1.908   8.310   0.692
  352    HG3  ARG  41          3HG       ARG  41  -3.218   8.722   1.804
  353    HD2  ARG  41          2HD       ARG  41  -1.778  10.664   1.354
  354    HD3  ARG  41          3HD       ARG  41  -1.716  10.205   3.058
  355    HE   ARG  41           HE       ARG  41   0.386   9.362   1.152
  356   HH11  ARG  41          1HH1      ARG  41  -0.474  11.067   4.115
  357   HH12  ARG  41          2HH1      ARG  41   1.178  11.296   4.589
  358   HH21  ARG  41          1HH2      ARG  41   2.533   9.629   1.848
  359   HH22  ARG  41          2HH2      ARG  41   2.862  10.484   3.317
  360    H    VAL  42           H        VAL  42  -1.985   3.645   1.795
  361    HA   VAL  42           HA       VAL  42  -1.534   2.702   4.525
  362    HB   VAL  42           HB       VAL  42  -1.014   0.431   3.230
  363   HG11  VAL  42          1HG1      VAL  42  -3.390  -0.167   3.173
  364   HG12  VAL  42          2HG1      VAL  42  -3.843   1.540   3.268
  365   HG13  VAL  42          3HG1      VAL  42  -3.014   0.772   4.623
  366   HG21  VAL  42          1HG2      VAL  42  -0.843   1.368   0.979
  367   HG22  VAL  42          2HG2      VAL  42  -2.494   1.980   1.073
  368   HG23  VAL  42          3HG2      VAL  42  -2.196   0.240   1.057
  369    H    GLU  43           H        GLU  43   0.361   2.780   5.411
  370    HA   GLU  43           HA       GLU  43   2.871   2.931   3.913
  371    HB2  GLU  43          2HB       GLU  43   2.254   2.973   6.902
  372    HB3  GLU  43          3HB       GLU  43   3.876   3.082   6.227
  373    HG2  GLU  43          2HG       GLU  43   3.202   5.168   5.032
  374    HG3  GLU  43          3HG       GLU  43   1.623   5.054   5.805
  375    H    LEU  44           H        LEU  44   4.139   1.171   3.554
  376    HA   LEU  44           HA       LEU  44   3.675  -1.300   5.114
  377    HB2  LEU  44          2HB       LEU  44   4.157  -1.310   2.097
  378    HB3  LEU  44          3HB       LEU  44   3.914  -2.700   3.139
  379    HG   LEU  44           HG       LEU  44   1.550  -1.502   3.634
  380   HD11  LEU  44          1HD1      LEU  44   1.982   0.495   2.310
  381   HD12  LEU  44          2HD1      LEU  44   0.627  -0.411   1.647
  382   HD13  LEU  44          3HD1      LEU  44   2.205  -0.483   0.857
  383   HD21  LEU  44          1HD2      LEU  44   2.050  -3.107   1.115
  384   HD22  LEU  44          2HD2      LEU  44   0.496  -2.886   1.925
  385   HD23  LEU  44          3HD2      LEU  44   1.793  -3.764   2.732
  386    H    GLU  45           H        GLU  45   5.464  -2.881   4.643
  387    HA   GLU  45           HA       GLU  45   8.080  -1.541   4.951
  388    HB2  GLU  45          2HB       GLU  45   7.179  -2.361   7.088
  389    HB3  GLU  45          3HB       GLU  45   6.880  -3.953   6.400
  390    HG2  GLU  45          2HG       GLU  45   9.386  -4.149   6.034
  391    HG3  GLU  45          3HG       GLU  45   9.570  -2.661   6.958
  392    H    LEU  46           H        LEU  46   9.438  -2.160   3.385
  393    HA   LEU  46           HA       LEU  46   9.245  -4.842   2.152
  394    HB2  LEU  46          2HB       LEU  46   8.064  -3.102   0.786
  395    HB3  LEU  46          3HB       LEU  46   9.539  -2.188   0.688
  396    HG   LEU  46           HG       LEU  46   9.352  -4.988  -0.481
  397   HD11  LEU  46          1HD1      LEU  46   8.828  -3.979  -2.667
  398   HD12  LEU  46          2HD1      LEU  46   8.686  -2.389  -1.910
  399   HD13  LEU  46          3HD1      LEU  46   7.548  -3.671  -1.495
  400   HD21  LEU  46          1HD2      LEU  46  11.163  -4.219  -1.960
  401   HD22  LEU  46          2HD2      LEU  46  11.628  -4.085  -0.268
  402   HD23  LEU  46          3HD2      LEU  46  11.159  -2.640  -1.167
  403    H    ARG  47           H        ARG  47  11.198  -5.772   2.018
  404    HA   ARG  47           HA       ARG  47  13.545  -4.274   2.996
  405    HB2  ARG  47          2HB       ARG  47  12.839  -7.231   2.979
  406    HB3  ARG  47          3HB       ARG  47  14.461  -6.657   3.357
  407    HG2  ARG  47          2HG       ARG  47  13.747  -5.582   5.356
  408    HG3  ARG  47          3HG       ARG  47  12.042  -5.683   4.908
  409    HD2  ARG  47          2HD       ARG  47  12.799  -7.315   6.701
  410    HD3  ARG  47          3HD       ARG  47  11.967  -8.038   5.324
  411    HE   ARG  47           HE       ARG  47  14.891  -8.007   5.233
  412   HH11  ARG  47          1HH1      ARG  47  12.012  -9.911   5.978
  413   HH12  ARG  47          2HH1      ARG  47  12.855 -11.422   5.874
  414   HH21  ARG  47          1HH2      ARG  47  15.947 -10.013   5.041
  415   HH22  ARG  47          2HH2      ARG  47  15.073 -11.483   5.344
  416    H    THR  48           H        THR  48  14.565  -3.385   1.285
  417    HA   THR  48           HA       THR  48  15.042  -4.952  -1.179
  418    HB   THR  48           HB       THR  48  15.765  -2.006  -0.810
  419    HG1  THR  48           HG1      THR  48  13.665  -1.892  -0.288
  420   HG21  THR  48          1HG2      THR  48  15.360  -1.895  -3.244
  421   HG22  THR  48          2HG2      THR  48  14.879  -3.592  -3.257
  422   HG23  THR  48          3HG2      THR  48  16.544  -3.150  -2.875
  423    H    ASN  49           H        ASN  49  17.006  -5.959  -1.306
  424    HA   ASN  49           HA       ASN  49  19.223  -6.447  -1.189
  425    HB2  ASN  49          2HB       ASN  49  19.521  -3.435  -0.793
  426    HB3  ASN  49          3HB       ASN  49  20.865  -4.539  -1.083
  427   HD21  ASN  49          1HD2      ASN  49  21.482  -3.599  -3.019
  428   HD22  ASN  49          2HD2      ASN  49  20.531  -3.667  -4.458
  429    H    GLY  50           H        GLY  50  17.554  -6.415   1.271
  430    HA2  GLY  50          2HA       GLY  50  18.072  -7.408   3.343
  431    HA3  GLY  50          3HA       GLY  50  19.689  -6.727   3.269
  432    H    LYS  51           H        LYS  51  18.315  -4.106   2.449
  433    HA   LYS  51           HA       LYS  51  18.103  -2.993   5.126
  434    HB2  LYS  51          2HB       LYS  51  17.898  -1.668   2.389
  435    HB3  LYS  51          3HB       LYS  51  18.036  -0.827   3.927
  436    HG2  LYS  51          2HG       LYS  51  20.161  -2.675   2.805
  437    HG3  LYS  51          3HG       LYS  51  20.150  -0.924   2.596
  438    HD2  LYS  51          2HD       LYS  51  20.261  -0.642   5.068
  439    HD3  LYS  51          3HD       LYS  51  20.326  -2.398   5.254
  440    HE2  LYS  51          2HE       LYS  51  22.452  -2.467   4.022
  441    HE3  LYS  51          3HE       LYS  51  22.378  -0.722   3.761
  442    HZ1  LYS  51          1HZ       LYS  51  23.841  -1.319   5.595
  443    HZ2  LYS  51          2HZ       LYS  51  22.558  -2.052   6.413
  444    HZ3  LYS  51          3HZ       LYS  51  22.541  -0.386   6.136
  445    H    LYS  52           H        LYS  52  16.258  -1.542   5.685
  446    HA   LYS  52           HA       LYS  52  13.693  -2.695   4.736
  447    HB2  LYS  52          2HB       LYS  52  14.208  -3.352   7.013
  448    HB3  LYS  52          3HB       LYS  52  14.549  -1.688   7.482
  449    HG2  LYS  52          2HG       LYS  52  12.203  -1.077   7.214
  450    HG3  LYS  52          3HG       LYS  52  11.813  -2.684   6.596
  451    HD2  LYS  52          2HD       LYS  52  12.844  -2.088   9.400
  452    HD3  LYS  52          3HD       LYS  52  11.157  -2.387   8.975
  453    HE2  LYS  52          2HE       LYS  52  11.895  -4.647   8.076
  454    HE3  LYS  52          3HE       LYS  52  13.472  -4.335   8.807
  455    HZ1  LYS  52          1HZ       LYS  52  10.866  -4.516  10.205
  456    HZ2  LYS  52          2HZ       LYS  52  12.320  -4.086  10.957
  457    HZ3  LYS  52          3HZ       LYS  52  12.139  -5.626  10.285
  458    H    GLU  53           H        GLU  53  12.819  -1.277   3.364
  459    HA   GLU  53           HA       GLU  53  12.819   1.628   3.934
  460    HB2  GLU  53          2HB       GLU  53  12.386   0.073   1.345
  461    HB3  GLU  53          3HB       GLU  53  12.037   1.793   1.493
  462    HG2  GLU  53          2HG       GLU  53  14.177   1.485   0.428
  463    HG3  GLU  53          3HG       GLU  53  14.392   2.241   2.001
  464    H    ASN  54           H        ASN  54  10.901   2.743   4.122
  465    HA   ASN  54           HA       ASN  54   8.365   1.247   4.309
  466    HB2  ASN  54          2HB       ASN  54   9.073   4.137   5.032
  467    HB3  ASN  54          3HB       ASN  54   7.473   3.422   5.239
  468   HD21  ASN  54          1HD2      ASN  54   7.130   1.983   6.953
  469   HD22  ASN  54          2HD2      ASN  54   8.283   1.752   8.217
  470    H    TYR  55           H        TYR  55   6.810   1.396   2.723
  471    HA   TYR  55           HA       TYR  55   7.110   3.442   0.577
  472    HB2  TYR  55          2HB       TYR  55   6.095   0.571   0.345
  473    HB3  TYR  55          3HB       TYR  55   5.985   1.770  -0.941
  474    HD1  TYR  55           HD1      TYR  55   7.712   1.847  -2.549
  475    HD2  TYR  55           HD2      TYR  55   8.543   0.123   1.265
  476    HE1  TYR  55           HE1      TYR  55   9.935   1.141  -3.345
  477    HE2  TYR  55           HE2      TYR  55  10.740  -0.584   0.473
  478    HH   TYR  55           HH       TYR  55  11.908  -1.064  -1.586
  479    H    THR  56           H        THR  56   5.514   4.842   0.640
  480    HA   THR  56           HA       THR  56   2.914   4.304   1.810
  481    HB   THR  56           HB       THR  56   3.928   6.803   0.372
  482    HG1  THR  56           HG1      THR  56   3.914   6.259   3.175
  483   HG21  THR  56          1HG2      THR  56   1.641   6.455   2.359
  484   HG22  THR  56          2HG2      THR  56   1.459   6.706   0.622
  485   HG23  THR  56          3HG2      THR  56   2.159   7.974   1.626
  486    H    VAL  57           H        VAL  57   1.755   2.950   0.475
  487    HA   VAL  57           HA       VAL  57   1.417   3.590  -2.381
  488    HB   VAL  57           HB       VAL  57   0.154   1.322  -0.752
  489   HG11  VAL  57          1HG1      VAL  57  -0.372   0.297  -2.935
  490   HG12  VAL  57          2HG1      VAL  57   0.318   1.686  -3.774
  491   HG13  VAL  57          3HG1      VAL  57  -1.130   1.883  -2.789
  492   HG21  VAL  57          1HG2      VAL  57   2.604   1.093  -0.800
  493   HG22  VAL  57          2HG2      VAL  57   2.599   1.219  -2.560
  494   HG23  VAL  57          3HG2      VAL  57   1.837  -0.165  -1.771
  495    H    GLU  58           H        GLU  58   0.106   5.303  -2.643
  496    HA   GLU  58           HA       GLU  58  -2.089   5.881  -0.786
  497    HB2  GLU  58          2HB       GLU  58  -1.176   7.439  -3.249
  498    HB3  GLU  58          3HB       GLU  58  -2.196   8.031  -1.934
  499    HG2  GLU  58          2HG       GLU  58  -0.324   7.872  -0.357
  500    HG3  GLU  58          3HG       GLU  58   0.702   7.165  -1.601
  501    H    VAL  59           H        VAL  59  -3.739   4.487  -1.189
  502    HA   VAL  59           HA       VAL  59  -4.692   4.027  -3.954
  503    HB   VAL  59           HB       VAL  59  -5.490   2.508  -1.407
  504   HG11  VAL  59          1HG1      VAL  59  -5.871   1.824  -4.350
  505   HG12  VAL  59          2HG1      VAL  59  -7.129   2.358  -3.233
  506   HG13  VAL  59          3HG1      VAL  59  -6.338   0.803  -2.984
  507   HG21  VAL  59          1HG2      VAL  59  -3.961   0.701  -2.131
  508   HG22  VAL  59          2HG2      VAL  59  -3.077   2.193  -1.810
  509   HG23  VAL  59          3HG2      VAL  59  -3.398   1.706  -3.473
  510    H    GLU  60           H        GLU  60  -6.412   5.196  -4.559
  511    HA   GLU  60           HA       GLU  60  -8.101   6.595  -2.587
  512    HB2  GLU  60          2HB       GLU  60  -6.931   7.968  -4.276
  513    HB3  GLU  60          3HB       GLU  60  -7.655   7.026  -5.576
  514    HG2  GLU  60          2HG       GLU  60  -9.934   7.847  -4.690
  515    HG3  GLU  60          3HG       GLU  60  -9.022   8.982  -3.697
  516    H    ARG  61           H        ARG  61 -10.323   6.387  -2.620
  517    HA   ARG  61           HA       ARG  61 -11.522   4.091  -3.846
  518    HB2  ARG  61          2HB       ARG  61 -12.302   4.944  -1.642
  519    HB3  ARG  61          3HB       ARG  61 -12.806   6.459  -2.388
  520    HG2  ARG  61          2HG       ARG  61 -14.740   5.039  -2.001
  521    HG3  ARG  61          3HG       ARG  61 -14.481   5.240  -3.734
  522    HD2  ARG  61          2HD       ARG  61 -14.784   2.976  -3.753
  523    HD3  ARG  61          3HD       ARG  61 -13.074   2.934  -3.332
  524    HE   ARG  61           HE       ARG  61 -14.266   3.040  -0.915
  525   HH11  ARG  61          1HH1      ARG  61 -14.733   0.951  -3.698
  526   HH12  ARG  61          2HH1      ARG  61 -15.246  -0.403  -2.750
  527   HH21  ARG  61          1HH2      ARG  61 -14.937   1.261   0.310
  528   HH22  ARG  61          2HH2      ARG  61 -15.366  -0.227  -0.476
  529    H    GLN  62           H        GLN  62 -12.840   3.991  -5.611
  530    HA   GLN  62           HA       GLN  62 -13.724   6.411  -7.011
  531    HB2  GLN  62          2HB       GLN  62 -11.555   5.706  -8.054
  532    HB3  GLN  62          3HB       GLN  62 -12.243   4.121  -8.397
  533    HG2  GLN  62          2HG       GLN  62 -13.890   5.141  -9.903
  534    HG3  GLN  62          3HG       GLN  62 -13.280   6.750  -9.509
  535   HE21  GLN  62          1HE2      GLN  62 -12.789   7.165 -11.690
  536   HE22  GLN  62          2HE2      GLN  62 -11.435   6.443 -12.477
  537    H    GLY  63           H        GLY  63 -15.735   5.849  -6.112
  538    HA2  GLY  63          2HA       GLY  63 -17.840   4.961  -6.133
  539    HA3  GLY  63          3HA       GLY  63 -17.403   4.092  -7.598
  540    H    ASN  64           H        ASN  64 -16.995   1.929  -7.471
  541    HA   ASN  64           HA       ASN  64 -17.197   0.607  -4.826
  542    HB2  ASN  64          2HB       ASN  64 -17.587  -0.561  -7.614
  543    HB3  ASN  64          3HB       ASN  64 -17.768  -1.452  -6.108
  544   HD21  ASN  64          1HD2      ASN  64 -19.712  -1.091  -8.185
  545   HD22  ASN  64          2HD2      ASN  64 -21.064  -0.281  -7.480
  546    H    THR  65           H        THR  65 -14.945   1.287  -7.352
  547    HA   THR  65           HA       THR  65 -13.182  -0.973  -6.624
  548    HB   THR  65           HB       THR  65 -13.691  -0.652  -9.046
  549    HG1  THR  65           HG1      THR  65 -11.801  -1.677  -8.656
  550   HG21  THR  65          1HG2      THR  65 -12.092   1.929  -8.809
  551   HG22  THR  65          2HG2      THR  65 -13.813   1.815  -9.182
  552   HG23  THR  65          3HG2      THR  65 -12.621   1.178 -10.315
  553    H    TRP  66           H        TRP  66 -10.766  -0.363  -6.780
  554    HA   TRP  66           HA       TRP  66 -10.179   2.137  -5.302
  555    HB2  TRP  66          2HB       TRP  66  -9.047  -0.673  -4.902
  556    HB3  TRP  66          3HB       TRP  66  -8.316   0.768  -4.210
  557    HD1  TRP  66           HD1      TRP  66 -11.124  -1.712  -3.600
  558    HE1  TRP  66           HE1      TRP  66 -12.337  -1.101  -1.419
  559    HE3  TRP  66           HE3      TRP  66  -9.024   2.893  -2.728
  560    HZ2  TRP  66           HZ2      TRP  66 -12.412   1.035   0.399
  561    HZ3  TRP  66           HZ3      TRP  66  -9.735   4.151  -0.731
  562    HH2  TRP  66           HH2      TRP  66 -11.399   3.232   0.805
  563    H    THR  67           H        THR  67  -8.873   3.412  -6.462
  564    HA   THR  67           HA       THR  67  -7.081   2.276  -8.525
  565    HB   THR  67           HB       THR  67  -8.768   3.669  -9.560
  566    HG1  THR  67           HG1      THR  67  -6.632   3.884 -10.358
  567   HG21  THR  67          1HG2      THR  67  -9.095   6.055  -9.034
  568   HG22  THR  67          2HG2      THR  67  -7.937   5.940  -7.709
  569   HG23  THR  67          3HG2      THR  67  -9.464   5.059  -7.625
  570    H    VAL  68           H        VAL  68  -4.954   2.345  -8.042
  571    HA   VAL  68           HA       VAL  68  -3.914   3.820  -5.792
  572    HB   VAL  68           HB       VAL  68  -2.370   2.259  -7.930
  573   HG11  VAL  68          1HG1      VAL  68  -0.522   2.195  -6.264
  574   HG12  VAL  68          2HG1      VAL  68  -1.461   3.230  -5.185
  575   HG13  VAL  68          3HG1      VAL  68  -0.911   3.850  -6.742
  576   HG21  VAL  68          1HG2      VAL  68  -3.327   1.353  -5.183
  577   HG22  VAL  68          2HG2      VAL  68  -2.326   0.406  -6.287
  578   HG23  VAL  68          3HG2      VAL  68  -3.979   0.823  -6.736
  579    H    LYS  69           H        LYS  69  -3.325   5.845  -5.821
  580    HA   LYS  69           HA       LYS  69  -3.181   7.479  -8.168
  581    HB2  LYS  69          2HB       LYS  69  -2.546   8.131  -5.262
  582    HB3  LYS  69          3HB       LYS  69  -2.750   9.316  -6.543
  583    HG2  LYS  69          2HG       LYS  69  -4.939   7.441  -5.604
  584    HG3  LYS  69          3HG       LYS  69  -4.691   9.068  -4.978
  585    HD2  LYS  69          2HD       LYS  69  -6.351   9.447  -6.556
  586    HD3  LYS  69          3HD       LYS  69  -4.910   9.800  -7.503
  587    HE2  LYS  69          2HE       LYS  69  -5.048   7.614  -8.586
  588    HE3  LYS  69          3HE       LYS  69  -6.398   7.148  -7.544
  589    HZ1  LYS  69          1HZ       LYS  69  -6.419   9.357  -9.533
  590    HZ2  LYS  69          2HZ       LYS  69  -7.707   8.943  -8.521
  591    HZ3  LYS  69          3HZ       LYS  69  -7.178   7.858  -9.708
  592    H    ARG  70           H        ARG  70  -0.855   6.601  -5.606
  593    HA   ARG  70           HA       ARG  70   1.416   6.692  -7.349
  594    HB2  ARG  70          2HB       ARG  70   1.148   9.087  -7.194
  595    HB3  ARG  70          3HB       ARG  70   0.881   9.023  -5.457
  596    HG2  ARG  70          2HG       ARG  70   3.209   8.474  -5.061
  597    HG3  ARG  70          3HG       ARG  70   3.527   8.351  -6.792
  598    HD2  ARG  70          2HD       ARG  70   3.311  10.707  -7.101
  599    HD3  ARG  70          3HD       ARG  70   2.523  10.921  -5.536
  600    HE   ARG  70           HE       ARG  70   4.608  10.567  -4.451
  601   HH11  ARG  70          1HH1      ARG  70   4.971  11.007  -7.911
  602   HH12  ARG  70          2HH1      ARG  70   6.643  11.439  -7.780
  603   HH21  ARG  70          1HH2      ARG  70   6.786  11.030  -4.319
  604   HH22  ARG  70          2HH2      ARG  70   7.674  11.448  -5.754
  605    H    ILE  71           H        ILE  71   2.709   5.184  -6.576
  606    HA   ILE  71           HA       ILE  71   2.968   4.611  -3.700
  607    HB   ILE  71           HB       ILE  71   4.356   3.296  -6.100
  608   HG12  ILE  71          2HG1      ILE  71   1.965   2.329  -4.452
  609   HG13  ILE  71          3HG1      ILE  71   1.916   2.873  -6.126
  610   HG21  ILE  71          1HG2      ILE  71   4.293   2.427  -3.173
  611   HG22  ILE  71          2HG2      ILE  71   5.689   3.081  -4.030
  612   HG23  ILE  71          3HG2      ILE  71   5.029   1.517  -4.498
  613   HD11  ILE  71          1HD1      ILE  71   3.293   0.416  -5.075
  614   HD12  ILE  71          2HD1      ILE  71   3.346   0.970  -6.751
  615   HD13  ILE  71          3HD1      ILE  71   1.812   0.491  -6.028
  616    H    THR  72           H        THR  72   4.662   5.435  -2.537
  617    HA   THR  72           HA       THR  72   7.029   6.534  -3.906
  618    HB   THR  72           HB       THR  72   5.406   8.012  -1.773
  619    HG1  THR  72           HG1      THR  72   5.710   8.292  -4.569
  620   HG21  THR  72          1HG2      THR  72   7.003   9.874  -2.119
  621   HG22  THR  72          2HG2      THR  72   7.957   8.862  -3.204
  622   HG23  THR  72          3HG2      THR  72   7.826   8.447  -1.494
  623    H    ARG  73           H        ARG  73   8.781   5.663  -3.023
  624    HA   ARG  73           HA       ARG  73   8.858   4.404  -0.431
  625    HB2  ARG  73          2HB       ARG  73  10.291   3.704  -2.398
  626    HB3  ARG  73          3HB       ARG  73  11.160   5.233  -2.278
  627    HG2  ARG  73          2HG       ARG  73  11.900   4.605   0.016
  628    HG3  ARG  73          3HG       ARG  73  11.075   3.050  -0.165
  629    HD2  ARG  73          2HD       ARG  73  13.408   2.699  -0.634
  630    HD3  ARG  73          3HD       ARG  73  12.544   2.598  -2.166
  631    HE   ARG  73           HE       ARG  73  13.381   4.783  -2.745
  632   HH11  ARG  73          1HH1      ARG  73  14.923   3.369   0.084
  633   HH12  ARG  73          2HH1      ARG  73  16.337   4.356  -0.039
  634   HH21  ARG  73          1HH2      ARG  73  15.240   6.070  -2.905
  635   HH22  ARG  73          2HH2      ARG  73  16.522   5.893  -1.742
  636    H    THR  74           H        THR  74   9.733   5.288   1.450
  637    HA   THR  74           HA       THR  74   9.814   8.031   1.986
  638    HB   THR  74           HB       THR  74   9.586   6.327   3.774
  639    HG1  THR  74           HG1      THR  74  10.555   8.480   4.159
  640   HG21  THR  74          1HG2      THR  74  11.167   4.608   2.939
  641   HG22  THR  74          2HG2      THR  74  11.535   5.049   4.605
  642   HG23  THR  74          3HG2      THR  74  12.529   5.676   3.289
  643    H    VAL  75           H        VAL  75  11.620   9.497   2.236
  644    HA   VAL  75           HA       VAL  75  13.583   9.304   0.201
  645    HB   VAL  75           HB       VAL  75  13.522  11.229   2.588
  646   HG11  VAL  75          1HG1      VAL  75  15.102  11.446  -0.013
  647   HG12  VAL  75          2HG1      VAL  75  15.777  11.150   1.588
  648   HG13  VAL  75          3HG1      VAL  75  15.010  12.698   1.233
  649   HG21  VAL  75          1HG2      VAL  75  12.475  11.606  -0.252
  650   HG22  VAL  75          2HG2      VAL  75  12.473  12.839   1.012
  651   HG23  VAL  75          3HG2      VAL  75  11.487  11.388   1.195
  652    H    GLY  76           H        GLY  76  14.815   7.541   0.382
  653    HA2  GLY  76          2HA       GLY  76  16.733   7.304   2.648
  654    HA3  GLY  76          3HA       GLY  76  16.132   5.945   1.695
  655    H    SER  77           H        SER  77  16.928   9.072   0.461
  656    HA   SER  77           HA       SER  77  19.402   8.259  -0.838
  657    HB2  SER  77          2HB       SER  77  17.490   7.545  -2.353
  658    HB3  SER  77          3HB       SER  77  16.956   9.222  -2.415
  659    HG   SER  77           HG       SER  77  18.214   9.113  -4.141
  660    H    LEU  78           H        LEU  78  19.763  10.492  -2.429
  661    HA   LEU  78           HA       LEU  78  20.025  12.702  -0.673
  662    HB2  LEU  78          2HB       LEU  78  20.724  14.027  -2.559
  663    HB3  LEU  78          3HB       LEU  78  21.445  12.440  -2.712
  664    HG   LEU  78           HG       LEU  78  18.951  13.226  -4.274
  665   HD11  LEU  78          1HD1      LEU  78  20.720  14.829  -4.840
  666   HD12  LEU  78          2HD1      LEU  78  20.399  13.743  -6.189
  667   HD13  LEU  78          3HD1      LEU  78  21.833  13.502  -5.187
  668   HD21  LEU  78          1HD2      LEU  78  19.369  10.810  -4.157
  669   HD22  LEU  78          2HD2      LEU  78  21.013  11.044  -4.751
  670   HD23  LEU  78          3HD2      LEU  78  19.637  11.404  -5.794
  671    H    GLU  79           H        GLU  79  18.865  14.590  -0.514
  672    HA   GLU  79           HA       GLU  79  16.015  14.399  -0.913
  673    HB2  GLU  79          2HB       GLU  79  17.646  16.763   0.122
  674    HB3  GLU  79          3HB       GLU  79  15.902  16.537   0.269
  675    HG2  GLU  79          2HG       GLU  79  16.390  14.430   1.595
  676    HG3  GLU  79          3HG       GLU  79  18.081  14.921   1.606
  677    H    HIS  80           H        HIS  80  15.799  14.271  -3.063
  678    HA   HIS  80           HA       HIS  80  16.994  15.707  -5.114
  679    HB2  HIS  80          2HB       HIS  80  14.913  14.823  -6.455
  680    HB3  HIS  80          3HB       HIS  80  16.013  13.651  -5.736
  681    HD1  HIS  80           HD1      HIS  80  15.102  12.159  -3.876
  682    HD2  HIS  80           HD2      HIS  80  12.334  14.994  -5.136
  683    HE1  HIS  80           HE1      HIS  80  12.929  11.519  -2.790
  684    HE2  HIS  80           HE2      HIS  80  11.265  13.201  -3.617
  685    H    HIS  81           H        HIS  81  16.969  17.935  -4.650
  686    HA   HIS  81           HA       HIS  81  14.447  19.420  -4.724
  687    HB2  HIS  81          2HB       HIS  81  16.246  20.307  -3.286
  688    HB3  HIS  81          3HB       HIS  81  17.335  20.412  -4.671
  689    HD1  HIS  81           HD1      HIS  81  17.453  22.714  -5.655
  690    HD2  HIS  81           HD2      HIS  81  13.771  22.036  -3.852
  691    HE1  HIS  81           HE1      HIS  81  16.148  24.828  -5.973
  692    HE2  HIS  81           HE2      HIS  81  13.874  24.319  -5.053
  693    H    HIS  82           H        HIS  82  13.489  19.917  -6.574
  694    HA   HIS  82           HA       HIS  82  15.068  20.299  -9.057
  695    HB2  HIS  82          2HB       HIS  82  13.306  19.323 -10.342
  696    HB3  HIS  82          3HB       HIS  82  13.550  18.227  -8.992
  697    HD1  HIS  82           HD1      HIS  82  10.968  20.110 -10.726
  698    HD2  HIS  82           HD2      HIS  82  11.453  18.518  -6.934
  699    HE1  HIS  82           HE1      HIS  82   8.662  19.974  -9.764
  700    HE2  HIS  82           HE2      HIS  82   8.969  18.931  -7.500
  701    H    HIS  83           H        HIS  83  13.987  21.852 -10.597
  702    HA   HIS  83           HA       HIS  83  13.316  24.258  -9.126
  703    HB2  HIS  83          2HB       HIS  83  13.398  25.409 -11.315
  704    HB3  HIS  83          3HB       HIS  83  14.835  24.443 -11.024
  705    HD1  HIS  83           HD1      HIS  83  15.504  22.889 -12.855
  706    HD2  HIS  83           HD2      HIS  83  11.561  24.125 -13.260
  707    HE1  HIS  83           HE1      HIS  83  14.759  22.046 -15.098
  708    HE2  HIS  83           HE2      HIS  83  12.435  22.949 -15.384
  709    H    HIS  84           H        HIS  84  11.470  25.545  -9.393
  710    HA   HIS  84           HA       HIS  84   9.020  24.205 -10.413
  711    HB2  HIS  84          2HB       HIS  84   8.894  24.751  -8.007
  712    HB3  HIS  84          3HB       HIS  84   9.337  26.426  -8.330
  713    HD1  HIS  84           HD1      HIS  84   7.420  28.003  -8.718
  714    HD2  HIS  84           HD2      HIS  84   6.258  24.042  -9.169
  715    HE1  HIS  84           HE1      HIS  84   4.938  28.062  -9.015
  716    HE2  HIS  84           HE2      HIS  84   4.241  25.653  -9.137
  717    H    HIS  85           H        HIS  85   9.190  24.811 -12.559
  718    HA   HIS  85           HA       HIS  85   9.691  27.570 -13.332
  719    HB2  HIS  85          2HB       HIS  85  10.601  25.641 -14.662
  720    HB3  HIS  85          3HB       HIS  85   8.957  25.185 -15.098
  721    HD1  HIS  85           HD1      HIS  85  11.482  27.949 -15.646
  722    HD2  HIS  85           HD2      HIS  85   7.894  26.603 -17.247
  723    HE1  HIS  85           HE1      HIS  85  11.172  29.238 -17.768
  724    HE2  HIS  85           HE2      HIS  85   9.083  28.311 -18.786
  Start of MODEL   15
    1    H1   MET   1          1H        MET   1 -25.076  -4.817   2.907
    2    H2   MET   1          2H        MET   1 -23.845  -5.612   3.746
    3    H3   MET   1          3H        MET   1 -23.587  -5.088   2.161
    4    HA   MET   1           HA       MET   1 -23.790  -2.809   2.820
    5    HB2  MET   1          2HB       MET   1 -23.921  -3.834   5.692
    6    HB3  MET   1          3HB       MET   1 -24.036  -2.160   5.156
    7    HG2  MET   1          2HG       MET   1 -26.082  -4.351   4.721
    8    HG3  MET   1          3HG       MET   1 -26.236  -2.951   5.782
    9    HE1  MET   1          1HE       MET   1 -25.209  -0.499   4.036
   10    HE2  MET   1          2HE       MET   1 -26.743  -0.467   4.908
   11    HE3  MET   1          3HE       MET   1 -26.686  -0.014   3.205
   12    HA   PRO   2           HA       PRO   2 -19.373  -4.077   3.112
   13    HB2  PRO   2          2HB       PRO   2 -18.323  -2.045   1.602
   14    HB3  PRO   2          3HB       PRO   2 -19.158  -3.430   0.869
   15    HG2  PRO   2          2HG       PRO   2 -20.207  -0.667   1.387
   16    HG3  PRO   2          3HG       PRO   2 -20.440  -1.709  -0.035
   17    HD2  PRO   2          2HD       PRO   2 -22.316  -1.430   1.960
   18    HD3  PRO   2          3HD       PRO   2 -22.178  -2.882   0.946
   19    H    SER   3           H        SER   3 -18.494  -3.710   5.073
   20    HA   SER   3           HA       SER   3 -18.668  -1.225   6.515
   21    HB2  SER   3          2HB       SER   3 -17.299  -2.373   8.233
   22    HB3  SER   3          3HB       SER   3 -18.628  -3.403   7.723
   23    HG   SER   3           HG       SER   3 -17.253  -4.726   6.724
   24    H    GLU   4           H        GLU   4 -16.997   0.287   6.858
   25    HA   GLU   4           HA       GLU   4 -15.203   0.685   4.706
   26    HB2  GLU   4          2HB       GLU   4 -16.150   2.523   6.136
   27    HB3  GLU   4          3HB       GLU   4 -15.077   2.018   7.436
   28    HG2  GLU   4          2HG       GLU   4 -13.128   2.461   5.852
   29    HG3  GLU   4          3HG       GLU   4 -14.289   3.185   4.742
   30    H    GLU   5           H        GLU   5 -14.809  -0.866   7.857
   31    HA   GLU   5           HA       GLU   5 -11.981  -1.065   7.870
   32    HB2  GLU   5          2HB       GLU   5 -13.309  -1.374   9.896
   33    HB3  GLU   5          3HB       GLU   5 -14.093  -2.795   9.215
   34    HG2  GLU   5          2HG       GLU   5 -11.966  -4.023   9.257
   35    HG3  GLU   5          3HG       GLU   5 -11.124  -2.587   9.837
   36    H    GLU   6           H        GLU   6 -14.519  -3.145   6.513
   37    HA   GLU   6           HA       GLU   6 -12.913  -5.232   5.475
   38    HB2  GLU   6          2HB       GLU   6 -15.343  -5.446   5.583
   39    HB3  GLU   6          3HB       GLU   6 -15.558  -4.075   4.504
   40    HG2  GLU   6          2HG       GLU   6 -14.579  -5.356   2.650
   41    HG3  GLU   6          3HG       GLU   6 -14.301  -6.722   3.731
   42    H    GLU   7           H        GLU   7 -13.689  -1.984   4.307
   43    HA   GLU   7           HA       GLU   7 -12.671  -2.309   1.681
   44    HB2  GLU   7          2HB       GLU   7 -12.984   0.285   3.242
   45    HB3  GLU   7          3HB       GLU   7 -12.764   0.140   1.502
   46    HG2  GLU   7          2HG       GLU   7 -15.167  -0.657   3.152
   47    HG3  GLU   7          3HG       GLU   7 -15.080   0.566   1.888
   48    H    LYS   8           H        LYS   8 -11.167  -0.810   4.645
   49    HA   LYS   8           HA       LYS   8  -8.636  -0.342   3.543
   50    HB2  LYS   8          2HB       LYS   8  -9.431  -0.928   6.417
   51    HB3  LYS   8          3HB       LYS   8  -7.743  -0.720   5.976
   52    HG2  LYS   8          2HG       LYS   8  -8.198   1.434   6.608
   53    HG3  LYS   8          3HG       LYS   8  -8.638   1.554   4.909
   54    HD2  LYS   8          2HD       LYS   8 -10.425   2.598   6.042
   55    HD3  LYS   8          3HD       LYS   8 -11.044   1.003   5.672
   56    HE2  LYS   8          2HE       LYS   8 -10.595   0.248   7.949
   57    HE3  LYS   8          3HE       LYS   8  -9.827   1.788   8.341
   58    HZ1  LYS   8          1HZ       LYS   8 -12.060   1.705   9.188
   59    HZ2  LYS   8          2HZ       LYS   8 -12.683   1.406   7.650
   60    HZ3  LYS   8          3HZ       LYS   8 -11.946   2.888   7.988
   61    H    ARG   9           H        ARG   9  -9.982  -3.331   4.901
   62    HA   ARG   9           HA       ARG   9  -7.663  -4.922   4.959
   63    HB2  ARG   9          2HB       ARG   9  -9.825  -5.575   5.994
   64    HB3  ARG   9          3HB       ARG   9 -10.524  -5.788   4.393
   65    HG2  ARG   9          2HG       ARG   9  -8.890  -7.624   3.955
   66    HG3  ARG   9          3HG       ARG   9  -8.262  -7.423   5.594
   67    HD2  ARG   9          2HD       ARG   9 -10.501  -7.979   6.499
   68    HD3  ARG   9          3HD       ARG   9 -11.095  -8.219   4.852
   69    HE   ARG   9           HE       ARG   9  -8.817  -9.853   5.390
   70   HH11  ARG   9          1HH1      ARG   9 -12.295  -9.675   5.945
   71   HH12  ARG   9          2HH1      ARG   9 -12.466 -11.391   6.140
   72   HH21  ARG   9          1HH2      ARG   9  -9.082 -12.101   5.708
   73   HH22  ARG   9          2HH2      ARG   9 -10.660 -12.748   6.007
   74    H    GLN  10           H        GLN  10 -10.024  -4.380   2.371
   75    HA   GLN  10           HA       GLN  10  -8.830  -5.958   0.349
   76    HB2  GLN  10          2HB       GLN  10 -10.654  -3.519   0.175
   77    HB3  GLN  10          3HB       GLN  10 -10.210  -4.497  -1.222
   78    HG2  GLN  10          2HG       GLN  10 -11.358  -6.423  -0.330
   79    HG3  GLN  10          3HG       GLN  10 -11.638  -5.610   1.210
   80   HE21  GLN  10          1HE2      GLN  10 -13.309  -4.098   1.358
   81   HE22  GLN  10          2HE2      GLN  10 -14.495  -3.883   0.125
   82    H    VAL  11           H        VAL  11  -8.441  -2.555   1.270
   83    HA   VAL  11           HA       VAL  11  -6.894  -1.647  -0.906
   84    HB   VAL  11           HB       VAL  11  -7.137  -0.575   1.951
   85   HG11  VAL  11          1HG1      VAL  11  -5.945   0.824  -0.452
   86   HG12  VAL  11          2HG1      VAL  11  -5.059   0.289   0.967
   87   HG13  VAL  11          3HG1      VAL  11  -6.258   1.574   1.110
   88   HG21  VAL  11          1HG2      VAL  11  -8.448   0.383  -0.614
   89   HG22  VAL  11          2HG2      VAL  11  -8.688   1.061   0.999
   90   HG23  VAL  11          3HG2      VAL  11  -9.236  -0.572   0.636
   91    H    LYS  12           H        LYS  12  -5.934  -3.044   2.233
   92    HA   LYS  12           HA       LYS  12  -3.137  -2.589   2.076
   93    HB2  LYS  12          2HB       LYS  12  -4.634  -4.807   3.532
   94    HB3  LYS  12          3HB       LYS  12  -2.938  -4.396   3.786
   95    HG2  LYS  12          2HG       LYS  12  -3.613  -2.159   4.600
   96    HG3  LYS  12          3HG       LYS  12  -5.307  -2.603   4.386
   97    HD2  LYS  12          2HD       LYS  12  -3.325  -3.948   6.256
   98    HD3  LYS  12          3HD       LYS  12  -4.621  -2.855   6.737
   99    HE2  LYS  12          2HE       LYS  12  -6.290  -4.478   5.975
  100    HE3  LYS  12          3HE       LYS  12  -5.011  -5.562   5.418
  101    HZ1  LYS  12          1HZ       LYS  12  -5.526  -4.726   8.214
  102    HZ2  LYS  12          2HZ       LYS  12  -4.218  -5.667   7.722
  103    HZ3  LYS  12          3HZ       LYS  12  -5.788  -6.260   7.555
  104    H    GLN  13           H        GLN  13  -5.238  -5.201   0.968
  105    HA   GLN  13           HA       GLN  13  -3.215  -6.947   0.007
  106    HB2  GLN  13          2HB       GLN  13  -5.496  -7.752   0.421
  107    HB3  GLN  13          3HB       GLN  13  -6.143  -6.669  -0.806
  108    HG2  GLN  13          2HG       GLN  13  -4.943  -7.918  -2.557
  109    HG3  GLN  13          3HG       GLN  13  -4.247  -8.978  -1.336
  110   HE21  GLN  13          1HE2      GLN  13  -7.620  -7.868  -1.306
  111   HE22  GLN  13          2HE2      GLN  13  -8.308  -9.421  -1.623
  112    H    VAL  14           H        VAL  14  -5.225  -4.466  -1.626
  113    HA   VAL  14           HA       VAL  14  -4.148  -4.674  -4.221
  114    HB   VAL  14           HB       VAL  14  -5.295  -2.174  -2.863
  115   HG11  VAL  14          1HG1      VAL  14  -5.869  -1.378  -5.130
  116   HG12  VAL  14          2HG1      VAL  14  -5.079  -2.790  -5.836
  117   HG13  VAL  14          3HG1      VAL  14  -4.124  -1.597  -4.955
  118   HG21  VAL  14          1HG2      VAL  14  -6.876  -4.061  -2.757
  119   HG22  VAL  14          2HG2      VAL  14  -6.749  -4.288  -4.499
  120   HG23  VAL  14          3HG2      VAL  14  -7.470  -2.812  -3.852
  121    H    ALA  15           H        ALA  15  -3.009  -3.014  -1.366
  122    HA   ALA  15           HA       ALA  15  -0.994  -1.384  -2.563
  123    HB1  ALA  15          1HB       ALA  15  -0.313  -0.945  -0.243
  124    HB2  ALA  15          2HB       ALA  15  -1.339  -2.267   0.325
  125    HB3  ALA  15          3HB       ALA  15  -2.064  -0.837  -0.410
  126    H    LYS  16           H        LYS  16  -0.913  -4.493  -0.791
  127    HA   LYS  16           HA       LYS  16   1.924  -4.724  -0.728
  128    HB2  LYS  16          2HB       LYS  16   1.587  -6.916   0.270
  129    HB3  LYS  16          3HB       LYS  16   0.424  -5.790   0.951
  130    HG2  LYS  16          2HG       LYS  16  -1.320  -6.725  -0.550
  131    HG3  LYS  16          3HG       LYS  16  -0.160  -7.905  -1.141
  132    HD2  LYS  16          2HD       LYS  16  -1.032  -7.669   1.772
  133    HD3  LYS  16          3HD       LYS  16  -1.745  -8.784   0.606
  134    HE2  LYS  16          2HE       LYS  16   1.159  -8.783   1.497
  135    HE3  LYS  16          3HE       LYS  16  -0.082  -9.925   2.012
  136    HZ1  LYS  16          1HZ       LYS  16   1.362 -10.786   0.241
  137    HZ2  LYS  16          2HZ       LYS  16   0.805  -9.580  -0.805
  138    HZ3  LYS  16          3HZ       LYS  16  -0.262 -10.750  -0.216
  139    H    GLU  17           H        GLU  17  -0.569  -5.957  -2.914
  140    HA   GLU  17           HA       GLU  17   1.012  -7.855  -4.285
  141    HB2  GLU  17          2HB       GLU  17  -1.443  -6.339  -5.276
  142    HB3  GLU  17          3HB       GLU  17  -0.742  -7.745  -6.070
  143    HG2  GLU  17          2HG       GLU  17  -2.018  -7.683  -3.326
  144    HG3  GLU  17          3HG       GLU  17  -2.720  -8.362  -4.785
  145    H    LYS  18           H        LYS  18   0.434  -4.392  -4.838
  146    HA   LYS  18           HA       LYS  18   1.816  -4.267  -7.352
  147    HB2  LYS  18          2HB       LYS  18   1.016  -2.025  -5.459
  148    HB3  LYS  18          3HB       LYS  18   1.577  -1.803  -7.114
  149    HG2  LYS  18          2HG       LYS  18  -0.979  -3.166  -6.227
  150    HG3  LYS  18          3HG       LYS  18  -0.845  -1.604  -7.029
  151    HD2  LYS  18          2HD       LYS  18  -0.097  -4.287  -8.266
  152    HD3  LYS  18          3HD       LYS  18  -1.607  -3.422  -8.549
  153    HE2  LYS  18          2HE       LYS  18   1.164  -2.417  -9.289
  154    HE3  LYS  18          3HE       LYS  18  -0.027  -3.085 -10.403
  155    HZ1  LYS  18          1HZ       LYS  18  -0.099  -0.719 -10.511
  156    HZ2  LYS  18          2HZ       LYS  18  -0.282  -0.573  -8.841
  157    HZ3  LYS  18          3HZ       LYS  18  -1.523  -1.246  -9.771
  158    H    LEU  19           H        LEU  19   2.749  -3.763  -3.982
  159    HA   LEU  19           HA       LEU  19   5.421  -2.903  -4.507
  160    HB2  LEU  19          2HB       LEU  19   4.061  -4.122  -2.090
  161    HB3  LEU  19          3HB       LEU  19   5.775  -3.726  -2.077
  162    HG   LEU  19           HG       LEU  19   3.523  -1.720  -2.534
  163   HD11  LEU  19          1HD1      LEU  19   4.081  -0.842  -0.330
  164   HD12  LEU  19          2HD1      LEU  19   5.296  -2.106  -0.110
  165   HD13  LEU  19          3HD1      LEU  19   3.585  -2.531  -0.222
  166   HD21  LEU  19          1HD2      LEU  19   5.554  -1.080  -3.728
  167   HD22  LEU  19          2HD2      LEU  19   6.513  -1.279  -2.260
  168   HD23  LEU  19          3HD2      LEU  19   5.283  -0.016  -2.352
  169    H    LEU  20           H        LEU  20   3.911  -6.091  -4.220
  170    HA   LEU  20           HA       LEU  20   6.307  -7.644  -4.389
  171    HB2  LEU  20          2HB       LEU  20   3.414  -8.321  -5.049
  172    HB3  LEU  20          3HB       LEU  20   4.711  -9.504  -5.094
  173    HG   LEU  20           HG       LEU  20   3.948  -7.979  -2.574
  174   HD11  LEU  20          1HD1      LEU  20   3.015 -10.740  -3.417
  175   HD12  LEU  20          2HD1      LEU  20   2.018  -9.286  -3.286
  176   HD13  LEU  20          3HD1      LEU  20   2.740  -9.987  -1.842
  177   HD21  LEU  20          1HD2      LEU  20   5.207  -9.739  -1.405
  178   HD22  LEU  20          2HD2      LEU  20   6.231  -8.865  -2.540
  179   HD23  LEU  20          3HD2      LEU  20   5.638 -10.478  -2.950
  180    H    GLU  21           H        GLU  21   4.126  -6.168  -6.774
  181    HA   GLU  21           HA       GLU  21   5.094  -7.385  -9.129
  182    HB2  GLU  21          2HB       GLU  21   3.939  -4.584  -8.746
  183    HB3  GLU  21          3HB       GLU  21   4.245  -5.314 -10.318
  184    HG2  GLU  21          2HG       GLU  21   2.284  -6.335  -8.246
  185    HG3  GLU  21          3HG       GLU  21   1.869  -5.420  -9.690
  186    H    GLN  22           H        GLN  22   6.105  -4.474  -7.384
  187    HA   GLN  22           HA       GLN  22   8.162  -3.647  -9.185
  188    HB2  GLN  22          2HB       GLN  22   7.634  -2.933  -6.272
  189    HB3  GLN  22          3HB       GLN  22   8.820  -2.117  -7.292
  190    HG2  GLN  22          2HG       GLN  22   7.051  -1.328  -8.779
  191    HG3  GLN  22          3HG       GLN  22   5.838  -2.209  -7.845
  192   HE21  GLN  22          1HE2      GLN  22   5.312  -1.459  -5.761
  193   HE22  GLN  22          2HE2      GLN  22   5.651   0.162  -5.270
  194    H    SER  23           H        SER  23   8.143  -5.501  -6.148
  195    HA   SER  23           HA       SER  23  10.863  -6.475  -6.715
  196    HB2  SER  23          2HB       SER  23  11.070  -4.553  -5.123
  197    HB3  SER  23          3HB       SER  23  10.036  -5.411  -3.980
  198    HG   SER  23           HG       SER  23  11.899  -6.150  -3.324
  199    HA   PRO  24           HA       PRO  24   8.509 -10.249  -5.408
  200    HB2  PRO  24          2HB       PRO  24   9.677 -11.868  -7.290
  201    HB3  PRO  24          3HB       PRO  24   8.244 -10.884  -7.656
  202    HG2  PRO  24          2HG       PRO  24  11.135 -10.271  -8.247
  203    HG3  PRO  24          3HG       PRO  24   9.721 -10.148  -9.322
  204    HD2  PRO  24          2HD       PRO  24  10.732  -7.972  -8.068
  205    HD3  PRO  24          3HD       PRO  24   8.986  -8.153  -8.357
  206    H    ASN  25           H        ASN  25  11.687  -9.067  -5.732
  207    HA   ASN  25           HA       ASN  25  13.242 -11.192  -4.658
  208    HB2  ASN  25          2HB       ASN  25  13.806  -8.193  -4.705
  209    HB3  ASN  25          3HB       ASN  25  15.004  -9.455  -4.440
  210   HD21  ASN  25          1HD2      ASN  25  13.916 -11.230  -6.545
  211   HD22  ASN  25          2HD2      ASN  25  14.339 -10.486  -8.045
  212    H    SER  26           H        SER  26  11.211  -8.762  -3.262
  213    HA   SER  26           HA       SER  26  12.199  -9.317  -0.514
  214    HB2  SER  26          2HB       SER  26  10.692  -6.829  -1.451
  215    HB3  SER  26          3HB       SER  26  11.549  -7.073   0.078
  216    HG   SER  26           HG       SER  26  13.481  -7.209  -1.123
  217    H    LYS  27           H        LYS  27  10.689  -9.786   1.066
  218    HA   LYS  27           HA       LYS  27   7.924 -10.325   0.228
  219    HB2  LYS  27          2HB       LYS  27   9.156 -12.094   1.480
  220    HB3  LYS  27          3HB       LYS  27   9.323 -11.002   2.850
  221    HG2  LYS  27          2HG       LYS  27   6.906 -10.982   3.202
  222    HG3  LYS  27          3HG       LYS  27   6.644 -11.916   1.728
  223    HD2  LYS  27          2HD       LYS  27   8.102 -12.904   4.211
  224    HD3  LYS  27          3HD       LYS  27   6.451 -13.332   3.755
  225    HE2  LYS  27          2HE       LYS  27   7.286 -14.440   1.715
  226    HE3  LYS  27          3HE       LYS  27   8.939 -13.972   2.122
  227    HZ1  LYS  27          1HZ       LYS  27   8.525 -16.245   2.740
  228    HZ2  LYS  27          2HZ       LYS  27   7.196 -15.800   3.685
  229    HZ3  LYS  27          3HZ       LYS  27   8.755 -15.321   4.139
  230    H    VAL  28           H        VAL  28   6.409  -8.872   0.653
  231    HA   VAL  28           HA       VAL  28   7.082  -6.447   2.170
  232    HB   VAL  28           HB       VAL  28   4.783  -6.954   0.225
  233   HG11  VAL  28          1HG1      VAL  28   5.845  -4.338   1.326
  234   HG12  VAL  28          2HG1      VAL  28   4.329  -5.115   1.788
  235   HG13  VAL  28          3HG1      VAL  28   4.545  -4.513   0.144
  236   HG21  VAL  28          1HG2      VAL  28   7.451  -5.610  -0.342
  237   HG22  VAL  28          2HG2      VAL  28   6.100  -5.738  -1.472
  238   HG23  VAL  28          3HG2      VAL  28   6.943  -7.193  -0.938
  239    H    GLN  29           H        GLN  29   5.941  -5.861   3.975
  240    HA   GLN  29           HA       GLN  29   3.570  -7.445   4.809
  241    HB2  GLN  29          2HB       GLN  29   5.530  -8.306   6.022
  242    HB3  GLN  29          3HB       GLN  29   5.979  -6.679   6.519
  243    HG2  GLN  29          2HG       GLN  29   4.945  -7.921   8.366
  244    HG3  GLN  29          3HG       GLN  29   3.973  -6.521   7.914
  245   HE21  GLN  29          1HE2      GLN  29   2.090  -7.382   8.806
  246   HE22  GLN  29          2HE2      GLN  29   1.251  -8.722   8.113
  247    H    VAL  30           H        VAL  30   1.911  -6.213   5.571
  248    HA   VAL  30           HA       VAL  30   1.841  -3.434   5.185
  249    HB   VAL  30           HB       VAL  30  -0.047  -5.089   6.927
  250   HG11  VAL  30          1HG1      VAL  30  -0.489  -2.382   5.606
  251   HG12  VAL  30          2HG1      VAL  30  -0.276  -2.665   7.334
  252   HG13  VAL  30          3HG1      VAL  30  -1.695  -3.297   6.507
  253   HG21  VAL  30          1HG2      VAL  30  -1.480  -5.290   4.925
  254   HG22  VAL  30          2HG2      VAL  30   0.105  -6.012   4.635
  255   HG23  VAL  30          3HG2      VAL  30  -0.280  -4.425   3.962
  256    H    ARG  31           H        ARG  31   2.612  -1.826   6.389
  257    HA   ARG  31           HA       ARG  31   3.854  -2.405   8.986
  258    HB2  ARG  31          2HB       ARG  31   5.159  -1.315   7.127
  259    HB3  ARG  31          3HB       ARG  31   4.081   0.073   7.210
  260    HG2  ARG  31          2HG       ARG  31   6.173   0.562   8.360
  261    HG3  ARG  31          3HG       ARG  31   4.854   0.516   9.533
  262    HD2  ARG  31          2HD       ARG  31   5.528  -1.790  10.170
  263    HD3  ARG  31          3HD       ARG  31   6.864  -1.713   9.015
  264    HE   ARG  31           HE       ARG  31   7.428   0.401  10.493
  265   HH11  ARG  31          1HH1      ARG  31   6.396  -2.778  11.639
  266   HH12  ARG  31          2HH1      ARG  31   7.247  -2.627  13.146
  267   HH21  ARG  31          1HH2      ARG  31   8.518   0.569  12.459
  268   HH22  ARG  31          2HH2      ARG  31   8.446  -0.730  13.608
  269    H    ARG  32           H        ARG  32   1.651  -0.028   7.491
  270    HA   ARG  32           HA       ARG  32   0.049   0.276   9.864
  271    HB2  ARG  32          2HB       ARG  32   2.021   1.781  10.355
  272    HB3  ARG  32          3HB       ARG  32   1.655   2.704   8.901
  273    HG2  ARG  32          2HG       ARG  32  -0.532   3.348   9.869
  274    HG3  ARG  32          3HG       ARG  32  -0.164   2.418  11.322
  275    HD2  ARG  32          2HD       ARG  32   1.872   3.926  11.630
  276    HD3  ARG  32          3HD       ARG  32   1.224   4.929  10.329
  277    HE   ARG  32           HE       ARG  32  -0.794   5.212  11.750
  278   HH11  ARG  32          1HH1      ARG  32   2.278   4.470  13.306
  279   HH12  ARG  32          2HH1      ARG  32   1.814   5.172  14.821
  280   HH21  ARG  32          1HH2      ARG  32  -1.410   6.062  13.770
  281   HH22  ARG  32          2HH2      ARG  32  -0.275   6.074  15.081
  282    H    VAL  33           H        VAL  33  -1.950   1.338   9.390
  283    HA   VAL  33           HA       VAL  33  -2.436   2.093   6.554
  284    HB   VAL  33           HB       VAL  33  -4.474   1.048   8.590
  285   HG11  VAL  33          1HG1      VAL  33  -6.071   0.995   6.697
  286   HG12  VAL  33          2HG1      VAL  33  -4.851   1.717   5.645
  287   HG13  VAL  33          3HG1      VAL  33  -5.499   2.640   7.002
  288   HG21  VAL  33          1HG2      VAL  33  -2.953  -0.733   7.827
  289   HG22  VAL  33          2HG2      VAL  33  -3.311  -0.329   6.146
  290   HG23  VAL  33          3HG2      VAL  33  -4.581  -0.975   7.188
  291    H    GLN  34           H        GLN  34  -2.949   4.141   6.214
  292    HA   GLN  34           HA       GLN  34  -3.902   5.904   8.403
  293    HB2  GLN  34          2HB       GLN  34  -1.619   6.508   7.633
  294    HB3  GLN  34          3HB       GLN  34  -2.167   6.571   5.963
  295    HG2  GLN  34          2HG       GLN  34  -1.870   8.824   6.929
  296    HG3  GLN  34          3HG       GLN  34  -3.539   8.531   6.446
  297   HE21  GLN  34          1HE2      GLN  34  -1.364   8.770   9.207
  298   HE22  GLN  34          2HE2      GLN  34  -2.588   9.136  10.370
  299    H    LYS  35           H        LYS  35  -5.765   7.051   7.953
  300    HA   LYS  35           HA       LYS  35  -7.160   6.526   5.388
  301    HB2  LYS  35          2HB       LYS  35  -8.084   5.763   7.745
  302    HB3  LYS  35          3HB       LYS  35  -8.488   7.452   7.975
  303    HG2  LYS  35          2HG       LYS  35  -9.542   5.713   5.717
  304    HG3  LYS  35          3HG       LYS  35 -10.394   6.024   7.228
  305    HD2  LYS  35          2HD       LYS  35 -10.373   8.488   6.641
  306    HD3  LYS  35          3HD       LYS  35  -9.694   8.050   5.069
  307    HE2  LYS  35          2HE       LYS  35 -12.063   8.346   4.787
  308    HE3  LYS  35          3HE       LYS  35 -11.740   6.616   4.683
  309    HZ1  LYS  35          1HZ       LYS  35 -12.767   8.048   7.068
  310    HZ2  LYS  35          2HZ       LYS  35 -12.473   6.389   6.973
  311    HZ3  LYS  35          3HZ       LYS  35 -13.680   7.087   6.021
  312    H    GLN  36           H        GLN  36  -7.204   8.253   4.049
  313    HA   GLN  36           HA       GLN  36  -7.274  11.010   5.124
  314    HB2  GLN  36          2HB       GLN  36  -4.953  10.484   4.376
  315    HB3  GLN  36          3HB       GLN  36  -5.559  10.037   2.786
  316    HG2  GLN  36          2HG       GLN  36  -6.337  12.376   2.456
  317    HG3  GLN  36          3HG       GLN  36  -5.654  12.807   4.023
  318   HE21  GLN  36          1HE2      GLN  36  -3.388  12.951   4.232
  319   HE22  GLN  36          2HE2      GLN  36  -2.347  13.002   2.855
  320    H    GLY  37           H        GLY  37  -9.560  10.622   4.800
  321    HA2  GLY  37          2HA       GLY  37 -11.546  10.965   3.732
  322    HA3  GLY  37          3HA       GLY  37 -10.640  11.768   2.461
  323    H    ASN  38           H        ASN  38 -10.735  10.835   0.516
  324    HA   ASN  38           HA       ASN  38 -12.002   8.243   0.159
  325    HB2  ASN  38          2HB       ASN  38 -10.938  10.162  -1.964
  326    HB3  ASN  38          3HB       ASN  38 -12.027   8.797  -2.229
  327   HD21  ASN  38          1HD2      ASN  38 -14.194   8.938  -1.301
  328   HD22  ASN  38          2HD2      ASN  38 -14.910  10.487  -1.037
  329    H    THR  39           H        THR  39  -8.797   9.478   0.286
  330    HA   THR  39           HA       THR  39  -7.616   7.158  -1.102
  331    HB   THR  39           HB       THR  39  -6.242   9.695  -0.095
  332    HG1  THR  39           HG1      THR  39  -7.886   9.383  -2.175
  333   HG21  THR  39          1HG2      THR  39  -5.294   7.546  -2.038
  334   HG22  THR  39          2HG2      THR  39  -4.648   7.839  -0.417
  335   HG23  THR  39          3HG2      THR  39  -4.441   9.046  -1.690
  336    H    ILE  40           H        ILE  40  -7.573   5.492   0.351
  337    HA   ILE  40           HA       ILE  40  -6.592   5.810   3.076
  338    HB   ILE  40           HB       ILE  40  -7.258   3.286   1.484
  339   HG12  ILE  40          2HG1      ILE  40  -8.889   4.710   3.643
  340   HG13  ILE  40          3HG1      ILE  40  -9.219   4.795   1.917
  341   HG21  ILE  40          1HG2      ILE  40  -5.637   2.794   3.272
  342   HG22  ILE  40          2HG2      ILE  40  -7.213   2.105   3.659
  343   HG23  ILE  40          3HG2      ILE  40  -6.682   3.586   4.458
  344   HD11  ILE  40          1HD1      ILE  40  -9.342   2.285   3.584
  345   HD12  ILE  40          2HD1      ILE  40  -9.722   2.426   1.869
  346   HD13  ILE  40          3HD1      ILE  40 -10.712   3.260   3.062
  347    H    ARG  41           H        ARG  41  -4.512   6.187   3.295
  348    HA   ARG  41           HA       ARG  41  -2.460   5.282   1.424
  349    HB2  ARG  41          2HB       ARG  41  -2.364   7.051   3.911
  350    HB3  ARG  41          3HB       ARG  41  -0.977   6.708   2.883
  351    HG2  ARG  41          2HG       ARG  41  -2.094   7.842   0.997
  352    HG3  ARG  41          3HG       ARG  41  -3.486   8.189   2.024
  353    HD2  ARG  41          2HD       ARG  41  -2.297   9.739   3.334
  354    HD3  ARG  41          3HD       ARG  41  -0.723   9.082   2.873
  355    HE   ARG  41           HE       ARG  41  -2.222  10.308   0.716
  356   HH11  ARG  41          1HH1      ARG  41   0.162  10.838   3.254
  357   HH12  ARG  41          2HH1      ARG  41   0.833  12.251   2.499
  358   HH21  ARG  41          1HH2      ARG  41  -1.285  12.128  -0.288
  359   HH22  ARG  41          2HH2      ARG  41   0.009  12.973   0.494
  360    H    VAL  42           H        VAL  42  -2.261   3.043   1.833
  361    HA   VAL  42           HA       VAL  42  -1.710   2.102   4.554
  362    HB   VAL  42           HB       VAL  42  -1.676   0.511   1.941
  363   HG11  VAL  42          1HG1      VAL  42  -1.794  -1.500   3.373
  364   HG12  VAL  42          2HG1      VAL  42  -1.715  -0.489   4.817
  365   HG13  VAL  42          3HG1      VAL  42  -0.334  -0.567   3.722
  366   HG21  VAL  42          1HG2      VAL  42  -3.877   0.768   4.014
  367   HG22  VAL  42          2HG2      VAL  42  -3.886  -0.351   2.646
  368   HG23  VAL  42          3HG2      VAL  42  -3.913   1.392   2.358
  369    H    GLU  43           H        GLU  43   0.276   2.636   5.267
  370    HA   GLU  43           HA       GLU  43   2.685   2.549   3.679
  371    HB2  GLU  43          2HB       GLU  43   2.322   2.583   6.708
  372    HB3  GLU  43          3HB       GLU  43   3.859   2.790   5.865
  373    HG2  GLU  43          2HG       GLU  43   2.925   4.857   4.785
  374    HG3  GLU  43          3HG       GLU  43   1.472   4.658   5.767
  375    H    LEU  44           H        LEU  44   3.982   0.790   3.330
  376    HA   LEU  44           HA       LEU  44   3.706  -1.604   5.051
  377    HB2  LEU  44          2HB       LEU  44   4.122  -1.779   2.046
  378    HB3  LEU  44          3HB       LEU  44   3.997  -3.107   3.180
  379    HG   LEU  44           HG       LEU  44   1.564  -2.073   3.631
  380   HD11  LEU  44          1HD1      LEU  44   1.862  -0.131   2.160
  381   HD12  LEU  44          2HD1      LEU  44   0.519  -1.151   1.655
  382   HD13  LEU  44          3HD1      LEU  44   2.047  -1.207   0.773
  383   HD21  LEU  44          1HD2      LEU  44   1.952  -4.347   2.877
  384   HD22  LEU  44          2HD2      LEU  44   2.198  -3.787   1.221
  385   HD23  LEU  44          3HD2      LEU  44   0.615  -3.620   1.987
  386    H    GLU  45           H        GLU  45   5.603  -3.082   4.705
  387    HA   GLU  45           HA       GLU  45   8.099  -1.519   4.603
  388    HB2  GLU  45          2HB       GLU  45   7.271  -2.597   6.820
  389    HB3  GLU  45          3HB       GLU  45   7.644  -4.149   6.087
  390    HG2  GLU  45          2HG       GLU  45   9.655  -1.915   6.493
  391    HG3  GLU  45          3HG       GLU  45   9.414  -3.237   7.621
  392    H    LEU  46           H        LEU  46   9.553  -2.133   3.134
  393    HA   LEU  46           HA       LEU  46   9.464  -4.729   1.774
  394    HB2  LEU  46          2HB       LEU  46   8.093  -3.095   0.423
  395    HB3  LEU  46          3HB       LEU  46   9.490  -2.078   0.287
  396    HG   LEU  46           HG       LEU  46   9.402  -4.873  -0.918
  397   HD11  LEU  46          1HD1      LEU  46   8.740  -2.254  -2.313
  398   HD12  LEU  46          2HD1      LEU  46   7.592  -3.528  -1.897
  399   HD13  LEU  46          3HD1      LEU  46   8.859  -3.846  -3.077
  400   HD21  LEU  46          1HD2      LEU  46  11.684  -3.992  -0.690
  401   HD22  LEU  46          2HD2      LEU  46  11.227  -2.514  -1.537
  402   HD23  LEU  46          3HD2      LEU  46  11.222  -4.062  -2.389
  403    H    ARG  47           H        ARG  47  11.499  -5.396   1.206
  404    HA   ARG  47           HA       ARG  47  13.623  -3.965   2.674
  405    HB2  ARG  47          2HB       ARG  47  13.451  -6.928   1.941
  406    HB3  ARG  47          3HB       ARG  47  14.546  -6.175   3.100
  407    HG2  ARG  47          2HG       ARG  47  12.591  -5.542   4.496
  408    HG3  ARG  47          3HG       ARG  47  11.534  -6.378   3.362
  409    HD2  ARG  47          2HD       ARG  47  12.480  -8.521   3.956
  410    HD3  ARG  47          3HD       ARG  47  13.757  -7.750   4.917
  411    HE   ARG  47           HE       ARG  47  11.407  -6.819   5.980
  412   HH11  ARG  47          1HH1      ARG  47  12.700 -10.067   5.544
  413   HH12  ARG  47          2HH1      ARG  47  11.868 -10.694   6.931
  414   HH21  ARG  47          1HH2      ARG  47  10.419  -7.623   7.801
  415   HH22  ARG  47          2HH2      ARG  47  10.575  -9.303   8.213
  416    H    THR  48           H        THR  48  14.635  -2.692   1.057
  417    HA   THR  48           HA       THR  48  15.292  -3.725  -1.553
  418    HB   THR  48           HB       THR  48  16.454  -1.285  -0.132
  419    HG1  THR  48           HG1      THR  48  14.283  -0.965  -0.292
  420   HG21  THR  48          1HG2      THR  48  16.323  -1.945  -3.105
  421   HG22  THR  48          2HG2      THR  48  17.788  -1.988  -2.121
  422   HG23  THR  48          3HG2      THR  48  16.960  -0.456  -2.404
  423    H    ASN  49           H        ASN  49  16.387  -5.654  -1.233
  424    HA   ASN  49           HA       ASN  49  17.960  -7.197  -0.730
  425    HB2  ASN  49          2HB       ASN  49  19.898  -4.840  -0.592
  426    HB3  ASN  49          3HB       ASN  49  20.336  -6.529  -0.827
  427   HD21  ASN  49          1HD2      ASN  49  20.762  -4.095  -2.505
  428   HD22  ASN  49          2HD2      ASN  49  20.147  -4.513  -4.064
  429    H    GLY  50           H        GLY  50  16.389  -6.097   1.388
  430    HA2  GLY  50          2HA       GLY  50  16.304  -6.783   3.653
  431    HA3  GLY  50          3HA       GLY  50  18.052  -6.717   3.750
  432    H    LYS  51           H        LYS  51  17.444  -3.897   2.258
  433    HA   LYS  51           HA       LYS  51  17.661  -2.361   4.691
  434    HB2  LYS  51          2HB       LYS  51  17.432  -1.478   1.789
  435    HB3  LYS  51          3HB       LYS  51  17.657  -0.363   3.129
  436    HG2  LYS  51          2HG       LYS  51  19.624  -2.569   2.429
  437    HG3  LYS  51          3HG       LYS  51  19.731  -0.923   1.821
  438    HD2  LYS  51          2HD       LYS  51  21.228  -0.888   3.616
  439    HD3  LYS  51          3HD       LYS  51  19.770  -0.217   4.341
  440    HE2  LYS  51          2HE       LYS  51  20.891  -1.821   5.840
  441    HE3  LYS  51          3HE       LYS  51  19.291  -2.401   5.390
  442    HZ1  LYS  51          1HZ       LYS  51  21.873  -3.287   4.230
  443    HZ2  LYS  51          2HZ       LYS  51  20.359  -3.826   3.720
  444    HZ3  LYS  51          3HZ       LYS  51  20.900  -4.177   5.282
  445    H    LYS  52           H        LYS  52  16.130  -1.290   5.768
  446    HA   LYS  52           HA       LYS  52  13.373  -1.992   5.233
  447    HB2  LYS  52          2HB       LYS  52  14.614  -2.060   7.507
  448    HB3  LYS  52          3HB       LYS  52  14.443  -0.315   7.547
  449    HG2  LYS  52          2HG       LYS  52  12.106  -2.241   7.372
  450    HG3  LYS  52          3HG       LYS  52  12.755  -1.643   8.881
  451    HD2  LYS  52          2HD       LYS  52  11.563   0.138   6.725
  452    HD3  LYS  52          3HD       LYS  52  10.658  -0.496   8.095
  453    HE2  LYS  52          2HE       LYS  52  11.275   1.763   8.609
  454    HE3  LYS  52          3HE       LYS  52  12.252   0.711   9.627
  455    HZ1  LYS  52          1HZ       LYS  52  14.128   1.083   8.203
  456    HZ2  LYS  52          2HZ       LYS  52  13.486   2.578   8.642
  457    HZ3  LYS  52          3HZ       LYS  52  13.193   1.958   7.099
  458    H    GLU  53           H        GLU  53  12.214  -0.752   3.874
  459    HA   GLU  53           HA       GLU  53  12.162   2.177   4.362
  460    HB2  GLU  53          2HB       GLU  53  12.054   0.801   1.647
  461    HB3  GLU  53          3HB       GLU  53  11.395   2.410   1.891
  462    HG2  GLU  53          2HG       GLU  53  13.531   2.767   0.976
  463    HG3  GLU  53          3HG       GLU  53  13.697   3.110   2.695
  464    H    ASN  54           H        ASN  54  10.191   3.022   4.656
  465    HA   ASN  54           HA       ASN  54   7.793   1.351   4.542
  466    HB2  ASN  54          2HB       ASN  54   8.275   4.155   5.645
  467    HB3  ASN  54          3HB       ASN  54   6.692   3.378   5.631
  468   HD21  ASN  54          1HD2      ASN  54   6.529   3.400   7.891
  469   HD22  ASN  54          2HD2      ASN  54   7.495   2.383   8.903
  470    H    TYR  55           H        TYR  55   6.525   1.383   2.800
  471    HA   TYR  55           HA       TYR  55   6.666   3.580   0.827
  472    HB2  TYR  55          2HB       TYR  55   5.713   0.685   0.557
  473    HB3  TYR  55          3HB       TYR  55   5.626   1.884  -0.730
  474    HD1  TYR  55           HD1      TYR  55   7.369   1.930  -2.290
  475    HD2  TYR  55           HD2      TYR  55   8.167   0.359   1.593
  476    HE1  TYR  55           HE1      TYR  55   9.641   1.270  -3.003
  477    HE2  TYR  55           HE2      TYR  55  10.408  -0.282   0.885
  478    HH   TYR  55           HH       TYR  55  11.625  -0.780  -1.104
  479    H    THR  56           H        THR  56   5.045   4.957   1.032
  480    HA   THR  56           HA       THR  56   2.503   4.241   2.270
  481    HB   THR  56           HB       THR  56   3.456   6.929   1.157
  482    HG1  THR  56           HG1      THR  56   3.898   5.615   3.594
  483   HG21  THR  56          1HG2      THR  56   1.204   6.285   3.099
  484   HG22  THR  56          2HG2      THR  56   1.004   6.838   1.432
  485   HG23  THR  56          3HG2      THR  56   1.732   7.901   2.641
  486    H    VAL  57           H        VAL  57   1.405   3.022   0.859
  487    HA   VAL  57           HA       VAL  57   1.240   3.680  -1.986
  488    HB   VAL  57           HB       VAL  57   0.004   1.320  -0.479
  489   HG11  VAL  57          1HG1      VAL  57   0.418   1.760  -3.463
  490   HG12  VAL  57          2HG1      VAL  57  -1.126   1.790  -2.613
  491   HG13  VAL  57          3HG1      VAL  57  -0.212   0.286  -2.723
  492   HG21  VAL  57          1HG2      VAL  57   2.460   1.256  -0.286
  493   HG22  VAL  57          2HG2      VAL  57   2.619   1.408  -2.038
  494   HG23  VAL  57          3HG2      VAL  57   1.883  -0.038  -1.342
  495    H    GLU  58           H        GLU  58  -0.090   5.259  -2.336
  496    HA   GLU  58           HA       GLU  58  -2.387   5.860  -0.669
  497    HB2  GLU  58          2HB       GLU  58  -1.209   7.314  -3.083
  498    HB3  GLU  58          3HB       GLU  58  -2.431   7.959  -1.987
  499    HG2  GLU  58          2HG       GLU  58  -0.744   7.754  -0.114
  500    HG3  GLU  58          3HG       GLU  58   0.449   7.278  -1.317
  501    H    VAL  59           H        VAL  59  -4.063   4.564  -1.073
  502    HA   VAL  59           HA       VAL  59  -4.845   3.891  -3.860
  503    HB   VAL  59           HB       VAL  59  -5.566   2.385  -1.307
  504   HG11  VAL  59          1HG1      VAL  59  -5.838   1.560  -4.214
  505   HG12  VAL  59          2HG1      VAL  59  -7.154   2.012  -3.128
  506   HG13  VAL  59          3HG1      VAL  59  -6.224   0.544  -2.821
  507   HG21  VAL  59          1HG2      VAL  59  -3.351   1.672  -3.264
  508   HG22  VAL  59          2HG2      VAL  59  -3.888   0.678  -1.903
  509   HG23  VAL  59          3HG2      VAL  59  -3.130   2.244  -1.605
  510    H    GLU  60           H        GLU  60  -6.558   5.074  -4.504
  511    HA   GLU  60           HA       GLU  60  -8.423   6.242  -2.516
  512    HB2  GLU  60          2HB       GLU  60  -7.154   7.841  -3.868
  513    HB3  GLU  60          3HB       GLU  60  -7.714   7.077  -5.351
  514    HG2  GLU  60          2HG       GLU  60 -10.048   7.784  -4.784
  515    HG3  GLU  60          3HG       GLU  60  -9.420   8.619  -3.361
  516    H    ARG  61           H        ARG  61 -10.630   6.141  -2.830
  517    HA   ARG  61           HA       ARG  61 -11.752   3.969  -4.344
  518    HB2  ARG  61          2HB       ARG  61 -12.604   4.762  -2.095
  519    HB3  ARG  61          3HB       ARG  61 -13.177   6.231  -2.869
  520    HG2  ARG  61          2HG       ARG  61 -15.026   4.698  -2.556
  521    HG3  ARG  61          3HG       ARG  61 -14.706   4.866  -4.282
  522    HD2  ARG  61          2HD       ARG  61 -13.701   2.704  -4.405
  523    HD3  ARG  61          3HD       ARG  61 -13.563   2.579  -2.644
  524    HE   ARG  61           HE       ARG  61 -16.253   2.789  -3.764
  525   HH11  ARG  61          1HH1      ARG  61 -13.778   0.663  -2.464
  526   HH12  ARG  61          2HH1      ARG  61 -14.891  -0.617  -2.115
  527   HH21  ARG  61          1HH2      ARG  61 -17.707   1.114  -3.266
  528   HH22  ARG  61          2HH2      ARG  61 -17.121  -0.365  -2.568
  529    H    GLN  62           H        GLN  62 -11.872   4.215  -6.502
  530    HA   GLN  62           HA       GLN  62 -13.226   6.616  -7.611
  531    HB2  GLN  62          2HB       GLN  62 -11.063   4.879  -8.903
  532    HB3  GLN  62          3HB       GLN  62 -12.060   6.003  -9.815
  533    HG2  GLN  62          2HG       GLN  62 -11.205   7.835  -8.242
  534    HG3  GLN  62          3HG       GLN  62 -10.033   6.659  -7.658
  535   HE21  GLN  62          1HE2      GLN  62  -9.616   5.468 -10.352
  536   HE22  GLN  62          2HE2      GLN  62  -8.689   6.630 -11.229
  537    H    GLY  63           H        GLY  63 -15.239   6.119  -8.030
  538    HA2  GLY  63          2HA       GLY  63 -17.126   5.051  -8.767
  539    HA3  GLY  63          3HA       GLY  63 -16.108   3.804  -9.485
  540    H    ASN  64           H        ASN  64 -16.107   1.858  -8.520
  541    HA   ASN  64           HA       ASN  64 -16.894   1.601  -5.659
  542    HB2  ASN  64          2HB       ASN  64 -17.479  -0.431  -7.865
  543    HB3  ASN  64          3HB       ASN  64 -17.988  -0.527  -6.183
  544   HD21  ASN  64          1HD2      ASN  64 -18.506   1.096  -9.241
  545   HD22  ASN  64          2HD2      ASN  64 -20.051   1.769  -8.850
  546    H    THR  65           H        THR  65 -14.311   1.583  -7.569
  547    HA   THR  65           HA       THR  65 -13.066  -0.894  -6.499
  548    HB   THR  65           HB       THR  65 -11.425  -0.664  -8.392
  549    HG1  THR  65           HG1      THR  65 -12.183   1.754  -8.597
  550   HG21  THR  65          1HG2      THR  65 -14.321  -0.740  -9.333
  551   HG22  THR  65          2HG2      THR  65 -13.421  -2.116  -8.681
  552   HG23  THR  65          3HG2      THR  65 -12.937  -1.372 -10.211
  553    H    TRP  66           H        TRP  66 -11.056  -0.778  -5.530
  554    HA   TRP  66           HA       TRP  66 -10.044   1.839  -4.653
  555    HB2  TRP  66          2HB       TRP  66  -9.474  -1.016  -3.723
  556    HB3  TRP  66          3HB       TRP  66  -8.583   0.384  -3.133
  557    HD1  TRP  66           HD1      TRP  66 -11.684  -1.576  -2.427
  558    HE1  TRP  66           HE1      TRP  66 -13.067  -0.391  -0.605
  559    HE3  TRP  66           HE3      TRP  66  -9.256   2.930  -2.343
  560    HZ2  TRP  66           HZ2      TRP  66 -13.132   2.118   0.677
  561    HZ3  TRP  66           HZ3      TRP  66 -10.047   4.675  -0.798
  562    HH2  TRP  66           HH2      TRP  66 -11.949   4.273   0.685
  563    H    THR  67           H        THR  67  -8.533   2.728  -5.892
  564    HA   THR  67           HA       THR  67  -6.823   1.039  -7.637
  565    HB   THR  67           HB       THR  67  -8.537   2.401  -8.856
  566    HG1  THR  67           HG1      THR  67  -6.398   1.929  -9.745
  567   HG21  THR  67          1HG2      THR  67  -7.045   4.841  -7.819
  568   HG22  THR  67          2HG2      THR  67  -8.676   4.360  -7.339
  569   HG23  THR  67          3HG2      THR  67  -8.347   4.849  -9.004
  570    H    VAL  68           H        VAL  68  -4.656   1.220  -7.364
  571    HA   VAL  68           HA       VAL  68  -3.456   2.952  -5.432
  572    HB   VAL  68           HB       VAL  68  -2.101   1.285  -7.612
  573   HG11  VAL  68          1HG1      VAL  68  -0.036   1.500  -6.255
  574   HG12  VAL  68          2HG1      VAL  68  -0.876   2.583  -5.143
  575   HG13  VAL  68          3HG1      VAL  68  -0.603   3.076  -6.815
  576   HG21  VAL  68          1HG2      VAL  68  -1.669  -0.359  -5.814
  577   HG22  VAL  68          2HG2      VAL  68  -3.398  -0.115  -6.061
  578   HG23  VAL  68          3HG2      VAL  68  -2.590   0.632  -4.680
  579    H    LYS  69           H        LYS  69  -3.470   5.053  -5.786
  580    HA   LYS  69           HA       LYS  69  -3.363   6.426  -8.271
  581    HB2  LYS  69          2HB       LYS  69  -2.632   7.484  -5.497
  582    HB3  LYS  69          3HB       LYS  69  -3.100   8.453  -6.893
  583    HG2  LYS  69          2HG       LYS  69  -4.905   6.467  -5.472
  584    HG3  LYS  69          3HG       LYS  69  -4.905   8.206  -5.188
  585    HD2  LYS  69          2HD       LYS  69  -5.518   6.918  -7.882
  586    HD3  LYS  69          3HD       LYS  69  -6.742   7.403  -6.705
  587    HE2  LYS  69          2HE       LYS  69  -5.844   9.753  -6.835
  588    HE3  LYS  69          3HE       LYS  69  -4.793   9.224  -8.153
  589    HZ1  LYS  69          1HZ       LYS  69  -7.759   9.085  -8.148
  590    HZ2  LYS  69          2HZ       LYS  69  -6.746   8.612  -9.422
  591    HZ3  LYS  69          3HZ       LYS  69  -6.827  10.234  -8.962
  592    H    ARG  70           H        ARG  70  -0.997   5.924  -5.688
  593    HA   ARG  70           HA       ARG  70   1.254   5.654  -7.444
  594    HB2  ARG  70          2HB       ARG  70   2.540   7.604  -6.676
  595    HB3  ARG  70          3HB       ARG  70   1.043   8.137  -7.432
  596    HG2  ARG  70          2HG       ARG  70   0.040   8.518  -5.208
  597    HG3  ARG  70          3HG       ARG  70   1.528   7.961  -4.438
  598    HD2  ARG  70          2HD       ARG  70   2.757   9.855  -5.483
  599    HD3  ARG  70          3HD       ARG  70   1.243  10.415  -6.212
  600    HE   ARG  70           HE       ARG  70   1.169  10.066  -3.348
  601   HH11  ARG  70          1HH1      ARG  70   1.806  12.397  -5.896
  602   HH12  ARG  70          2HH1      ARG  70   1.543  13.762  -4.861
  603   HH21  ARG  70          1HH2      ARG  70   0.826  11.818  -2.014
  604   HH22  ARG  70          2HH2      ARG  70   0.986  13.431  -2.644
  605    H    ILE  71           H        ILE  71   3.259   5.284  -6.191
  606    HA   ILE  71           HA       ILE  71   2.816   4.380  -3.399
  607    HB   ILE  71           HB       ILE  71   4.572   3.060  -5.532
  608   HG12  ILE  71          2HG1      ILE  71   2.029   2.150  -4.106
  609   HG13  ILE  71          3HG1      ILE  71   2.198   2.515  -5.815
  610   HG21  ILE  71          1HG2      ILE  71   5.155   1.387  -3.812
  611   HG22  ILE  71          2HG2      ILE  71   4.256   2.307  -2.604
  612   HG23  ILE  71          3HG2      ILE  71   5.703   3.000  -3.342
  613   HD11  ILE  71          1HD1      ILE  71   2.034   0.152  -5.452
  614   HD12  ILE  71          2HD1      ILE  71   3.418   0.175  -4.361
  615   HD13  ILE  71          3HD1      ILE  71   3.635   0.546  -6.075
  616    H    THR  72           H        THR  72   3.775   5.865  -2.163
  617    HA   THR  72           HA       THR  72   6.090   7.403  -3.081
  618    HB   THR  72           HB       THR  72   4.350   7.743  -0.578
  619    HG1  THR  72           HG1      THR  72   3.076   9.005  -1.782
  620   HG21  THR  72          1HG2      THR  72   5.293  10.014  -0.454
  621   HG22  THR  72          2HG2      THR  72   6.284   9.711  -1.880
  622   HG23  THR  72          3HG2      THR  72   6.600   8.826  -0.387
  623    H    ARG  73           H        ARG  73   7.945   6.204  -2.768
  624    HA   ARG  73           HA       ARG  73   8.456   4.629  -0.384
  625    HB2  ARG  73          2HB       ARG  73   9.435   3.989  -2.581
  626    HB3  ARG  73          3HB       ARG  73  10.334   5.502  -2.632
  627    HG2  ARG  73          2HG       ARG  73  11.631   4.797  -0.635
  628    HG3  ARG  73          3HG       ARG  73  10.725   3.283  -0.587
  629    HD2  ARG  73          2HD       ARG  73  11.612   2.744  -2.865
  630    HD3  ARG  73          3HD       ARG  73  12.591   4.210  -2.795
  631    HE   ARG  73           HE       ARG  73  12.898   2.028  -0.812
  632   HH11  ARG  73          1HH1      ARG  73  14.331   4.201  -3.174
  633   HH12  ARG  73          2HH1      ARG  73  15.957   3.720  -2.809
  634   HH21  ARG  73          1HH2      ARG  73  15.044   1.350  -0.391
  635   HH22  ARG  73          2HH2      ARG  73  16.364   2.107  -1.236
  636    H    THR  74           H        THR  74   9.408   5.358   1.490
  637    HA   THR  74           HA       THR  74  10.458   8.075   1.674
  638    HB   THR  74           HB       THR  74   9.114   7.015   3.547
  639    HG1  THR  74           HG1      THR  74  10.456   8.817   3.924
  640   HG21  THR  74          1HG2      THR  74  11.661   5.449   4.126
  641   HG22  THR  74          2HG2      THR  74  10.151   4.746   3.538
  642   HG23  THR  74          3HG2      THR  74  10.219   5.502   5.132
  643    H    VAL  75           H        VAL  75  12.636   8.564   2.229
  644    HA   VAL  75           HA       VAL  75  14.643   6.442   1.705
  645    HB   VAL  75           HB       VAL  75  14.456   8.164  -0.147
  646   HG11  VAL  75          1HG1      VAL  75  15.600  10.124   1.871
  647   HG12  VAL  75          2HG1      VAL  75  13.977  10.173   1.181
  648   HG13  VAL  75          3HG1      VAL  75  15.381  10.418   0.142
  649   HG21  VAL  75          1HG2      VAL  75  16.499   6.843   0.118
  650   HG22  VAL  75          2HG2      VAL  75  17.151   8.032   1.248
  651   HG23  VAL  75          3HG2      VAL  75  16.886   8.471  -0.442
  652    H    GLY  76           H        GLY  76  16.498   6.454   3.051
  653    HA2  GLY  76          2HA       GLY  76  16.083   7.249   5.744
  654    HA3  GLY  76          3HA       GLY  76  17.574   6.609   5.073
  655    H    SER  77           H        SER  77  18.171   8.543   3.180
  656    HA   SER  77           HA       SER  77  18.269  11.168   4.475
  657    HB2  SER  77          2HB       SER  77  20.289   9.893   5.292
  658    HB3  SER  77          3HB       SER  77  20.822   9.720   3.618
  659    HG   SER  77           HG       SER  77  21.692  11.607   3.864
  660    H    LEU  78           H        LEU  78  19.434  12.766   2.916
  661    HA   LEU  78           HA       LEU  78  19.053  12.180   0.080
  662    HB2  LEU  78          2HB       LEU  78  17.348  14.159  -0.058
  663    HB3  LEU  78          3HB       LEU  78  16.777  12.590   0.468
  664    HG   LEU  78           HG       LEU  78  16.997  13.471   2.900
  665   HD11  LEU  78          1HD1      LEU  78  16.882  15.888   3.260
  666   HD12  LEU  78          2HD1      LEU  78  17.136  16.169   1.536
  667   HD13  LEU  78          3HD1      LEU  78  18.404  15.419   2.504
  668   HD21  LEU  78          1HD2      LEU  78  14.810  14.566   2.876
  669   HD22  LEU  78          2HD2      LEU  78  14.822  13.155   1.822
  670   HD23  LEU  78          3HD2      LEU  78  14.913  14.774   1.124
  671    H    GLU  79           H        GLU  79  21.254  13.062   1.821
  672    HA   GLU  79           HA       GLU  79  21.934  15.666   0.592
  673    HB2  GLU  79          2HB       GLU  79  22.949  16.342   2.825
  674    HB3  GLU  79          3HB       GLU  79  21.196  16.268   2.786
  675    HG2  GLU  79          2HG       GLU  79  21.895  15.384   4.885
  676    HG3  GLU  79          3HG       GLU  79  21.308  14.035   3.921
  677    H    HIS  80           H        HIS  80  24.279  16.210   1.081
  678    HA   HIS  80           HA       HIS  80  26.068  13.979   1.685
  679    HB2  HIS  80          2HB       HIS  80  27.664  14.622  -0.128
  680    HB3  HIS  80          3HB       HIS  80  26.135  14.063  -0.792
  681    HD1  HIS  80           HD1      HIS  80  28.425  16.957  -0.736
  682    HD2  HIS  80           HD2      HIS  80  24.536  16.168  -1.952
  683    HE1  HIS  80           HE1      HIS  80  27.747  18.919  -2.144
  684    HE2  HIS  80           HE2      HIS  80  25.345  18.483  -2.740
  685    H    HIS  81           H        HIS  81  26.723  14.755   3.596
  686    HA   HIS  81           HA       HIS  81  26.635  17.466   4.368
  687    HB2  HIS  81          2HB       HIS  81  27.698  16.738   6.484
  688    HB3  HIS  81          3HB       HIS  81  26.393  15.653   6.019
  689    HD1  HIS  81           HD1      HIS  81  27.025  13.250   5.339
  690    HD2  HIS  81           HD2      HIS  81  30.277  15.556   6.517
  691    HE1  HIS  81           HE1      HIS  81  28.919  11.639   5.684
  692    HE2  HIS  81           HE2      HIS  81  30.908  13.091   6.140
  693    H    HIS  82           H        HIS  82  28.156  19.036   4.522
  694    HA   HIS  82           HA       HIS  82  30.709  18.791   3.203
  695    HB2  HIS  82          2HB       HIS  82  29.626  21.069   4.941
  696    HB3  HIS  82          3HB       HIS  82  31.021  21.170   3.866
  697    HD1  HIS  82           HD1      HIS  82  28.296  22.874   3.747
  698    HD2  HIS  82           HD2      HIS  82  29.380  19.745   1.238
  699    HE1  HIS  82           HE1      HIS  82  26.965  23.207   1.640
  700    HE2  HIS  82           HE2      HIS  82  27.681  21.330   0.129
  701    H    HIS  83           H        HIS  83  32.721  19.468   4.427
  702    HA   HIS  83           HA       HIS  83  34.416  18.631   5.600
  703    HB2  HIS  83          2HB       HIS  83  34.481  18.956   8.007
  704    HB3  HIS  83          3HB       HIS  83  33.611  20.295   7.279
  705    HD1  HIS  83           HD1      HIS  83  31.296  20.779   8.175
  706    HD2  HIS  83           HD2      HIS  83  32.714  17.090   9.469
  707    HE1  HIS  83           HE1      HIS  83  29.648  19.985   9.887
  708    HE2  HIS  83           HE2      HIS  83  30.564  17.791  10.704
  709    H    HIS  84           H        HIS  84  35.092  16.955   7.438
  710    HA   HIS  84           HA       HIS  84  33.506  14.464   7.178
  711    HB2  HIS  84          2HB       HIS  84  36.543  14.661   6.850
  712    HB3  HIS  84          3HB       HIS  84  35.604  13.175   6.810
  713    HD1  HIS  84           HD1      HIS  84  37.212  15.402   4.592
  714    HD2  HIS  84           HD2      HIS  84  33.556  13.436   4.512
  715    HE1  HIS  84           HE1      HIS  84  36.513  15.376   2.185
  716    HE2  HIS  84           HE2      HIS  84  34.213  14.374   2.203
  717    H    HIS  85           H        HIS  85  33.755  13.002   8.937
  718    HA   HIS  85           HA       HIS  85  34.404  14.239  11.489
  719    HB2  HIS  85          2HB       HIS  85  33.183  11.531  10.793
  720    HB3  HIS  85          3HB       HIS  85  33.511  12.040  12.442
  721    HD1  HIS  85           HD1      HIS  85  31.509  12.919  13.578
  722    HD2  HIS  85           HD2      HIS  85  31.339  13.623   9.485
  723    HE1  HIS  85           HE1      HIS  85  29.248  13.920  13.158
  724    HE2  HIS  85           HE2      HIS  85  29.222  14.452  10.705
  Start of MODEL   16
    1    H1   MET   1          1H        MET   1 -24.419  -4.802   4.595
    2    H2   MET   1          2H        MET   1 -25.070  -3.332   5.083
    3    H3   MET   1          3H        MET   1 -25.541  -4.755   5.856
    4    HA   MET   1           HA       MET   1 -24.044  -3.564   7.246
    5    HB2  MET   1          2HB       MET   1 -23.927  -6.023   7.309
    6    HB3  MET   1          3HB       MET   1 -22.799  -6.038   5.962
    7    HG2  MET   1          2HG       MET   1 -21.101  -4.952   7.347
    8    HG3  MET   1          3HG       MET   1 -22.238  -4.842   8.686
    9    HE1  MET   1          1HE       MET   1 -23.716  -7.696   8.554
   10    HE2  MET   1          2HE       MET   1 -23.148  -6.932  10.041
   11    HE3  MET   1          3HE       MET   1 -22.710  -8.602   9.677
   12    HA   PRO   2           HA       PRO   2 -21.119  -0.929   4.923
   13    HB2  PRO   2          2HB       PRO   2 -19.969  -0.371   7.649
   14    HB3  PRO   2          3HB       PRO   2 -20.568   0.767   6.422
   15    HG2  PRO   2          2HG       PRO   2 -21.981   0.281   8.634
   16    HG3  PRO   2          3HG       PRO   2 -22.792   0.518   7.067
   17    HD2  PRO   2          2HD       PRO   2 -22.226  -2.058   8.533
   18    HD3  PRO   2          3HD       PRO   2 -23.686  -1.559   7.646
   19    H    SER   3           H        SER   3 -19.668  -2.118   3.831
   20    HA   SER   3           HA       SER   3 -17.900  -4.056   5.065
   21    HB2  SER   3          2HB       SER   3 -18.081  -3.106   2.167
   22    HB3  SER   3          3HB       SER   3 -17.181  -4.515   2.738
   23    HG   SER   3           HG       SER   3 -18.963  -5.608   2.710
   24    H    GLU   4           H        GLU   4 -17.665  -0.965   5.438
   25    HA   GLU   4           HA       GLU   4 -15.454   0.178   4.335
   26    HB2  GLU   4          2HB       GLU   4 -15.389   1.618   6.378
   27    HB3  GLU   4          3HB       GLU   4 -17.019   1.418   5.738
   28    HG2  GLU   4          2HG       GLU   4 -17.448  -0.340   7.450
   29    HG3  GLU   4          3HG       GLU   4 -15.844  -0.048   8.119
   30    H    GLU   5           H        GLU   5 -15.526  -2.127   7.033
   31    HA   GLU   5           HA       GLU   5 -12.758  -1.863   7.745
   32    HB2  GLU   5          2HB       GLU   5 -14.785  -4.019   8.441
   33    HB3  GLU   5          3HB       GLU   5 -13.218  -3.811   9.220
   34    HG2  GLU   5          2HG       GLU   5 -15.418  -1.726   9.218
   35    HG3  GLU   5          3HG       GLU   5 -15.160  -2.886  10.519
   36    H    GLU   6           H        GLU   6 -14.671  -4.066   5.767
   37    HA   GLU   6           HA       GLU   6 -12.551  -5.826   5.021
   38    HB2  GLU   6          2HB       GLU   6 -14.928  -6.505   4.868
   39    HB3  GLU   6          3HB       GLU   6 -15.214  -5.288   3.628
   40    HG2  GLU   6          2HG       GLU   6 -13.653  -6.462   2.116
   41    HG3  GLU   6          3HG       GLU   6 -13.338  -7.664   3.364
   42    H    GLU   7           H        GLU   7 -13.558  -2.655   3.962
   43    HA   GLU   7           HA       GLU   7 -12.389  -2.673   1.398
   44    HB2  GLU   7          2HB       GLU   7 -12.765  -0.276   3.243
   45    HB3  GLU   7          3HB       GLU   7 -12.326  -0.188   1.542
   46    HG2  GLU   7          2HG       GLU   7 -14.966  -0.967   2.768
   47    HG3  GLU   7          3HG       GLU   7 -14.626   0.274   1.568
   48    H    LYS   8           H        LYS   8 -11.010  -1.635   4.583
   49    HA   LYS   8           HA       LYS   8  -8.439  -1.023   3.572
   50    HB2  LYS   8          2HB       LYS   8  -9.253  -1.829   6.386
   51    HB3  LYS   8          3HB       LYS   8  -7.620  -1.347   5.954
   52    HG2  LYS   8          2HG       LYS   8  -8.399   0.668   6.738
   53    HG3  LYS   8          3HG       LYS   8  -8.820   0.838   5.036
   54    HD2  LYS   8          2HD       LYS   8 -10.692   1.583   6.343
   55    HD3  LYS   8          3HD       LYS   8 -11.154   0.050   5.609
   56    HE2  LYS   8          2HE       LYS   8 -11.894   0.159   7.941
   57    HE3  LYS   8          3HE       LYS   8 -10.697  -1.118   7.730
   58    HZ1  LYS   8          1HZ       LYS   8 -10.132   1.587   8.822
   59    HZ2  LYS   8          2HZ       LYS   8  -9.035   0.311   8.703
   60    HZ3  LYS   8          3HZ       LYS   8 -10.355   0.195   9.748
   61    H    ARG   9           H        ARG   9  -9.876  -4.108   4.425
   62    HA   ARG   9           HA       ARG   9  -7.533  -5.718   4.431
   63    HB2  ARG   9          2HB       ARG   9 -10.336  -6.491   3.505
   64    HB3  ARG   9          3HB       ARG   9  -9.036  -7.624   3.866
   65    HG2  ARG   9          2HG       ARG   9  -9.062  -6.922   6.221
   66    HG3  ARG   9          3HG       ARG   9 -10.345  -5.758   5.872
   67    HD2  ARG   9          2HD       ARG   9 -11.801  -7.681   5.146
   68    HD3  ARG   9          3HD       ARG   9 -10.524  -8.789   5.669
   69    HE   ARG   9           HE       ARG   9 -10.925  -7.354   7.890
   70   HH11  ARG   9          1HH1      ARG   9 -13.260  -8.959   5.795
   71   HH12  ARG   9          2HH1      ARG   9 -14.392  -9.240   7.080
   72   HH21  ARG   9          1HH2      ARG   9 -12.401  -7.733   9.558
   73   HH22  ARG   9          2HH2      ARG   9 -13.899  -8.540   9.216
   74    H    GLN  10           H        GLN  10  -9.739  -4.735   1.835
   75    HA   GLN  10           HA       GLN  10  -8.377  -5.994  -0.325
   76    HB2  GLN  10          2HB       GLN  10 -10.316  -3.631  -0.340
   77    HB3  GLN  10          3HB       GLN  10  -9.830  -4.554  -1.763
   78    HG2  GLN  10          2HG       GLN  10 -10.926  -6.555  -0.900
   79    HG3  GLN  10          3HG       GLN  10 -11.295  -5.736   0.617
   80   HE21  GLN  10          1HE2      GLN  10 -12.952  -4.230   0.675
   81   HE22  GLN  10          2HE2      GLN  10 -14.116  -4.052  -0.587
   82    H    VAL  11           H        VAL  11  -8.113  -2.805   1.198
   83    HA   VAL  11           HA       VAL  11  -6.711  -1.462  -0.869
   84    HB   VAL  11           HB       VAL  11  -6.944  -0.818   2.117
   85   HG11  VAL  11          1HG1      VAL  11  -4.931   0.276   1.195
   86   HG12  VAL  11          2HG1      VAL  11  -6.180   1.460   1.574
   87   HG13  VAL  11          3HG1      VAL  11  -5.898   0.980  -0.099
   88   HG21  VAL  11          1HG2      VAL  11  -8.603   0.846   1.414
   89   HG22  VAL  11          2HG2      VAL  11  -9.072  -0.753   0.847
   90   HG23  VAL  11          3HG2      VAL  11  -8.365   0.400  -0.277
   91    H    LYS  12           H        LYS  12  -5.537  -2.920   2.215
   92    HA   LYS  12           HA       LYS  12  -2.785  -2.361   1.780
   93    HB2  LYS  12          2HB       LYS  12  -3.991  -4.577   3.486
   94    HB3  LYS  12          3HB       LYS  12  -2.321  -4.018   3.560
   95    HG2  LYS  12          2HG       LYS  12  -3.200  -1.755   4.246
   96    HG3  LYS  12          3HG       LYS  12  -4.808  -2.478   4.359
   97    HD2  LYS  12          2HD       LYS  12  -2.344  -3.254   5.968
   98    HD3  LYS  12          3HD       LYS  12  -3.762  -2.401   6.566
   99    HE2  LYS  12          2HE       LYS  12  -3.642  -5.278   5.620
  100    HE3  LYS  12          3HE       LYS  12  -3.866  -4.712   7.276
  101    HZ1  LYS  12          1HZ       LYS  12  -5.938  -5.399   6.254
  102    HZ2  LYS  12          2HZ       LYS  12  -5.758  -4.242   5.042
  103    HZ3  LYS  12          3HZ       LYS  12  -5.972  -3.758   6.646
  104    H    GLN  13           H        GLN  13  -4.864  -5.059   0.877
  105    HA   GLN  13           HA       GLN  13  -2.851  -6.851  -0.008
  106    HB2  GLN  13          2HB       GLN  13  -5.124  -7.648   0.430
  107    HB3  GLN  13          3HB       GLN  13  -5.785  -6.592  -0.815
  108    HG2  GLN  13          2HG       GLN  13  -4.565  -7.886  -2.547
  109    HG3  GLN  13          3HG       GLN  13  -3.923  -8.941  -1.289
  110   HE21  GLN  13          1HE2      GLN  13  -7.247  -7.743  -1.286
  111   HE22  GLN  13          2HE2      GLN  13  -7.977  -9.273  -1.608
  112    H    VAL  14           H        VAL  14  -4.925  -4.568  -1.865
  113    HA   VAL  14           HA       VAL  14  -3.726  -4.930  -4.378
  114    HB   VAL  14           HB       VAL  14  -5.200  -2.490  -3.255
  115   HG11  VAL  14          1HG1      VAL  14  -4.523  -3.071  -6.166
  116   HG12  VAL  14          2HG1      VAL  14  -3.825  -1.787  -5.175
  117   HG13  VAL  14          3HG1      VAL  14  -5.540  -1.752  -5.583
  118   HG21  VAL  14          1HG2      VAL  14  -7.154  -3.342  -4.499
  119   HG22  VAL  14          2HG2      VAL  14  -6.573  -4.558  -3.361
  120   HG23  VAL  14          3HG2      VAL  14  -6.208  -4.720  -5.078
  121    H    ALA  15           H        ALA  15  -2.894  -2.808  -1.675
  122    HA   ALA  15           HA       ALA  15  -0.927  -1.216  -2.934
  123    HB1  ALA  15          1HB       ALA  15  -1.237  -1.943  -0.001
  124    HB2  ALA  15          2HB       ALA  15  -2.041  -0.608  -0.823
  125    HB3  ALA  15          3HB       ALA  15  -0.287  -0.591  -0.649
  126    H    LYS  16           H        LYS  16  -0.685  -4.257  -1.046
  127    HA   LYS  16           HA       LYS  16   2.177  -4.374  -1.122
  128    HB2  LYS  16          2HB       LYS  16   2.046  -6.548  -0.116
  129    HB3  LYS  16          3HB       LYS  16   0.821  -5.553   0.645
  130    HG2  LYS  16          2HG       LYS  16  -0.934  -6.673  -0.568
  131    HG3  LYS  16          3HG       LYS  16   0.230  -7.556  -1.554
  132    HD2  LYS  16          2HD       LYS  16  -0.089  -7.863   1.461
  133    HD3  LYS  16          3HD       LYS  16  -0.788  -8.942   0.253
  134    HE2  LYS  16          2HE       LYS  16   1.511  -9.501  -0.542
  135    HE3  LYS  16          3HE       LYS  16   2.175  -8.467   0.728
  136    HZ1  LYS  16          1HZ       LYS  16   2.152 -10.803   1.387
  137    HZ2  LYS  16          2HZ       LYS  16   0.473 -10.860   1.191
  138    HZ3  LYS  16          3HZ       LYS  16   1.146  -9.876   2.384
  139    H    GLU  17           H        GLU  17  -0.405  -5.550  -3.178
  140    HA   GLU  17           HA       GLU  17   1.058  -7.423  -4.725
  141    HB2  GLU  17          2HB       GLU  17  -1.480  -5.854  -5.355
  142    HB3  GLU  17          3HB       GLU  17  -0.804  -7.055  -6.455
  143    HG2  GLU  17          2HG       GLU  17  -1.095  -8.813  -4.786
  144    HG3  GLU  17          3HG       GLU  17  -1.682  -7.639  -3.612
  145    H    LYS  18           H        LYS  18   0.472  -3.920  -5.104
  146    HA   LYS  18           HA       LYS  18   1.836  -3.744  -7.629
  147    HB2  LYS  18          2HB       LYS  18   1.280  -1.452  -5.709
  148    HB3  LYS  18          3HB       LYS  18   1.646  -1.329  -7.426
  149    HG2  LYS  18          2HG       LYS  18  -0.863  -2.380  -6.128
  150    HG3  LYS  18          3HG       LYS  18  -0.699  -0.956  -7.149
  151    HD2  LYS  18          2HD       LYS  18  -0.295  -2.384  -9.115
  152    HD3  LYS  18          3HD       LYS  18  -0.324  -3.831  -8.099
  153    HE2  LYS  18          2HE       LYS  18  -2.696  -3.286  -7.485
  154    HE3  LYS  18          3HE       LYS  18  -2.645  -1.955  -8.644
  155    HZ1  LYS  18          1HZ       LYS  18  -3.650  -4.007  -9.527
  156    HZ2  LYS  18          2HZ       LYS  18  -2.172  -4.802  -9.338
  157    HZ3  LYS  18          3HZ       LYS  18  -2.303  -3.511 -10.416
  158    H    LEU  19           H        LEU  19   2.817  -3.472  -4.256
  159    HA   LEU  19           HA       LEU  19   5.537  -2.738  -4.745
  160    HB2  LEU  19          2HB       LEU  19   4.131  -4.063  -2.403
  161    HB3  LEU  19          3HB       LEU  19   5.872  -3.819  -2.397
  162    HG   LEU  19           HG       LEU  19   3.796  -1.595  -2.600
  163   HD11  LEU  19          1HD1      LEU  19   5.595  -2.344  -0.273
  164   HD12  LEU  19          2HD1      LEU  19   3.854  -2.622  -0.365
  165   HD13  LEU  19          3HD1      LEU  19   4.479  -0.976  -0.339
  166   HD21  LEU  19          1HD2      LEU  19   5.719  -0.068  -2.334
  167   HD22  LEU  19          2HD2      LEU  19   5.828  -1.013  -3.815
  168   HD23  LEU  19          3HD2      LEU  19   6.826  -1.443  -2.422
  169    H    LEU  20           H        LEU  20   3.809  -5.795  -4.770
  170    HA   LEU  20           HA       LEU  20   6.146  -7.469  -5.091
  171    HB2  LEU  20          2HB       LEU  20   3.168  -8.028  -5.409
  172    HB3  LEU  20          3HB       LEU  20   4.402  -9.258  -5.635
  173    HG   LEU  20           HG       LEU  20   4.018  -7.750  -3.017
  174   HD11  LEU  20          1HD1      LEU  20   2.917 -10.489  -3.730
  175   HD12  LEU  20          2HD1      LEU  20   1.978  -9.013  -3.499
  176   HD13  LEU  20          3HD1      LEU  20   2.852  -9.715  -2.142
  177   HD21  LEU  20          1HD2      LEU  20   6.260  -8.691  -3.293
  178   HD22  LEU  20          2HD2      LEU  20   5.576 -10.284  -3.627
  179   HD23  LEU  20          3HD2      LEU  20   5.371  -9.549  -2.035
  180    H    GLU  21           H        GLU  21   4.127  -5.582  -7.219
  181    HA   GLU  21           HA       GLU  21   4.836  -6.877  -9.684
  182    HB2  GLU  21          2HB       GLU  21   3.936  -4.004  -9.169
  183    HB3  GLU  21          3HB       GLU  21   4.113  -4.719 -10.768
  184    HG2  GLU  21          2HG       GLU  21   2.206  -5.713  -8.642
  185    HG3  GLU  21          3HG       GLU  21   1.759  -4.616  -9.938
  186    H    GLN  22           H        GLN  22   6.160  -4.219  -7.789
  187    HA   GLN  22           HA       GLN  22   8.353  -3.602  -9.554
  188    HB2  GLN  22          2HB       GLN  22   7.921  -2.871  -6.620
  189    HB3  GLN  22          3HB       GLN  22   9.080  -2.114  -7.715
  190    HG2  GLN  22          2HG       GLN  22   7.287  -1.153  -9.043
  191    HG3  GLN  22          3HG       GLN  22   6.077  -2.045  -8.117
  192   HE21  GLN  22          1HE2      GLN  22   5.633  -1.406  -5.987
  193   HE22  GLN  22          2HE2      GLN  22   6.064   0.157  -5.393
  194    H    SER  23           H        SER  23   7.841  -5.626  -6.710
  195    HA   SER  23           HA       SER  23  10.415  -6.938  -6.958
  196    HB2  SER  23          2HB       SER  23  11.086  -5.010  -5.627
  197    HB3  SER  23          3HB       SER  23   9.737  -5.237  -4.514
  198    HG   SER  23           HG       SER  23  10.755  -6.892  -3.595
  199    HA   PRO  24           HA       PRO  24   7.115  -9.790  -5.327
  200    HB2  PRO  24          2HB       PRO  24   7.522 -11.864  -7.050
  201    HB3  PRO  24          3HB       PRO  24   6.582 -10.429  -7.507
  202    HG2  PRO  24          2HG       PRO  24   9.417 -11.113  -8.193
  203    HG3  PRO  24          3HG       PRO  24   8.148 -10.406  -9.218
  204    HD2  PRO  24          2HD       PRO  24  10.136  -8.919  -7.993
  205    HD3  PRO  24          3HD       PRO  24   8.557  -8.259  -8.469
  206    H    ASN  25           H        ASN  25  10.548 -10.022  -5.739
  207    HA   ASN  25           HA       ASN  25  10.924 -12.622  -4.521
  208    HB2  ASN  25          2HB       ASN  25  12.934 -10.448  -5.271
  209    HB3  ASN  25          3HB       ASN  25  13.380 -12.018  -4.618
  210   HD21  ASN  25          1HD2      ASN  25  10.795 -11.578  -7.020
  211   HD22  ASN  25          2HD2      ASN  25  11.642 -12.336  -8.312
  212    H    SER  26           H        SER  26  10.537  -9.409  -3.357
  213    HA   SER  26           HA       SER  26  11.750 -10.014  -0.735
  214    HB2  SER  26          2HB       SER  26  10.711  -7.364  -1.844
  215    HB3  SER  26          3HB       SER  26  11.563  -7.591  -0.312
  216    HG   SER  26           HG       SER  26  12.980  -8.682  -2.317
  217    H    LYS  27           H        LYS  27  10.529 -10.068   1.118
  218    HA   LYS  27           HA       LYS  27   7.700 -10.592   0.938
  219    HB2  LYS  27          2HB       LYS  27   9.738 -10.632   3.187
  220    HB3  LYS  27          3HB       LYS  27   8.026 -10.732   3.555
  221    HG2  LYS  27          2HG       LYS  27   8.886 -12.944   3.591
  222    HG3  LYS  27          3HG       LYS  27   7.882 -12.805   2.160
  223    HD2  LYS  27          2HD       LYS  27  10.868 -12.423   1.870
  224    HD3  LYS  27          3HD       LYS  27  10.247 -14.054   2.107
  225    HE2  LYS  27          2HE       LYS  27   9.464 -12.171  -0.144
  226    HE3  LYS  27          3HE       LYS  27  10.540 -13.557  -0.277
  227    HZ1  LYS  27          1HZ       LYS  27   7.661 -13.670   0.440
  228    HZ2  LYS  27          2HZ       LYS  27   8.691 -14.999   0.306
  229    HZ3  LYS  27          3HZ       LYS  27   8.324 -14.076  -1.059
  230    H    VAL  28           H        VAL  28   6.163  -9.065   1.032
  231    HA   VAL  28           HA       VAL  28   6.805  -6.360   2.009
  232    HB   VAL  28           HB       VAL  28   4.386  -7.319   0.396
  233   HG11  VAL  28          1HG1      VAL  28   3.987  -4.909  -0.019
  234   HG12  VAL  28          2HG1      VAL  28   5.327  -4.502   1.057
  235   HG13  VAL  28          3HG1      VAL  28   3.890  -5.303   1.700
  236   HG21  VAL  28          1HG2      VAL  28   6.466  -7.553  -0.910
  237   HG22  VAL  28          2HG2      VAL  28   6.880  -5.870  -0.581
  238   HG23  VAL  28          3HG2      VAL  28   5.461  -6.255  -1.561
  239    H    GLN  29           H        GLN  29   6.370  -6.135   4.103
  240    HA   GLN  29           HA       GLN  29   4.005  -7.278   5.418
  241    HB2  GLN  29          2HB       GLN  29   6.360  -5.638   6.487
  242    HB3  GLN  29          3HB       GLN  29   5.077  -6.320   7.483
  243    HG2  GLN  29          2HG       GLN  29   7.098  -7.888   5.850
  244    HG3  GLN  29          3HG       GLN  29   7.095  -7.699   7.603
  245   HE21  GLN  29          1HE2      GLN  29   5.556  -9.272   4.892
  246   HE22  GLN  29          2HE2      GLN  29   4.630 -10.401   5.811
  247    H    VAL  30           H        VAL  30   2.826  -5.646   6.921
  248    HA   VAL  30           HA       VAL  30   2.540  -2.982   5.641
  249    HB   VAL  30           HB       VAL  30   0.649  -4.324   7.641
  250   HG11  VAL  30          1HG1      VAL  30   0.240  -1.821   5.946
  251   HG12  VAL  30          2HG1      VAL  30   0.578  -1.845   7.678
  252   HG13  VAL  30          3HG1      VAL  30  -0.926  -2.528   7.070
  253   HG21  VAL  30          1HG2      VAL  30   0.676  -5.573   5.507
  254   HG22  VAL  30          2HG2      VAL  30   0.324  -4.089   4.617
  255   HG23  VAL  30          3HG2      VAL  30  -0.867  -4.749   5.741
  256    H    ARG  31           H        ARG  31   3.035  -1.147   6.830
  257    HA   ARG  31           HA       ARG  31   4.265  -1.539   9.496
  258    HB2  ARG  31          2HB       ARG  31   5.732  -0.563   7.745
  259    HB3  ARG  31          3HB       ARG  31   4.583   0.750   7.496
  260    HG2  ARG  31          2HG       ARG  31   6.481   1.501   8.848
  261    HG3  ARG  31          3HG       ARG  31   4.990   1.558   9.793
  262    HD2  ARG  31          2HD       ARG  31   5.627  -0.651  10.820
  263    HD3  ARG  31          3HD       ARG  31   7.158  -0.572   9.945
  264    HE   ARG  31           HE       ARG  31   6.367   1.507  11.891
  265   HH11  ARG  31          1HH1      ARG  31   8.711  -0.912  10.848
  266   HH12  ARG  31          2HH1      ARG  31   9.890  -0.420  12.025
  267   HH21  ARG  31          1HH2      ARG  31   7.926   2.124  13.401
  268   HH22  ARG  31          2HH2      ARG  31   9.444   1.287  13.457
  269    H    ARG  32           H        ARG  32   2.198   0.788   7.729
  270    HA   ARG  32           HA       ARG  32   0.487   1.257  10.025
  271    HB2  ARG  32          2HB       ARG  32   2.421   2.820  10.376
  272    HB3  ARG  32          3HB       ARG  32   2.135   3.532   8.795
  273    HG2  ARG  32          2HG       ARG  32   1.286   4.965  10.591
  274    HG3  ARG  32          3HG       ARG  32  -0.037   4.407   9.565
  275    HD2  ARG  32          2HD       ARG  32  -0.715   2.781  11.234
  276    HD3  ARG  32          3HD       ARG  32   0.707   3.129  12.222
  277    HE   ARG  32           HE       ARG  32  -0.500   5.528  12.054
  278   HH11  ARG  32          1HH1      ARG  32  -1.776   2.381  13.004
  279   HH12  ARG  32          2HH1      ARG  32  -2.948   3.063  14.086
  280   HH21  ARG  32          1HH2      ARG  32  -1.998   6.387  13.525
  281   HH22  ARG  32          2HH2      ARG  32  -3.073   5.322  14.380
  282    H    VAL  33           H        VAL  33  -1.513   2.140   9.397
  283    HA   VAL  33           HA       VAL  33  -2.001   2.586   6.493
  284    HB   VAL  33           HB       VAL  33  -3.921   1.366   8.553
  285   HG11  VAL  33          1HG1      VAL  33  -4.334   1.811   5.565
  286   HG12  VAL  33          2HG1      VAL  33  -5.135   2.695   6.866
  287   HG13  VAL  33          3HG1      VAL  33  -5.448   0.973   6.649
  288   HG21  VAL  33          1HG2      VAL  33  -2.130  -0.194   7.931
  289   HG22  VAL  33          2HG2      VAL  33  -2.497   0.037   6.218
  290   HG23  VAL  33          3HG2      VAL  33  -3.682  -0.724   7.283
  291    H    GLN  34           H        GLN  34  -2.524   4.670   6.143
  292    HA   GLN  34           HA       GLN  34  -3.853   6.244   8.281
  293    HB2  GLN  34          2HB       GLN  34  -1.853   7.158   6.158
  294    HB3  GLN  34          3HB       GLN  34  -2.729   8.250   7.229
  295    HG2  GLN  34          2HG       GLN  34  -0.774   6.105   8.120
  296    HG3  GLN  34          3HG       GLN  34  -0.426   7.827   8.006
  297   HE21  GLN  34          1HE2      GLN  34  -2.110   5.371   9.844
  298   HE22  GLN  34          2HE2      GLN  34  -2.467   6.360  11.211
  299    H    LYS  35           H        LYS  35  -5.925   6.411   7.785
  300    HA   LYS  35           HA       LYS  35  -6.939   6.428   5.047
  301    HB2  LYS  35          2HB       LYS  35  -7.990   5.321   7.240
  302    HB3  LYS  35          3HB       LYS  35  -8.620   6.928   7.548
  303    HG2  LYS  35          2HG       LYS  35  -9.216   5.203   5.121
  304    HG3  LYS  35          3HG       LYS  35 -10.286   5.477   6.493
  305    HD2  LYS  35          2HD       LYS  35 -10.478   7.857   5.892
  306    HD3  LYS  35          3HD       LYS  35  -9.353   7.625   4.550
  307    HE2  LYS  35          2HE       LYS  35 -11.656   7.667   3.738
  308    HE3  LYS  35          3HE       LYS  35 -10.956   6.072   3.482
  309    HZ1  LYS  35          1HZ       LYS  35 -12.149   5.267   5.403
  310    HZ2  LYS  35          2HZ       LYS  35 -13.236   5.994   4.332
  311    HZ3  LYS  35          3HZ       LYS  35 -12.754   6.812   5.727
  312    H    GLN  36           H        GLN  36  -6.975   8.341   3.942
  313    HA   GLN  36           HA       GLN  36  -7.445  10.886   5.384
  314    HB2  GLN  36          2HB       GLN  36  -4.953  10.299   4.620
  315    HB3  GLN  36          3HB       GLN  36  -5.525  10.770   3.031
  316    HG2  GLN  36          2HG       GLN  36  -5.405  12.505   5.520
  317    HG3  GLN  36          3HG       GLN  36  -4.369  12.621   4.105
  318   HE21  GLN  36          1HE2      GLN  36  -7.489  13.358   5.434
  319   HE22  GLN  36          2HE2      GLN  36  -8.018  14.407   4.170
  320    H    GLY  37           H        GLY  37  -9.621  10.770   4.721
  321    HA2  GLY  37          2HA       GLY  37 -11.347  11.596   3.475
  322    HA3  GLY  37          3HA       GLY  37 -10.166  12.223   2.339
  323    H    ASN  38           H        ASN  38 -10.180  11.346   0.353
  324    HA   ASN  38           HA       ASN  38 -11.681   8.852  -0.147
  325    HB2  ASN  38          2HB       ASN  38 -10.758  11.088  -2.004
  326    HB3  ASN  38          3HB       ASN  38 -11.428   9.577  -2.607
  327   HD21  ASN  38          1HD2      ASN  38 -12.140  12.594  -1.074
  328   HD22  ASN  38          2HD2      ASN  38 -13.858  12.458  -1.126
  329    H    THR  39           H        THR  39  -8.584   9.517   0.619
  330    HA   THR  39           HA       THR  39  -7.464   7.378  -1.101
  331    HB   THR  39           HB       THR  39  -5.974   9.927  -0.315
  332    HG1  THR  39           HG1      THR  39  -7.449   9.254  -2.627
  333   HG21  THR  39          1HG2      THR  39  -5.208   7.698  -2.248
  334   HG22  THR  39          2HG2      THR  39  -4.472   7.993  -0.669
  335   HG23  THR  39          3HG2      THR  39  -4.286   9.177  -1.963
  336    H    ILE  40           H        ILE  40  -7.234   5.763   0.387
  337    HA   ILE  40           HA       ILE  40  -6.132   6.228   3.044
  338    HB   ILE  40           HB       ILE  40  -6.610   3.556   1.623
  339   HG12  ILE  40          2HG1      ILE  40  -8.455   5.106   3.496
  340   HG13  ILE  40          3HG1      ILE  40  -8.735   4.790   1.788
  341   HG21  ILE  40          1HG2      ILE  40  -6.546   2.575   3.891
  342   HG22  ILE  40          2HG2      ILE  40  -6.222   4.166   4.581
  343   HG23  ILE  40          3HG2      ILE  40  -5.033   3.409   3.522
  344   HD11  ILE  40          1HD1      ILE  40  -8.677   2.719   3.996
  345   HD12  ILE  40          2HD1      ILE  40  -8.948   2.392   2.280
  346   HD13  ILE  40          3HD1      ILE  40 -10.105   3.365   3.184
  347    H    ARG  41           H        ARG  41  -4.029   6.803   3.039
  348    HA   ARG  41           HA       ARG  41  -2.063   5.682   1.198
  349    HB2  ARG  41          2HB       ARG  41  -1.872   7.723   3.452
  350    HB3  ARG  41          3HB       ARG  41  -0.491   7.204   2.492
  351    HG2  ARG  41          2HG       ARG  41  -1.598   8.086   0.451
  352    HG3  ARG  41          3HG       ARG  41  -2.951   8.647   1.438
  353    HD2  ARG  41          2HD       ARG  41  -1.555  10.240   2.585
  354    HD3  ARG  41          3HD       ARG  41  -0.083   9.544   1.902
  355    HE   ARG  41           HE       ARG  41  -1.622  10.396  -0.253
  356   HH11  ARG  41          1HH1      ARG  41  -0.042  11.921   2.507
  357   HH12  ARG  41          2HH1      ARG  41   0.214  13.426   1.680
  358   HH21  ARG  41          1HH2      ARG  41  -1.219  12.348  -1.345
  359   HH22  ARG  41          2HH2      ARG  41  -0.455  13.669  -0.507
  360    H    VAL  42           H        VAL  42  -1.902   3.544   1.738
  361    HA   VAL  42           HA       VAL  42  -1.342   2.673   4.468
  362    HB   VAL  42           HB       VAL  42  -1.411   1.049   1.873
  363   HG11  VAL  42          1HG1      VAL  42  -1.522  -0.944   3.302
  364   HG12  VAL  42          2HG1      VAL  42  -1.412   0.060   4.754
  365   HG13  VAL  42          3HG1      VAL  42  -0.045  -0.036   3.641
  366   HG21  VAL  42          1HG2      VAL  42  -3.607   2.011   2.394
  367   HG22  VAL  42          2HG2      VAL  42  -3.529   1.344   4.028
  368   HG23  VAL  42          3HG2      VAL  42  -3.615   0.261   2.634
  369    H    GLU  43           H        GLU  43   0.620   3.005   5.177
  370    HA   GLU  43           HA       GLU  43   3.021   2.984   3.517
  371    HB2  GLU  43          2HB       GLU  43   2.713   3.284   6.541
  372    HB3  GLU  43          3HB       GLU  43   4.148   3.665   5.588
  373    HG2  GLU  43          2HG       GLU  43   2.914   5.472   4.436
  374    HG3  GLU  43          3HG       GLU  43   1.464   5.066   5.352
  375    H    LEU  44           H        LEU  44   3.551   0.908   2.907
  376    HA   LEU  44           HA       LEU  44   3.387  -1.293   4.867
  377    HB2  LEU  44          2HB       LEU  44   4.050  -1.433   1.893
  378    HB3  LEU  44          3HB       LEU  44   3.801  -2.791   2.973
  379    HG   LEU  44           HG       LEU  44   1.391  -1.609   3.314
  380   HD11  LEU  44          1HD1      LEU  44   2.135  -0.804   0.495
  381   HD12  LEU  44          2HD1      LEU  44   1.880   0.290   1.858
  382   HD13  LEU  44          3HD1      LEU  44   0.540  -0.669   1.242
  383   HD21  LEU  44          1HD2      LEU  44   1.706  -3.921   2.589
  384   HD22  LEU  44          2HD2      LEU  44   2.043  -3.374   0.946
  385   HD23  LEU  44          3HD2      LEU  44   0.442  -3.123   1.649
  386    H    GLU  45           H        GLU  45   5.250  -2.844   4.836
  387    HA   GLU  45           HA       GLU  45   7.827  -1.382   4.748
  388    HB2  GLU  45          2HB       GLU  45   6.958  -1.892   7.022
  389    HB3  GLU  45          3HB       GLU  45   6.961  -3.612   6.644
  390    HG2  GLU  45          2HG       GLU  45   9.335  -3.705   6.567
  391    HG3  GLU  45          3HG       GLU  45   9.492  -1.949   6.476
  392    H    LEU  46           H        LEU  46   8.748  -2.026   2.922
  393    HA   LEU  46           HA       LEU  46   8.887  -4.892   2.179
  394    HB2  LEU  46          2HB       LEU  46   7.904  -3.162   0.558
  395    HB3  LEU  46          3HB       LEU  46   9.490  -2.443   0.452
  396    HG   LEU  46           HG       LEU  46   8.961  -5.334  -0.373
  397   HD11  LEU  46          1HD1      LEU  46   8.884  -2.881  -2.168
  398   HD12  LEU  46          2HD1      LEU  46   7.509  -3.896  -1.725
  399   HD13  LEU  46          3HD1      LEU  46   8.811  -4.565  -2.703
  400   HD21  LEU  46          1HD2      LEU  46  11.210  -3.435  -1.120
  401   HD22  LEU  46          2HD2      LEU  46  11.001  -5.084  -1.722
  402   HD23  LEU  46          3HD2      LEU  46  11.328  -4.805  -0.014
  403    H    ARG  47           H        ARG  47  10.853  -5.852   2.365
  404    HA   ARG  47           HA       ARG  47  13.142  -4.227   3.291
  405    HB2  ARG  47          2HB       ARG  47  12.538  -7.206   3.553
  406    HB3  ARG  47          3HB       ARG  47  14.049  -6.465   4.079
  407    HG2  ARG  47          2HG       ARG  47  12.854  -5.106   5.728
  408    HG3  ARG  47          3HG       ARG  47  11.302  -5.718   5.151
  409    HD2  ARG  47          2HD       ARG  47  13.481  -7.430   6.398
  410    HD3  ARG  47          3HD       ARG  47  12.078  -6.805   7.263
  411    HE   ARG  47           HE       ARG  47  10.733  -8.103   5.531
  412   HH11  ARG  47          1HH1      ARG  47  13.891  -9.195   6.641
  413   HH12  ARG  47          2HH1      ARG  47  13.551 -10.869   6.332
  414   HH21  ARG  47          1HH2      ARG  47  10.308 -10.311   5.134
  415   HH22  ARG  47          2HH2      ARG  47  11.527 -11.496   5.479
  416    H    THR  48           H        THR  48  14.233  -3.561   1.597
  417    HA   THR  48           HA       THR  48  14.581  -5.170  -0.833
  418    HB   THR  48           HB       THR  48  15.364  -2.266  -0.267
  419    HG1  THR  48           HG1      THR  48  13.338  -1.807  -0.484
  420   HG21  THR  48          1HG2      THR  48  16.561  -3.124  -2.191
  421   HG22  THR  48          2HG2      THR  48  15.280  -2.056  -2.762
  422   HG23  THR  48          3HG2      THR  48  15.082  -3.803  -2.868
  423    H    ASN  49           H        ASN  49  16.324  -6.561  -0.642
  424    HA   ASN  49           HA       ASN  49  18.421  -7.394  -0.394
  425    HB2  ASN  49          2HB       ASN  49  19.189  -4.456  -0.708
  426    HB3  ASN  49          3HB       ASN  49  20.364  -5.767  -0.668
  427   HD21  ASN  49          1HD2      ASN  49  17.909  -4.208  -2.553
  428   HD22  ASN  49          2HD2      ASN  49  18.220  -5.043  -4.027
  429    H    GLY  50           H        GLY  50  16.879  -6.693   1.993
  430    HA2  GLY  50          2HA       GLY  50  17.377  -7.287   4.225
  431    HA3  GLY  50          3HA       GLY  50  19.048  -6.792   3.999
  432    H    LYS  51           H        LYS  51  17.843  -4.243   2.659
  433    HA   LYS  51           HA       LYS  51  17.863  -2.569   4.999
  434    HB2  LYS  51          2HB       LYS  51  17.057  -1.835   2.142
  435    HB3  LYS  51          3HB       LYS  51  17.497  -0.711   3.426
  436    HG2  LYS  51          2HG       LYS  51  19.809  -1.503   3.390
  437    HG3  LYS  51          3HG       LYS  51  19.396  -2.746   2.203
  438    HD2  LYS  51          2HD       LYS  51  19.279   0.271   1.758
  439    HD3  LYS  51          3HD       LYS  51  20.490  -0.833   1.104
  440    HE2  LYS  51          2HE       LYS  51  18.667  -2.013  -0.151
  441    HE3  LYS  51          3HE       LYS  51  17.525  -0.798   0.432
  442    HZ1  LYS  51          1HZ       LYS  51  18.799   0.897  -0.713
  443    HZ2  LYS  51          2HZ       LYS  51  18.315  -0.302  -1.798
  444    HZ3  LYS  51          3HZ       LYS  51  19.913  -0.252  -1.247
  445    H    LYS  52           H        LYS  52  16.137  -2.101   6.227
  446    HA   LYS  52           HA       LYS  52  13.442  -2.918   5.516
  447    HB2  LYS  52          2HB       LYS  52  14.329  -3.248   7.796
  448    HB3  LYS  52          3HB       LYS  52  14.580  -1.515   7.977
  449    HG2  LYS  52          2HG       LYS  52  12.121  -1.167   7.815
  450    HG3  LYS  52          3HG       LYS  52  11.898  -2.916   7.695
  451    HD2  LYS  52          2HD       LYS  52  13.193  -1.478  10.049
  452    HD3  LYS  52          3HD       LYS  52  11.520  -2.039  10.005
  453    HE2  LYS  52          2HE       LYS  52  12.252  -4.359   9.858
  454    HE3  LYS  52          3HE       LYS  52  13.941  -3.860   9.730
  455    HZ1  LYS  52          1HZ       LYS  52  12.189  -3.377  12.079
  456    HZ2  LYS  52          2HZ       LYS  52  13.824  -2.969  11.962
  457    HZ3  LYS  52          3HZ       LYS  52  13.357  -4.591  11.968
  458    H    GLU  53           H        GLU  53  12.311  -1.599   4.192
  459    HA   GLU  53           HA       GLU  53  12.484   1.349   4.516
  460    HB2  GLU  53          2HB       GLU  53  12.112  -0.100   1.851
  461    HB3  GLU  53          3HB       GLU  53  12.297   1.635   2.112
  462    HG2  GLU  53          2HG       GLU  53  14.616   1.150   3.028
  463    HG3  GLU  53          3HG       GLU  53  14.403  -0.512   2.482
  464    H    ASN  54           H        ASN  54  10.573   2.485   4.311
  465    HA   ASN  54           HA       ASN  54   8.067   0.909   4.219
  466    HB2  ASN  54          2HB       ASN  54   8.610   3.632   5.502
  467    HB3  ASN  54          3HB       ASN  54   7.039   2.834   5.457
  468   HD21  ASN  54          1HD2      ASN  54   7.988   0.159   6.018
  469   HD22  ASN  54          2HD2      ASN  54   8.519   0.146   7.663
  470    H    TYR  55           H        TYR  55   6.700   1.264   2.559
  471    HA   TYR  55           HA       TYR  55   7.158   3.553   0.728
  472    HB2  TYR  55          2HB       TYR  55   6.035   0.759   0.174
  473    HB3  TYR  55          3HB       TYR  55   6.081   2.064  -1.006
  474    HD1  TYR  55           HD1      TYR  55   7.995   2.320  -2.396
  475    HD2  TYR  55           HD2      TYR  55   8.349  -0.023   1.163
  476    HE1  TYR  55           HE1      TYR  55  10.250   1.615  -3.076
  477    HE2  TYR  55           HE2      TYR  55  10.599  -0.731   0.475
  478    HH   TYR  55           HH       TYR  55  11.957  -0.926  -1.530
  479    H    THR  56           H        THR  56   5.617   5.050   0.914
  480    HA   THR  56           HA       THR  56   3.004   4.512   2.058
  481    HB   THR  56           HB       THR  56   4.117   7.103   0.868
  482    HG1  THR  56           HG1      THR  56   4.117   6.151   3.564
  483   HG21  THR  56          1HG2      THR  56   2.391   8.223   2.235
  484   HG22  THR  56          2HG2      THR  56   1.770   6.656   2.756
  485   HG23  THR  56          3HG2      THR  56   1.653   7.132   1.060
  486    H    VAL  57           H        VAL  57   1.784   3.359   0.683
  487    HA   VAL  57           HA       VAL  57   1.572   3.997  -2.169
  488    HB   VAL  57           HB       VAL  57   0.284   1.704  -0.600
  489   HG11  VAL  57          1HG1      VAL  57  -0.088   0.682  -2.825
  490   HG12  VAL  57          2HG1      VAL  57   0.564   2.125  -3.604
  491   HG13  VAL  57          3HG1      VAL  57  -0.930   2.225  -2.671
  492   HG21  VAL  57          1HG2      VAL  57   2.049   0.260  -1.556
  493   HG22  VAL  57          2HG2      VAL  57   2.734   1.515  -0.523
  494   HG23  VAL  57          3HG2      VAL  57   2.825   1.674  -2.278
  495    H    GLU  58           H        GLU  58   0.218   5.575  -2.584
  496    HA   GLU  58           HA       GLU  58  -2.108   6.271  -1.023
  497    HB2  GLU  58          2HB       GLU  58  -1.197   7.265  -3.763
  498    HB3  GLU  58          3HB       GLU  58  -2.425   8.018  -2.747
  499    HG2  GLU  58          2HG       GLU  58  -0.663   8.495  -1.036
  500    HG3  GLU  58          3HG       GLU  58   0.538   7.794  -2.119
  501    H    VAL  59           H        VAL  59  -3.767   4.814  -1.139
  502    HA   VAL  59           HA       VAL  59  -4.660   3.819  -3.795
  503    HB   VAL  59           HB       VAL  59  -5.311   2.650  -1.040
  504   HG11  VAL  59          1HG1      VAL  59  -5.797   1.555  -3.838
  505   HG12  VAL  59          2HG1      VAL  59  -7.023   2.177  -2.730
  506   HG13  VAL  59          3HG1      VAL  59  -6.140   0.706  -2.325
  507   HG21  VAL  59          1HG2      VAL  59  -3.736   0.824  -1.581
  508   HG22  VAL  59          2HG2      VAL  59  -2.905   2.382  -1.513
  509   HG23  VAL  59          3HG2      VAL  59  -3.278   1.650  -3.076
  510    H    GLU  60           H        GLU  60  -6.375   4.882  -4.533
  511    HA   GLU  60           HA       GLU  60  -8.012   6.583  -2.763
  512    HB2  GLU  60          2HB       GLU  60  -6.666   7.628  -4.584
  513    HB3  GLU  60          3HB       GLU  60  -7.542   6.679  -5.777
  514    HG2  GLU  60          2HG       GLU  60  -9.623   7.862  -5.220
  515    HG3  GLU  60          3HG       GLU  60  -8.794   8.779  -3.961
  516    H    ARG  61           H        ARG  61 -10.323   6.765  -3.238
  517    HA   ARG  61           HA       ARG  61 -11.539   4.168  -3.786
  518    HB2  ARG  61          2HB       ARG  61 -12.150   5.412  -1.718
  519    HB3  ARG  61          3HB       ARG  61 -12.762   6.748  -2.685
  520    HG2  ARG  61          2HG       ARG  61 -14.592   5.335  -1.838
  521    HG3  ARG  61          3HG       ARG  61 -14.529   5.305  -3.604
  522    HD2  ARG  61          2HD       ARG  61 -13.347   3.124  -3.509
  523    HD3  ARG  61          3HD       ARG  61 -13.448   3.155  -1.744
  524    HE   ARG  61           HE       ARG  61 -15.964   3.348  -3.200
  525   HH11  ARG  61          1HH1      ARG  61 -13.720   1.235  -1.512
  526   HH12  ARG  61          2HH1      ARG  61 -14.898  -0.007  -1.255
  527   HH21  ARG  61          1HH2      ARG  61 -17.488   1.719  -2.875
  528   HH22  ARG  61          2HH2      ARG  61 -17.055   0.263  -2.030
  529    H    GLN  62           H        GLN  62 -12.744   3.748  -5.540
  530    HA   GLN  62           HA       GLN  62 -13.762   5.893  -7.276
  531    HB2  GLN  62          2HB       GLN  62 -11.496   5.166  -8.135
  532    HB3  GLN  62          3HB       GLN  62 -12.110   3.524  -8.303
  533    HG2  GLN  62          2HG       GLN  62 -13.795   4.368  -9.946
  534    HG3  GLN  62          3HG       GLN  62 -13.087   5.978  -9.799
  535   HE21  GLN  62          1HE2      GLN  62 -12.536   6.042 -11.995
  536   HE22  GLN  62          2HE2      GLN  62 -11.255   5.095 -12.663
  537    H    GLY  63           H        GLY  63 -15.835   5.369  -6.597
  538    HA2  GLY  63          2HA       GLY  63 -17.892   4.388  -6.784
  539    HA3  GLY  63          3HA       GLY  63 -17.207   3.281  -7.961
  540    H    ASN  64           H        ASN  64 -16.797   1.205  -7.356
  541    HA   ASN  64           HA       ASN  64 -17.128   0.412  -4.510
  542    HB2  ASN  64          2HB       ASN  64 -17.937  -1.008  -7.078
  543    HB3  ASN  64          3HB       ASN  64 -17.787  -1.876  -5.556
  544   HD21  ASN  64          1HD2      ASN  64 -19.541   0.717  -7.188
  545   HD22  ASN  64          2HD2      ASN  64 -20.937   0.650  -6.175
  546    H    THR  65           H        THR  65 -14.789   0.929  -6.693
  547    HA   THR  65           HA       THR  65 -13.102  -1.378  -5.886
  548    HB   THR  65           HB       THR  65 -11.773  -0.941  -7.969
  549    HG1  THR  65           HG1      THR  65 -12.801   1.346  -8.076
  550   HG21  THR  65          1HG2      THR  65 -13.550  -2.663  -8.031
  551   HG22  THR  65          2HG2      THR  65 -13.390  -1.859  -9.590
  552   HG23  THR  65          3HG2      THR  65 -14.727  -1.435  -8.523
  553    H    TRP  66           H        TRP  66 -10.762  -0.858  -5.781
  554    HA   TRP  66           HA       TRP  66 -10.152   1.910  -4.900
  555    HB2  TRP  66          2HB       TRP  66  -9.005  -0.758  -3.934
  556    HB3  TRP  66          3HB       TRP  66  -8.331   0.812  -3.512
  557    HD1  TRP  66           HD1      TRP  66 -11.178  -1.537  -2.605
  558    HE1  TRP  66           HE1      TRP  66 -12.449  -0.570  -0.586
  559    HE3  TRP  66           HE3      TRP  66  -9.006   3.098  -2.377
  560    HZ2  TRP  66           HZ2      TRP  66 -12.532   1.813   0.902
  561    HZ3  TRP  66           HZ3      TRP  66  -9.742   4.664  -0.625
  562    HH2  TRP  66           HH2      TRP  66 -11.473   4.031   0.984
  563    H    THR  67           H        THR  67  -8.406   2.875  -5.839
  564    HA   THR  67           HA       THR  67  -6.920   1.429  -7.952
  565    HB   THR  67           HB       THR  67  -8.636   2.743  -9.071
  566    HG1  THR  67           HG1      THR  67  -6.638   2.787 -10.109
  567   HG21  THR  67          1HG2      THR  67  -9.165   4.414  -7.318
  568   HG22  THR  67          2HG2      THR  67  -8.841   5.200  -8.864
  569   HG23  THR  67          3HG2      THR  67  -7.613   5.209  -7.595
  570    H    VAL  68           H        VAL  68  -4.759   1.525  -7.617
  571    HA   VAL  68           HA       VAL  68  -3.575   3.222  -5.618
  572    HB   VAL  68           HB       VAL  68  -2.262   1.353  -7.649
  573   HG11  VAL  68          1HG1      VAL  68  -0.203   1.529  -6.284
  574   HG12  VAL  68          2HG1      VAL  68  -0.968   2.761  -5.277
  575   HG13  VAL  68          3HG1      VAL  68  -0.648   3.089  -6.983
  576   HG21  VAL  68          1HG2      VAL  68  -3.676   0.183  -6.019
  577   HG22  VAL  68          2HG2      VAL  68  -2.844   0.982  -4.683
  578   HG23  VAL  68          3HG2      VAL  68  -1.974  -0.161  -5.709
  579    H    LYS  69           H        LYS  69  -3.159   5.275  -5.929
  580    HA   LYS  69           HA       LYS  69  -2.960   6.597  -8.460
  581    HB2  LYS  69          2HB       LYS  69  -2.399   7.591  -5.627
  582    HB3  LYS  69          3HB       LYS  69  -2.540   8.618  -7.052
  583    HG2  LYS  69          2HG       LYS  69  -4.759   6.888  -5.910
  584    HG3  LYS  69          3HG       LYS  69  -4.591   8.626  -5.662
  585    HD2  LYS  69          2HD       LYS  69  -5.007   7.283  -8.371
  586    HD3  LYS  69          3HD       LYS  69  -6.278   8.041  -7.407
  587    HE2  LYS  69          2HE       LYS  69  -3.862   9.458  -8.592
  588    HE3  LYS  69          3HE       LYS  69  -5.521   9.557  -9.183
  589    HZ1  LYS  69          1HZ       LYS  69  -4.977  11.471  -7.842
  590    HZ2  LYS  69          2HZ       LYS  69  -4.566  10.489  -6.529
  591    HZ3  LYS  69          3HZ       LYS  69  -6.167  10.550  -7.070
  592    H    ARG  70           H        ARG  70  -0.644   6.147  -5.753
  593    HA   ARG  70           HA       ARG  70   1.579   5.721  -7.532
  594    HB2  ARG  70          2HB       ARG  70   1.415   8.212  -7.614
  595    HB3  ARG  70          3HB       ARG  70   1.536   8.284  -5.858
  596    HG2  ARG  70          2HG       ARG  70   3.805   7.280  -5.992
  597    HG3  ARG  70          3HG       ARG  70   3.690   7.266  -7.752
  598    HD2  ARG  70          2HD       ARG  70   3.555   9.729  -7.760
  599    HD3  ARG  70          3HD       ARG  70   3.623   9.741  -5.994
  600    HE   ARG  70           HE       ARG  70   5.877   8.734  -6.187
  601   HH11  ARG  70          1HH1      ARG  70   4.654  10.589  -8.923
  602   HH12  ARG  70          2HH1      ARG  70   6.239  10.954  -9.520
  603   HH21  ARG  70          1HH2      ARG  70   7.932   9.171  -7.035
  604   HH22  ARG  70          2HH2      ARG  70   8.088  10.155  -8.457
  605    H    ILE  71           H        ILE  71   3.317   4.793  -6.505
  606    HA   ILE  71           HA       ILE  71   3.226   4.390  -3.575
  607    HB   ILE  71           HB       ILE  71   4.850   2.926  -5.717
  608   HG12  ILE  71          2HG1      ILE  71   2.362   2.082  -4.163
  609   HG13  ILE  71          3HG1      ILE  71   2.466   2.377  -5.891
  610   HG21  ILE  71          1HG2      ILE  71   4.632   2.339  -2.739
  611   HG22  ILE  71          2HG2      ILE  71   6.047   3.003  -3.560
  612   HG23  ILE  71          3HG2      ILE  71   5.504   1.366  -3.923
  613   HD11  ILE  71          1HD1      ILE  71   3.807   0.132  -4.396
  614   HD12  ILE  71          2HD1      ILE  71   3.900   0.422  -6.136
  615   HD13  ILE  71          3HD1      ILE  71   2.356   0.027  -5.387
  616    H    THR  72           H        THR  72   4.249   6.082  -2.663
  617    HA   THR  72           HA       THR  72   6.869   6.999  -3.686
  618    HB   THR  72           HB       THR  72   4.929   8.398  -1.776
  619    HG1  THR  72           HG1      THR  72   4.377   9.652  -3.524
  620   HG21  THR  72          1HG2      THR  72   7.279   9.055  -1.352
  621   HG22  THR  72          2HG2      THR  72   6.376  10.386  -2.078
  622   HG23  THR  72          3HG2      THR  72   7.488   9.437  -3.065
  623    H    ARG  73           H        ARG  73   8.520   6.047  -2.629
  624    HA   ARG  73           HA       ARG  73   8.334   4.754  -0.091
  625    HB2  ARG  73          2HB       ARG  73   9.983   4.016  -1.746
  626    HB3  ARG  73          3HB       ARG  73  10.748   5.600  -1.762
  627    HG2  ARG  73          2HG       ARG  73  11.582   5.283   0.497
  628    HG3  ARG  73          3HG       ARG  73  10.681   3.774   0.667
  629    HD2  ARG  73          2HD       ARG  73  13.106   3.433   0.224
  630    HD3  ARG  73          3HD       ARG  73  12.068   2.692  -0.997
  631    HE   ARG  73           HE       ARG  73  12.784   5.257  -1.884
  632   HH11  ARG  73          1HH1      ARG  73  14.336   2.151  -1.307
  633   HH12  ARG  73          2HH1      ARG  73  15.560   2.411  -2.512
  634   HH21  ARG  73          1HH2      ARG  73  14.362   5.562  -3.484
  635   HH22  ARG  73          2HH2      ARG  73  15.571   4.345  -3.746
  636    H    THR  74           H        THR  74   9.145   5.440   1.905
  637    HA   THR  74           HA       THR  74   8.772   8.144   2.578
  638    HB   THR  74           HB       THR  74   8.393   6.302   4.201
  639    HG1  THR  74           HG1      THR  74   8.708   8.356   5.036
  640   HG21  THR  74          1HG2      THR  74  11.431   6.065   4.387
  641   HG22  THR  74          2HG2      THR  74  10.350   4.845   3.710
  642   HG23  THR  74          3HG2      THR  74  10.260   5.246   5.426
  643    H    VAL  75           H        VAL  75  10.171   9.806   2.797
  644    HA   VAL  75           HA       VAL  75  12.916   9.495   1.815
  645    HB   VAL  75           HB       VAL  75  11.445  11.236   0.835
  646   HG11  VAL  75          1HG1      VAL  75  10.082  11.786   2.785
  647   HG12  VAL  75          2HG1      VAL  75  10.783  13.242   2.081
  648   HG13  VAL  75          3HG1      VAL  75  11.462  12.564   3.563
  649   HG21  VAL  75          1HG2      VAL  75  13.869  11.572   0.737
  650   HG22  VAL  75          2HG2      VAL  75  13.845  12.404   2.295
  651   HG23  VAL  75          3HG2      VAL  75  13.038  13.122   0.899
  652    H    GLY  76           H        GLY  76  14.725  10.299   3.026
  653    HA2  GLY  76          2HA       GLY  76  14.508  11.311   5.719
  654    HA3  GLY  76          3HA       GLY  76  15.025   9.623   5.663
  655    H    SER  77           H        SER  77  15.695  12.360   3.515
  656    HA   SER  77           HA       SER  77  18.529  11.709   3.371
  657    HB2  SER  77          2HB       SER  77  17.167  12.377   1.359
  658    HB3  SER  77          3HB       SER  77  16.970  13.988   2.049
  659    HG   SER  77           HG       SER  77  18.705  13.793   0.501
  660    H    LEU  78           H        LEU  78  19.915  14.025   3.235
  661    HA   LEU  78           HA       LEU  78  20.021  15.049   5.925
  662    HB2  LEU  78          2HB       LEU  78  21.497  15.922   3.410
  663    HB3  LEU  78          3HB       LEU  78  21.858  16.514   5.024
  664    HG   LEU  78           HG       LEU  78  22.201  13.647   4.052
  665   HD11  LEU  78          1HD1      LEU  78  24.293  15.750   4.710
  666   HD12  LEU  78          2HD1      LEU  78  23.885  15.140   3.103
  667   HD13  LEU  78          3HD1      LEU  78  24.615  14.064   4.291
  668   HD21  LEU  78          1HD2      LEU  78  22.813  14.838   6.781
  669   HD22  LEU  78          2HD2      LEU  78  23.263  13.217   6.248
  670   HD23  LEU  78          3HD2      LEU  78  21.563  13.649   6.409
  671    H    GLU  79           H        GLU  79  17.835  15.839   6.030
  672    HA   GLU  79           HA       GLU  79  17.190  18.268   4.460
  673    HB2  GLU  79          2HB       GLU  79  15.374  16.312   5.936
  674    HB3  GLU  79          3HB       GLU  79  14.819  17.750   5.077
  675    HG2  GLU  79          2HG       GLU  79  15.643  16.825   2.951
  676    HG3  GLU  79          3HG       GLU  79  16.261  15.403   3.794
  677    H    HIS  80           H        HIS  80  15.727  19.796   5.682
  678    HA   HIS  80           HA       HIS  80  17.273  20.859   7.841
  679    HB2  HIS  80          2HB       HIS  80  14.693  21.820   6.526
  680    HB3  HIS  80          3HB       HIS  80  15.558  22.727   7.767
  681    HD1  HIS  80           HD1      HIS  80  16.597  24.631   6.568
  682    HD2  HIS  80           HD2      HIS  80  17.058  21.090   4.442
  683    HE1  HIS  80           HE1      HIS  80  18.044  25.205   4.595
  684    HE2  HIS  80           HE2      HIS  80  18.123  23.101   3.235
  685    H    HIS  81           H        HIS  81  17.152  19.607   9.639
  686    HA   HIS  81           HA       HIS  81  14.763  18.615  10.850
  687    HB2  HIS  81          2HB       HIS  81  17.023  17.638  11.265
  688    HB3  HIS  81          3HB       HIS  81  17.496  19.104  12.114
  689    HD1  HIS  81           HD1      HIS  81  16.951  19.212  14.568
  690    HD2  HIS  81           HD2      HIS  81  14.982  16.096  12.652
  691    HE1  HIS  81           HE1      HIS  81  15.850  17.891  16.390
  692    HE2  HIS  81           HE2      HIS  81  14.615  16.052  15.209
  693    H    HIS  82           H        HIS  82  13.446  19.562  12.313
  694    HA   HIS  82           HA       HIS  82  12.185  21.173  13.195
  695    HB2  HIS  82          2HB       HIS  82  13.897  21.340  14.938
  696    HB3  HIS  82          3HB       HIS  82  14.857  22.431  13.948
  697    HD1  HIS  82           HD1      HIS  82  11.423  22.366  15.619
  698    HD2  HIS  82           HD2      HIS  82  14.372  25.057  14.466
  699    HE1  HIS  82           HE1      HIS  82  10.656  24.610  16.449
  700    HE2  HIS  82           HE2      HIS  82  12.347  26.216  15.533
  701    H    HIS  83           H        HIS  83  11.257  21.737  11.276
  702    HA   HIS  83           HA       HIS  83  12.164  24.209   9.923
  703    HB2  HIS  83          2HB       HIS  83  11.490  23.239   7.751
  704    HB3  HIS  83          3HB       HIS  83  12.750  22.277   8.509
  705    HD1  HIS  83           HD1      HIS  83  10.019  21.663   6.500
  706    HD2  HIS  83           HD2      HIS  83  11.184  20.084  10.161
  707    HE1  HIS  83           HE1      HIS  83   8.847  19.448   6.686
  708    HE2  HIS  83           HE2      HIS  83   9.773  18.441   8.787
  709    H    HIS  84           H        HIS  84   9.921  23.222  11.945
  710    HA   HIS  84           HA       HIS  84   8.093  25.301  11.054
  711    HB2  HIS  84          2HB       HIS  84   6.033  24.061  11.259
  712    HB3  HIS  84          3HB       HIS  84   7.068  23.140  10.178
  713    HD1  HIS  84           HD1      HIS  84   5.611  23.056  13.662
  714    HD2  HIS  84           HD2      HIS  84   7.662  20.545  11.063
  715    HE1  HIS  84           HE1      HIS  84   5.476  20.770  14.685
  716    HE2  HIS  84           HE2      HIS  84   6.578  19.255  13.011
  717    H    HIS  85           H        HIS  85   6.730  26.094  12.766
  718    HA   HIS  85           HA       HIS  85   7.911  25.898  15.428
  719    HB2  HIS  85          2HB       HIS  85   5.665  27.645  14.325
  720    HB3  HIS  85          3HB       HIS  85   6.252  27.729  15.985
  721    HD1  HIS  85           HD1      HIS  85   8.056  29.380  16.387
  722    HD2  HIS  85           HD2      HIS  85   7.835  28.329  12.375
  723    HE1  HIS  85           HE1      HIS  85   9.686  30.874  15.208
  724    HE2  HIS  85           HE2      HIS  85   9.378  30.353  12.775
  Start of MODEL   17
    1    H1   MET   1          1H        MET   1 -20.700 -10.690   4.620
    2    H2   MET   1          2H        MET   1 -19.676 -11.425   3.497
    3    H3   MET   1          3H        MET   1 -21.351 -11.594   3.351
    4    HA   MET   1           HA       MET   1 -20.427 -10.019   1.758
    5    HB2  MET   1          2HB       MET   1 -22.296  -8.897   3.889
    6    HB3  MET   1          3HB       MET   1 -21.984  -8.081   2.365
    7    HG2  MET   1          2HG       MET   1 -22.874 -10.129   1.190
    8    HG3  MET   1          3HG       MET   1 -23.372 -10.737   2.773
    9    HE1  MET   1          1HE       MET   1 -26.761  -9.558   1.103
   10    HE2  MET   1          2HE       MET   1 -25.828 -10.940   1.673
   11    HE3  MET   1          3HE       MET   1 -25.384 -10.135   0.166
   12    HA   PRO   2           HA       PRO   2 -17.015  -7.506   3.060
   13    HB2  PRO   2          2HB       PRO   2 -17.063  -5.425   1.253
   14    HB3  PRO   2          3HB       PRO   2 -16.590  -7.078   0.815
   15    HG2  PRO   2          2HG       PRO   2 -19.234  -5.713   0.421
   16    HG3  PRO   2          3HG       PRO   2 -18.314  -6.738  -0.706
   17    HD2  PRO   2          2HD       PRO   2 -20.403  -7.710   0.724
   18    HD3  PRO   2          3HD       PRO   2 -18.993  -8.711   0.310
   19    H    SER   3           H        SER   3 -17.141  -6.559   5.014
   20    HA   SER   3           HA       SER   3 -18.987  -4.434   5.685
   21    HB2  SER   3          2HB       SER   3 -18.296  -6.199   7.329
   22    HB3  SER   3          3HB       SER   3 -16.648  -5.571   7.294
   23    HG   SER   3           HG       SER   3 -18.844  -4.669   8.645
   24    H    GLU   4           H        GLU   4 -17.912  -2.491   6.990
   25    HA   GLU   4           HA       GLU   4 -16.381  -0.847   5.289
   26    HB2  GLU   4          2HB       GLU   4 -16.163   0.678   7.231
   27    HB3  GLU   4          3HB       GLU   4 -17.813   0.102   7.026
   28    HG2  GLU   4          2HG       GLU   4 -17.410  -1.572   8.847
   29    HG3  GLU   4          3HG       GLU   4 -15.808  -0.874   9.081
   30    H    GLU   5           H        GLU   5 -15.405  -3.254   7.609
   31    HA   GLU   5           HA       GLU   5 -12.659  -2.513   7.869
   32    HB2  GLU   5          2HB       GLU   5 -13.857  -4.036   9.466
   33    HB3  GLU   5          3HB       GLU   5 -13.918  -5.276   8.216
   34    HG2  GLU   5          2HG       GLU   5 -11.452  -5.351   8.166
   35    HG3  GLU   5          3HG       GLU   5 -11.383  -4.095   9.401
   36    H    GLU   6           H        GLU   6 -14.458  -4.651   5.680
   37    HA   GLU   6           HA       GLU   6 -12.242  -5.892   4.447
   38    HB2  GLU   6          2HB       GLU   6 -15.063  -5.563   3.380
   39    HB3  GLU   6          3HB       GLU   6 -13.837  -6.621   2.689
   40    HG2  GLU   6          2HG       GLU   6 -15.089  -6.852   5.427
   41    HG3  GLU   6          3HG       GLU   6 -15.356  -7.913   4.046
   42    H    GLU   7           H        GLU   7 -13.707  -2.815   3.900
   43    HA   GLU   7           HA       GLU   7 -12.714  -2.130   1.381
   44    HB2  GLU   7          2HB       GLU   7 -12.925  -0.367   3.867
   45    HB3  GLU   7          3HB       GLU   7 -12.771   0.219   2.214
   46    HG2  GLU   7          2HG       GLU   7 -14.960  -0.743   1.643
   47    HG3  GLU   7          3HG       GLU   7 -15.120  -1.385   3.282
   48    H    LYS   8           H        LYS   8 -11.173  -1.707   4.595
   49    HA   LYS   8           HA       LYS   8  -8.684  -0.725   3.554
   50    HB2  LYS   8          2HB       LYS   8  -9.358  -1.734   6.355
   51    HB3  LYS   8          3HB       LYS   8  -7.823  -0.999   5.915
   52    HG2  LYS   8          2HG       LYS   8  -9.062   0.704   7.000
   53    HG3  LYS   8          3HG       LYS   8  -9.144   1.103   5.282
   54    HD2  LYS   8          2HD       LYS   8 -11.405   0.068   5.181
   55    HD3  LYS   8          3HD       LYS   8 -11.307  -0.280   6.909
   56    HE2  LYS   8          2HE       LYS   8 -11.207   2.125   7.403
   57    HE3  LYS   8          3HE       LYS   8 -11.251   2.493   5.673
   58    HZ1  LYS   8          1HZ       LYS   8 -13.436   1.440   5.552
   59    HZ2  LYS   8          2HZ       LYS   8 -13.440   2.711   6.670
   60    HZ3  LYS   8          3HZ       LYS   8 -13.390   1.110   7.214
   61    H    ARG   9           H        ARG   9  -9.883  -3.909   4.505
   62    HA   ARG   9           HA       ARG   9  -7.551  -5.459   4.500
   63    HB2  ARG   9          2HB       ARG   9 -10.334  -6.175   3.488
   64    HB3  ARG   9          3HB       ARG   9  -9.060  -7.358   3.738
   65    HG2  ARG   9          2HG       ARG   9 -10.215  -5.621   5.932
   66    HG3  ARG   9          3HG       ARG   9 -10.776  -7.250   5.565
   67    HD2  ARG   9          2HD       ARG   9  -8.407  -8.048   5.994
   68    HD3  ARG   9          3HD       ARG   9  -8.045  -6.423   6.586
   69    HE   ARG   9           HE       ARG   9 -10.194  -7.106   8.070
   70   HH11  ARG   9          1HH1      ARG   9  -7.174  -8.806   7.410
   71   HH12  ARG   9          2HH1      ARG   9  -7.169  -9.632   8.936
   72   HH21  ARG   9          1HH2      ARG   9 -10.168  -8.192  10.063
   73   HH22  ARG   9          2HH2      ARG   9  -8.868  -9.285  10.445
   74    H    GLN  10           H        GLN  10  -9.710  -4.610   1.840
   75    HA   GLN  10           HA       GLN  10  -8.292  -5.804  -0.288
   76    HB2  GLN  10          2HB       GLN  10 -10.374  -3.583  -0.182
   77    HB3  GLN  10          3HB       GLN  10  -9.716  -4.177  -1.704
   78    HG2  GLN  10          2HG       GLN  10 -10.682  -6.341  -1.402
   79    HG3  GLN  10          3HG       GLN  10 -11.041  -6.024   0.297
   80   HE21  GLN  10          1HE2      GLN  10 -13.215  -6.533   0.036
   81   HE22  GLN  10          2HE2      GLN  10 -14.321  -5.497  -0.794
   82    H    VAL  11           H        VAL  11  -8.234  -2.480   1.031
   83    HA   VAL  11           HA       VAL  11  -6.660  -1.281  -0.984
   84    HB   VAL  11           HB       VAL  11  -6.897  -0.454   1.951
   85   HG11  VAL  11          1HG1      VAL  11  -4.981   0.640   0.828
   86   HG12  VAL  11          2HG1      VAL  11  -6.255   1.794   1.203
   87   HG13  VAL  11          3HG1      VAL  11  -6.053   1.210  -0.447
   88   HG21  VAL  11          1HG2      VAL  11  -9.076  -0.580   0.815
   89   HG22  VAL  11          2HG2      VAL  11  -8.487   0.480  -0.459
   90   HG23  VAL  11          3HG2      VAL  11  -8.646   1.081   1.190
   91    H    LYS  12           H        LYS  12  -5.699  -2.751   2.122
   92    HA   LYS  12           HA       LYS  12  -2.905  -2.234   1.955
   93    HB2  LYS  12          2HB       LYS  12  -4.366  -4.447   3.454
   94    HB3  LYS  12          3HB       LYS  12  -2.677  -4.013   3.699
   95    HG2  LYS  12          2HG       LYS  12  -3.348  -1.796   4.532
   96    HG3  LYS  12          3HG       LYS  12  -5.045  -2.192   4.254
   97    HD2  LYS  12          2HD       LYS  12  -3.183  -3.649   6.174
   98    HD3  LYS  12          3HD       LYS  12  -4.405  -2.467   6.640
   99    HE2  LYS  12          2HE       LYS  12  -6.193  -3.938   5.917
  100    HE3  LYS  12          3HE       LYS  12  -5.039  -5.081   5.224
  101    HZ1  LYS  12          1HZ       LYS  12  -5.853  -5.826   7.383
  102    HZ2  LYS  12          2HZ       LYS  12  -5.278  -4.413   8.110
  103    HZ3  LYS  12          3HZ       LYS  12  -4.192  -5.522   7.447
  104    H    GLN  13           H        GLN  13  -4.978  -4.850   0.808
  105    HA   GLN  13           HA       GLN  13  -2.967  -6.619  -0.113
  106    HB2  GLN  13          2HB       GLN  13  -5.273  -7.395   0.159
  107    HB3  GLN  13          3HB       GLN  13  -5.852  -6.243  -1.038
  108    HG2  GLN  13          2HG       GLN  13  -4.557  -7.446  -2.791
  109    HG3  GLN  13          3HG       GLN  13  -4.041  -8.617  -1.578
  110   HE21  GLN  13          1HE2      GLN  13  -7.317  -7.244  -1.743
  111   HE22  GLN  13          2HE2      GLN  13  -8.098  -8.708  -2.215
  112    H    VAL  14           H        VAL  14  -4.827  -4.071  -1.833
  113    HA   VAL  14           HA       VAL  14  -3.707  -4.381  -4.389
  114    HB   VAL  14           HB       VAL  14  -4.683  -1.745  -3.157
  115   HG11  VAL  14          1HG1      VAL  14  -4.513  -2.568  -6.081
  116   HG12  VAL  14          2HG1      VAL  14  -3.469  -1.403  -5.266
  117   HG13  VAL  14          3HG1      VAL  14  -5.186  -1.055  -5.466
  118   HG21  VAL  14          1HG2      VAL  14  -6.429  -3.452  -2.954
  119   HG22  VAL  14          2HG2      VAL  14  -6.314  -3.816  -4.671
  120   HG23  VAL  14          3HG2      VAL  14  -6.888  -2.232  -4.138
  121    H    ALA  15           H        ALA  15  -2.772  -2.340  -1.662
  122    HA   ALA  15           HA       ALA  15  -0.619  -0.943  -2.783
  123    HB1  ALA  15          1HB       ALA  15  -0.036  -0.417  -0.448
  124    HB2  ALA  15          2HB       ALA  15  -1.118  -1.693   0.120
  125    HB3  ALA  15          3HB       ALA  15  -1.774  -0.282  -0.715
  126    H    LYS  16           H        LYS  16  -0.650  -4.009  -0.920
  127    HA   LYS  16           HA       LYS  16   2.203  -4.265  -0.817
  128    HB2  LYS  16          2HB       LYS  16   1.883  -6.338   0.335
  129    HB3  LYS  16          3HB       LYS  16   0.608  -5.271   0.889
  130    HG2  LYS  16          2HG       LYS  16  -0.998  -6.425  -0.570
  131    HG3  LYS  16          3HG       LYS  16   0.276  -7.475  -1.166
  132    HD2  LYS  16          2HD       LYS  16  -0.678  -7.354   1.726
  133    HD3  LYS  16          3HD       LYS  16  -1.146  -8.580   0.549
  134    HE2  LYS  16          2HE       LYS  16   1.268  -9.224   0.343
  135    HE3  LYS  16          3HE       LYS  16   1.638  -8.090   1.645
  136    HZ1  LYS  16          1HZ       LYS  16  -0.085 -10.507   1.819
  137    HZ2  LYS  16          2HZ       LYS  16   0.064  -9.367   3.055
  138    HZ3  LYS  16          3HZ       LYS  16   1.409 -10.266   2.575
  139    H    GLU  17           H        GLU  17  -0.297  -5.514  -2.976
  140    HA   GLU  17           HA       GLU  17   1.332  -7.413  -4.344
  141    HB2  GLU  17          2HB       GLU  17  -1.254  -6.075  -5.242
  142    HB3  GLU  17          3HB       GLU  17  -0.483  -7.417  -6.079
  143    HG2  GLU  17          2HG       GLU  17  -1.709  -7.456  -3.314
  144    HG3  GLU  17          3HG       GLU  17  -2.316  -8.252  -4.759
  145    H    LYS  18           H        LYS  18   0.631  -3.992  -4.846
  146    HA   LYS  18           HA       LYS  18   1.927  -3.686  -7.373
  147    HB2  LYS  18          2HB       LYS  18   1.407  -1.652  -5.167
  148    HB3  LYS  18          3HB       LYS  18   1.982  -1.242  -6.778
  149    HG2  LYS  18          2HG       LYS  18  -0.674  -2.524  -6.138
  150    HG3  LYS  18          3HG       LYS  18  -0.412  -0.821  -6.502
  151    HD2  LYS  18          2HD       LYS  18   0.344  -1.398  -8.769
  152    HD3  LYS  18          3HD       LYS  18   0.153  -3.119  -8.410
  153    HE2  LYS  18          2HE       LYS  18  -2.254  -2.826  -8.115
  154    HE3  LYS  18          3HE       LYS  18  -2.100  -1.081  -8.360
  155    HZ1  LYS  18          1HZ       LYS  18  -1.407  -3.140 -10.387
  156    HZ2  LYS  18          2HZ       LYS  18  -1.398  -1.465 -10.615
  157    HZ3  LYS  18          3HZ       LYS  18  -2.857  -2.275 -10.343
  158    H    LEU  19           H        LEU  19   3.022  -3.469  -4.027
  159    HA   LEU  19           HA       LEU  19   5.705  -2.659  -4.542
  160    HB2  LEU  19          2HB       LEU  19   4.412  -4.065  -2.179
  161    HB3  LEU  19          3HB       LEU  19   6.104  -3.604  -2.193
  162    HG   LEU  19           HG       LEU  19   3.699  -1.748  -2.228
  163   HD11  LEU  19          1HD1      LEU  19   4.310  -2.588  -0.024
  164   HD12  LEU  19          2HD1      LEU  19   4.681  -0.872  -0.145
  165   HD13  LEU  19          3HD1      LEU  19   5.980  -2.065  -0.253
  166   HD21  LEU  19          1HD2      LEU  19   5.325  -0.848  -3.800
  167   HD22  LEU  19          2HD2      LEU  19   6.614  -0.997  -2.603
  168   HD23  LEU  19          3HD2      LEU  19   5.285   0.134  -2.336
  169    H    LEU  20           H        LEU  20   4.110  -5.771  -4.465
  170    HA   LEU  20           HA       LEU  20   6.455  -7.405  -4.737
  171    HB2  LEU  20          2HB       LEU  20   3.492  -7.930  -5.175
  172    HB3  LEU  20          3HB       LEU  20   4.712  -9.179  -5.395
  173    HG   LEU  20           HG       LEU  20   4.279  -7.687  -2.776
  174   HD11  LEU  20          1HD1      LEU  20   3.182  -9.718  -1.933
  175   HD12  LEU  20          2HD1      LEU  20   3.268 -10.445  -3.539
  176   HD13  LEU  20          3HD1      LEU  20   2.284  -9.001  -3.271
  177   HD21  LEU  20          1HD2      LEU  20   5.696  -9.449  -1.805
  178   HD22  LEU  20          2HD2      LEU  20   6.554  -8.544  -3.046
  179   HD23  LEU  20          3HD2      LEU  20   5.930 -10.157  -3.406
  180    H    GLU  21           H        GLU  21   4.369  -5.693  -6.977
  181    HA   GLU  21           HA       GLU  21   5.272  -6.891  -9.397
  182    HB2  GLU  21          2HB       GLU  21   4.229  -4.060  -8.919
  183    HB3  GLU  21          3HB       GLU  21   4.477  -4.778 -10.503
  184    HG2  GLU  21          2HG       GLU  21   2.466  -5.631  -8.415
  185    HG3  GLU  21          3HG       GLU  21   2.135  -4.853  -9.960
  186    H    GLN  22           H        GLN  22   6.427  -4.170  -7.452
  187    HA   GLN  22           HA       GLN  22   8.570  -3.361  -9.191
  188    HB2  GLN  22          2HB       GLN  22   8.176  -2.819  -6.212
  189    HB3  GLN  22          3HB       GLN  22   9.318  -1.984  -7.262
  190    HG2  GLN  22          2HG       GLN  22   7.428  -1.081  -8.582
  191    HG3  GLN  22          3HG       GLN  22   6.298  -1.894  -7.501
  192   HE21  GLN  22          1HE2      GLN  22   7.864  -1.292  -5.064
  193   HE22  GLN  22          2HE2      GLN  22   7.625   0.389  -4.766
  194    H    SER  23           H        SER  23   8.301  -5.446  -6.366
  195    HA   SER  23           HA       SER  23  10.957  -6.587  -6.824
  196    HB2  SER  23          2HB       SER  23  11.232  -4.721  -5.128
  197    HB3  SER  23          3HB       SER  23  10.093  -5.559  -4.076
  198    HG   SER  23           HG       SER  23  12.607  -5.887  -4.018
  199    HA   PRO  24           HA       PRO  24   8.141 -10.092  -5.678
  200    HB2  PRO  24          2HB       PRO  24   9.177 -11.925  -7.398
  201    HB3  PRO  24          3HB       PRO  24   8.039 -10.681  -7.953
  202    HG2  PRO  24          2HG       PRO  24  11.025 -10.742  -8.192
  203    HG3  PRO  24          3HG       PRO  24   9.810 -10.279  -9.405
  204    HD2  PRO  24          2HD       PRO  24  11.212  -8.453  -7.893
  205    HD3  PRO  24          3HD       PRO  24   9.597  -8.135  -8.563
  206    H    ASN  25           H        ASN  25  11.367  -9.305  -5.354
  207    HA   ASN  25           HA       ASN  25  12.237 -11.752  -3.962
  208    HB2  ASN  25          2HB       ASN  25  13.830  -9.306  -4.870
  209    HB3  ASN  25          3HB       ASN  25  14.509 -10.768  -4.160
  210   HD21  ASN  25          1HD2      ASN  25  14.586 -12.683  -5.430
  211   HD22  ASN  25          2HD2      ASN  25  14.388 -12.646  -7.146
  212    H    SER  26           H        SER  26  10.300  -9.615  -2.903
  213    HA   SER  26           HA       SER  26  11.817  -8.806  -0.480
  214    HB2  SER  26          2HB       SER  26  10.526  -6.722  -0.433
  215    HB3  SER  26          3HB       SER  26  11.349  -6.868  -1.984
  216    HG   SER  26           HG       SER  26   9.481  -6.850  -2.924
  217    H    LYS  27           H        LYS  27  10.712  -8.858   1.510
  218    HA   LYS  27           HA       LYS  27   7.991  -9.998   1.581
  219    HB2  LYS  27          2HB       LYS  27   9.467 -11.010   3.224
  220    HB3  LYS  27          3HB       LYS  27  10.023  -9.440   3.801
  221    HG2  LYS  27          2HG       LYS  27   7.892  -8.960   4.824
  222    HG3  LYS  27          3HG       LYS  27   7.129 -10.350   4.062
  223    HD2  LYS  27          2HD       LYS  27   9.328 -10.512   6.165
  224    HD3  LYS  27          3HD       LYS  27   7.601 -10.680   6.491
  225    HE2  LYS  27          2HE       LYS  27   7.567 -12.629   4.900
  226    HE3  LYS  27          3HE       LYS  27   9.324 -12.513   4.805
  227    HZ1  LYS  27          1HZ       LYS  27   9.386 -12.856   7.236
  228    HZ2  LYS  27          2HZ       LYS  27   8.708 -14.164   6.405
  229    HZ3  LYS  27          3HZ       LYS  27   7.707 -13.080   7.230
  230    H    VAL  28           H        VAL  28   6.320  -8.631   1.602
  231    HA   VAL  28           HA       VAL  28   6.692  -5.812   2.385
  232    HB   VAL  28           HB       VAL  28   4.275  -7.062   0.984
  233   HG11  VAL  28          1HG1      VAL  28   5.097  -4.159   1.369
  234   HG12  VAL  28          2HG1      VAL  28   3.758  -4.986   2.171
  235   HG13  VAL  28          3HG1      VAL  28   3.711  -4.714   0.430
  236   HG21  VAL  28          1HG2      VAL  28   6.262  -7.287  -0.459
  237   HG22  VAL  28          2HG2      VAL  28   6.600  -5.564  -0.292
  238   HG23  VAL  28          3HG2      VAL  28   5.136  -6.099  -1.123
  239    H    GLN  29           H        GLN  29   6.315  -5.524   4.492
  240    HA   GLN  29           HA       GLN  29   4.047  -6.765   5.896
  241    HB2  GLN  29          2HB       GLN  29   6.255  -4.883   6.880
  242    HB3  GLN  29          3HB       GLN  29   5.043  -5.641   7.907
  243    HG2  GLN  29          2HG       GLN  29   7.130  -7.141   6.299
  244    HG3  GLN  29          3HG       GLN  29   7.263  -6.746   8.016
  245   HE21  GLN  29          1HE2      GLN  29   5.971  -7.869   9.506
  246   HE22  GLN  29          2HE2      GLN  29   5.121  -9.318   9.108
  247    H    VAL  30           H        VAL  30   2.462  -5.333   6.961
  248    HA   VAL  30           HA       VAL  30   2.155  -2.674   5.691
  249    HB   VAL  30           HB       VAL  30   0.128  -3.961   5.521
  250   HG11  VAL  30          1HG1      VAL  30  -1.106  -4.922   7.427
  251   HG12  VAL  30          2HG1      VAL  30   0.201  -4.447   8.514
  252   HG13  VAL  30          3HG1      VAL  30   0.497  -5.644   7.255
  253   HG21  VAL  30          1HG2      VAL  30  -0.165  -1.568   6.023
  254   HG22  VAL  30          2HG2      VAL  30  -0.215  -1.918   7.753
  255   HG23  VAL  30          3HG2      VAL  30  -1.495  -2.513   6.695
  256    H    ARG  31           H        ARG  31   2.862  -0.952   6.768
  257    HA   ARG  31           HA       ARG  31   3.895  -1.237   9.480
  258    HB2  ARG  31          2HB       ARG  31   5.244  -0.180   7.617
  259    HB3  ARG  31          3HB       ARG  31   4.083   1.145   7.572
  260    HG2  ARG  31          2HG       ARG  31   6.039   1.845   8.827
  261    HG3  ARG  31          3HG       ARG  31   4.675   1.698   9.937
  262    HD2  ARG  31          2HD       ARG  31   5.541  -0.628  10.522
  263    HD3  ARG  31          3HD       ARG  31   6.995  -0.238   9.594
  264    HE   ARG  31           HE       ARG  31   6.444   1.751  11.566
  265   HH11  ARG  31          1HH1      ARG  31   7.762  -1.513  11.249
  266   HH12  ARG  31          2HH1      ARG  31   8.735  -1.381  12.677
  267   HH21  ARG  31          1HH2      ARG  31   7.726   1.892  13.431
  268   HH22  ARG  31          2HH2      ARG  31   8.717   0.547  13.914
  269    H    ARG  32           H        ARG  32   1.743   1.060   7.755
  270    HA   ARG  32           HA       ARG  32   0.103   1.562  10.090
  271    HB2  ARG  32          2HB       ARG  32   2.036   3.003  10.585
  272    HB3  ARG  32          3HB       ARG  32   1.988   3.693   8.971
  273    HG2  ARG  32          2HG       ARG  32   1.126   5.263  10.626
  274    HG3  ARG  32          3HG       ARG  32  -0.130   4.803   9.477
  275    HD2  ARG  32          2HD       ARG  32  -0.990   3.166  11.185
  276    HD3  ARG  32          3HD       ARG  32   0.188   3.819  12.330
  277    HE   ARG  32           HE       ARG  32  -1.258   5.972  11.347
  278   HH11  ARG  32          1HH1      ARG  32  -1.958   3.059  13.206
  279   HH12  ARG  32          2HH1      ARG  32  -3.289   3.777  14.058
  280   HH21  ARG  32          1HH2      ARG  32  -3.007   6.911  12.487
  281   HH22  ARG  32          2HH2      ARG  32  -3.884   5.965  13.650
  282    H    VAL  33           H        VAL  33  -1.895   2.528   9.509
  283    HA   VAL  33           HA       VAL  33  -2.327   3.138   6.633
  284    HB   VAL  33           HB       VAL  33  -4.197   1.477   8.419
  285   HG11  VAL  33          1HG1      VAL  33  -5.629   1.226   6.422
  286   HG12  VAL  33          2HG1      VAL  33  -4.587   2.329   5.521
  287   HG13  VAL  33          3HG1      VAL  33  -5.501   2.916   6.912
  288   HG21  VAL  33          1HG2      VAL  33  -2.255   0.180   7.624
  289   HG22  VAL  33          2HG2      VAL  33  -2.608   0.636   5.956
  290   HG23  VAL  33          3HG2      VAL  33  -3.741  -0.378   6.851
  291    H    GLN  34           H        GLN  34  -3.010   5.154   6.419
  292    HA   GLN  34           HA       GLN  34  -4.815   6.436   8.382
  293    HB2  GLN  34          2HB       GLN  34  -3.029   7.596   6.189
  294    HB3  GLN  34          3HB       GLN  34  -4.311   8.538   6.943
  295    HG2  GLN  34          2HG       GLN  34  -2.275   9.144   8.005
  296    HG3  GLN  34          3HG       GLN  34  -3.197   8.188   9.155
  297   HE21  GLN  34          1HE2      GLN  34  -1.302   6.798   6.495
  298   HE22  GLN  34          2HE2      GLN  34  -0.103   6.077   7.507
  299    H    LYS  35           H        LYS  35  -6.940   6.612   7.816
  300    HA   LYS  35           HA       LYS  35  -7.753   6.279   4.976
  301    HB2  LYS  35          2HB       LYS  35  -8.718   4.758   6.810
  302    HB3  LYS  35          3HB       LYS  35  -9.520   6.167   7.475
  303    HG2  LYS  35          2HG       LYS  35 -10.006   5.234   4.631
  304    HG3  LYS  35          3HG       LYS  35 -10.892   4.570   5.998
  305    HD2  LYS  35          2HD       LYS  35 -11.752   6.838   6.526
  306    HD3  LYS  35          3HD       LYS  35 -10.881   7.484   5.132
  307    HE2  LYS  35          2HE       LYS  35 -12.243   6.136   3.609
  308    HE3  LYS  35          3HE       LYS  35 -13.054   5.359   4.970
  309    HZ1  LYS  35          1HZ       LYS  35 -13.957   7.527   5.603
  310    HZ2  LYS  35          2HZ       LYS  35 -14.423   7.100   4.037
  311    HZ3  LYS  35          3HZ       LYS  35 -13.206   8.245   4.269
  312    H    GLN  36           H        GLN  36  -7.794   8.262   4.016
  313    HA   GLN  36           HA       GLN  36  -8.941  10.571   5.494
  314    HB2  GLN  36          2HB       GLN  36  -6.598  10.557   3.537
  315    HB3  GLN  36          3HB       GLN  36  -7.351  12.017   4.165
  316    HG2  GLN  36          2HG       GLN  36  -5.974   9.918   5.878
  317    HG3  GLN  36          3HG       GLN  36  -5.215  11.406   5.309
  318   HE21  GLN  36          1HE2      GLN  36  -5.908  13.405   6.224
  319   HE22  GLN  36          2HE2      GLN  36  -6.769  13.470   7.716
  320    H    GLY  37           H        GLY  37 -10.985  10.361   4.683
  321    HA2  GLY  37          2HA       GLY  37 -12.737  10.859   3.291
  322    HA3  GLY  37          3HA       GLY  37 -11.582  11.548   2.160
  323    H    ASN  38           H        ASN  38 -10.980  10.366   0.379
  324    HA   ASN  38           HA       ASN  38 -12.011   7.586   0.121
  325    HB2  ASN  38          2HB       ASN  38 -11.498   9.711  -2.005
  326    HB3  ASN  38          3HB       ASN  38 -11.708   8.008  -2.409
  327   HD21  ASN  38          1HD2      ASN  38 -13.287  10.906  -1.305
  328   HD22  ASN  38          2HD2      ASN  38 -14.906  10.318  -1.435
  329    H    THR  39           H        THR  39  -9.175   9.644   0.006
  330    HA   THR  39           HA       THR  39  -7.464   7.605  -1.163
  331    HB   THR  39           HB       THR  39  -6.607  10.271   0.063
  332    HG1  THR  39           HG1      THR  39  -7.697   9.642  -2.465
  333   HG21  THR  39          1HG2      THR  39  -4.640  10.011  -1.453
  334   HG22  THR  39          2HG2      THR  39  -5.236   8.422  -1.946
  335   HG23  THR  39          3HG2      THR  39  -4.729   8.703  -0.276
  336    H    ILE  40           H        ILE  40  -7.293   5.900   0.224
  337    HA   ILE  40           HA       ILE  40  -6.476   6.252   3.000
  338    HB   ILE  40           HB       ILE  40  -6.863   3.711   1.340
  339   HG12  ILE  40          2HG1      ILE  40  -8.639   5.102   3.402
  340   HG13  ILE  40          3HG1      ILE  40  -8.993   4.849   1.699
  341   HG21  ILE  40          1HG2      ILE  40  -5.223   3.335   3.143
  342   HG22  ILE  40          2HG2      ILE  40  -6.725   2.479   3.482
  343   HG23  ILE  40          3HG2      ILE  40  -6.356   3.982   4.332
  344   HD11  ILE  40          1HD1      ILE  40  -8.802   2.681   3.793
  345   HD12  ILE  40          2HD1      ILE  40  -9.213   2.456   2.092
  346   HD13  ILE  40          3HD1      ILE  40 -10.281   3.380   3.139
  347    H    ARG  41           H        ARG  41  -4.441   6.806   3.335
  348    HA   ARG  41           HA       ARG  41  -2.197   6.055   1.655
  349    HB2  ARG  41          2HB       ARG  41  -2.412   7.519   4.313
  350    HB3  ARG  41          3HB       ARG  41  -0.877   7.206   3.512
  351    HG2  ARG  41          2HG       ARG  41  -1.642   8.579   1.585
  352    HG3  ARG  41          3HG       ARG  41  -3.133   8.940   2.457
  353    HD2  ARG  41          2HD       ARG  41  -1.979  10.171   4.136
  354    HD3  ARG  41          3HD       ARG  41  -0.408   9.525   3.646
  355    HE   ARG  41           HE       ARG  41  -1.607  11.016   1.537
  356   HH11  ARG  41          1HH1      ARG  41   0.114  11.416   4.597
  357   HH12  ARG  41          2HH1      ARG  41   0.770  12.968   4.164
  358   HH21  ARG  41          1HH2      ARG  41  -0.725  13.050   0.975
  359   HH22  ARG  41          2HH2      ARG  41   0.287  13.891   2.109
  360    H    VAL  42           H        VAL  42  -1.997   3.789   1.777
  361    HA   VAL  42           HA       VAL  42  -1.536   2.575   4.423
  362    HB   VAL  42           HB       VAL  42  -1.403   1.242   1.669
  363   HG11  VAL  42          1HG1      VAL  42  -0.031   0.069   3.366
  364   HG12  VAL  42          2HG1      VAL  42  -1.437  -0.888   2.908
  365   HG13  VAL  42          3HG1      VAL  42  -1.428  -0.020   4.446
  366   HG21  VAL  42          1HG2      VAL  42  -3.675   1.999   2.175
  367   HG22  VAL  42          2HG2      VAL  42  -3.620   1.191   3.745
  368   HG23  VAL  42          3HG2      VAL  42  -3.575   0.239   2.257
  369    H    GLU  43           H        GLU  43   0.331   3.252   5.188
  370    HA   GLU  43           HA       GLU  43   2.831   3.245   3.714
  371    HB2  GLU  43          2HB       GLU  43   2.332   3.418   6.727
  372    HB3  GLU  43          3HB       GLU  43   3.853   3.764   5.903
  373    HG2  GLU  43          2HG       GLU  43   2.801   5.690   4.763
  374    HG3  GLU  43          3HG       GLU  43   1.277   5.316   5.564
  375    H    LEU  44           H        LEU  44   3.957   1.426   3.345
  376    HA   LEU  44           HA       LEU  44   3.517  -0.969   5.044
  377    HB2  LEU  44          2HB       LEU  44   4.419  -1.050   2.124
  378    HB3  LEU  44          3HB       LEU  44   3.873  -2.372   3.135
  379    HG   LEU  44           HG       LEU  44   1.596  -0.878   3.182
  380   HD11  LEU  44          1HD1      LEU  44   1.136   0.083   0.987
  381   HD12  LEU  44          2HD1      LEU  44   2.789  -0.256   0.467
  382   HD13  LEU  44          3HD1      LEU  44   2.489   0.900   1.768
  383   HD21  LEU  44          1HD2      LEU  44   1.701  -3.236   2.550
  384   HD22  LEU  44          2HD2      LEU  44   2.293  -2.795   0.946
  385   HD23  LEU  44          3HD2      LEU  44   0.668  -2.320   1.451
  386    H    GLU  45           H        GLU  45   5.353  -2.260   5.484
  387    HA   GLU  45           HA       GLU  45   7.984  -0.929   5.142
  388    HB2  GLU  45          2HB       GLU  45   7.215  -1.144   7.477
  389    HB3  GLU  45          3HB       GLU  45   7.003  -2.884   7.286
  390    HG2  GLU  45          2HG       GLU  45   9.357  -3.258   7.157
  391    HG3  GLU  45          3HG       GLU  45   9.693  -1.541   6.917
  392    H    LEU  46           H        LEU  46   8.908  -1.794   3.395
  393    HA   LEU  46           HA       LEU  46   8.582  -4.651   2.702
  394    HB2  LEU  46          2HB       LEU  46   7.774  -3.105   1.028
  395    HB3  LEU  46          3HB       LEU  46   9.248  -2.169   1.054
  396    HG   LEU  46           HG       LEU  46   9.359  -5.053   0.107
  397   HD11  LEU  46          1HD1      LEU  46   8.543  -2.717  -1.662
  398   HD12  LEU  46          2HD1      LEU  46   7.500  -4.053  -1.169
  399   HD13  LEU  46          3HD1      LEU  46   8.894  -4.365  -2.197
  400   HD21  LEU  46          1HD2      LEU  46  11.486  -3.844   0.378
  401   HD22  LEU  46          2HD2      LEU  46  10.923  -2.579  -0.710
  402   HD23  LEU  46          3HD2      LEU  46  11.176  -4.215  -1.317
  403    H    ARG  47           H        ARG  47  10.460  -5.860   2.039
  404    HA   ARG  47           HA       ARG  47  13.115  -4.775   2.842
  405    HB2  ARG  47          2HB       ARG  47  11.937  -7.525   3.436
  406    HB3  ARG  47          3HB       ARG  47  13.634  -7.123   3.668
  407    HG2  ARG  47          2HG       ARG  47  13.169  -5.678   5.488
  408    HG3  ARG  47          3HG       ARG  47  11.448  -5.587   5.097
  409    HD2  ARG  47          2HD       ARG  47  11.998  -7.031   7.088
  410    HD3  ARG  47          3HD       ARG  47  11.078  -7.851   5.826
  411    HE   ARG  47           HE       ARG  47  13.860  -8.268   5.467
  412   HH11  ARG  47          1HH1      ARG  47  11.191  -9.346   7.499
  413   HH12  ARG  47          2HH1      ARG  47  11.917 -10.884   7.836
  414   HH21  ARG  47          1HH2      ARG  47  14.781 -10.312   5.899
  415   HH22  ARG  47          2HH2      ARG  47  13.945 -11.429   6.932
  416    H    THR  48           H        THR  48  13.823  -4.425   0.678
  417    HA   THR  48           HA       THR  48  13.697  -6.510  -1.337
  418    HB   THR  48           HB       THR  48  15.283  -3.885  -1.352
  419    HG1  THR  48           HG1      THR  48  13.425  -3.036  -1.820
  420   HG21  THR  48          1HG2      THR  48  14.671  -5.797  -3.651
  421   HG22  THR  48          2HG2      THR  48  16.263  -5.483  -2.958
  422   HG23  THR  48          3HG2      THR  48  15.409  -4.203  -3.820
  423    H    ASN  49           H        ASN  49  14.874  -8.302  -0.814
  424    HA   ASN  49           HA       ASN  49  16.619  -9.701  -0.401
  425    HB2  ASN  49          2HB       ASN  49  18.332  -7.323  -1.266
  426    HB3  ASN  49          3HB       ASN  49  18.914  -8.975  -1.081
  427   HD21  ASN  49          1HD2      ASN  49  19.576  -8.925  -3.286
  428   HD22  ASN  49          2HD2      ASN  49  18.438  -9.096  -4.572
  429    H    GLY  50           H        GLY  50  15.514  -8.012   1.732
  430    HA2  GLY  50          2HA       GLY  50  15.913  -8.194   4.049
  431    HA3  GLY  50          3HA       GLY  50  17.643  -8.303   3.760
  432    H    LYS  51           H        LYS  51  17.252  -5.900   1.828
  433    HA   LYS  51           HA       LYS  51  17.909  -3.834   3.679
  434    HB2  LYS  51          2HB       LYS  51  17.110  -3.519   0.743
  435    HB3  LYS  51          3HB       LYS  51  17.953  -2.332   1.730
  436    HG2  LYS  51          2HG       LYS  51  19.042  -5.019   0.854
  437    HG3  LYS  51          3HG       LYS  51  19.482  -3.454   0.185
  438    HD2  LYS  51          2HD       LYS  51  19.966  -4.222   3.086
  439    HD3  LYS  51          3HD       LYS  51  21.153  -4.482   1.814
  440    HE2  LYS  51          2HE       LYS  51  21.757  -2.459   2.948
  441    HE3  LYS  51          3HE       LYS  51  21.108  -1.987   1.380
  442    HZ1  LYS  51          1HZ       LYS  51  19.565  -1.936   3.922
  443    HZ2  LYS  51          2HZ       LYS  51  19.058  -1.342   2.425
  444    HZ3  LYS  51          3HZ       LYS  51  20.328  -0.593   3.238
  445    H    LYS  52           H        LYS  52  16.574  -2.468   4.747
  446    HA   LYS  52           HA       LYS  52  13.705  -2.971   4.482
  447    HB2  LYS  52          2HB       LYS  52  15.018  -3.101   6.691
  448    HB3  LYS  52          3HB       LYS  52  15.085  -1.347   6.669
  449    HG2  LYS  52          2HG       LYS  52  12.475  -2.894   6.590
  450    HG3  LYS  52          3HG       LYS  52  13.267  -2.449   8.092
  451    HD2  LYS  52          2HD       LYS  52  12.291  -0.471   6.000
  452    HD3  LYS  52          3HD       LYS  52  11.409  -0.918   7.455
  453    HE2  LYS  52          2HE       LYS  52  12.433   1.140   7.992
  454    HE3  LYS  52          3HE       LYS  52  13.458  -0.063   8.771
  455    HZ1  LYS  52          1HZ       LYS  52  15.058   0.162   7.023
  456    HZ2  LYS  52          2HZ       LYS  52  14.686   1.714   7.576
  457    HZ3  LYS  52          3HZ       LYS  52  14.033   1.155   6.122
  458    H    GLU  53           H        GLU  53  12.644  -1.736   3.182
  459    HA   GLU  53           HA       GLU  53  13.089   1.179   3.053
  460    HB2  GLU  53          2HB       GLU  53  12.358  -0.679   0.737
  461    HB3  GLU  53          3HB       GLU  53  12.486   1.076   0.638
  462    HG2  GLU  53          2HG       GLU  53  14.877   0.967   1.125
  463    HG3  GLU  53          3HG       GLU  53  14.785  -0.783   1.321
  464    H    ASN  54           H        ASN  54  11.342   2.007   4.111
  465    HA   ASN  54           HA       ASN  54   8.703   0.822   4.018
  466    HB2  ASN  54          2HB       ASN  54   9.585   3.558   5.061
  467    HB3  ASN  54          3HB       ASN  54   7.973   2.871   5.265
  468   HD21  ASN  54          1HD2      ASN  54   7.691   1.164   6.777
  469   HD22  ASN  54          2HD2      ASN  54   8.895   0.778   7.961
  470    H    TYR  55           H        TYR  55   7.141   1.267   2.573
  471    HA   TYR  55           HA       TYR  55   7.402   3.607   0.766
  472    HB2  TYR  55          2HB       TYR  55   6.000   0.929   0.306
  473    HB3  TYR  55          3HB       TYR  55   5.910   2.304  -0.794
  474    HD1  TYR  55           HD1      TYR  55   7.671   2.687  -2.415
  475    HD2  TYR  55           HD2      TYR  55   8.269  -0.179   0.689
  476    HE1  TYR  55           HE1      TYR  55   9.708   1.896  -3.540
  477    HE2  TYR  55           HE2      TYR  55  10.298  -0.966  -0.432
  478    HH   TYR  55           HH       TYR  55  11.302  -0.994  -2.671
  479    H    THR  56           H        THR  56   5.222   4.348  -0.019
  480    HA   THR  56           HA       THR  56   2.966   4.053   1.825
  481    HB   THR  56           HB       THR  56   4.119   6.785   1.028
  482    HG1  THR  56           HG1      THR  56   4.208   5.240   3.383
  483   HG21  THR  56          1HG2      THR  56   1.641   6.094   2.667
  484   HG22  THR  56          2HG2      THR  56   1.664   6.899   1.096
  485   HG23  THR  56          3HG2      THR  56   2.329   7.713   2.510
  486    H    VAL  57           H        VAL  57   1.708   3.118   0.365
  487    HA   VAL  57           HA       VAL  57   1.481   4.138  -2.387
  488    HB   VAL  57           HB       VAL  57   0.331   1.584  -1.148
  489   HG11  VAL  57          1HG1      VAL  57  -0.909   2.332  -3.132
  490   HG12  VAL  57          2HG1      VAL  57  -0.033   0.839  -3.459
  491   HG13  VAL  57          3HG1      VAL  57   0.587   2.375  -4.070
  492   HG21  VAL  57          1HG2      VAL  57   2.847   1.871  -2.837
  493   HG22  VAL  57          2HG2      VAL  57   2.151   0.354  -2.262
  494   HG23  VAL  57          3HG2      VAL  57   2.796   1.520  -1.107
  495    H    GLU  58           H        GLU  58   0.124   5.823  -2.368
  496    HA   GLU  58           HA       GLU  58  -2.199   6.007  -0.650
  497    HB2  GLU  58          2HB       GLU  58  -1.267   7.829  -2.910
  498    HB3  GLU  58          3HB       GLU  58  -2.592   8.181  -1.804
  499    HG2  GLU  58          2HG       GLU  58  -0.799   7.941   0.082
  500    HG3  GLU  58          3HG       GLU  58   0.369   8.067  -1.232
  501    H    VAL  59           H        VAL  59  -3.753   4.623  -1.116
  502    HA   VAL  59           HA       VAL  59  -4.647   4.157  -3.895
  503    HB   VAL  59           HB       VAL  59  -5.342   2.535  -1.403
  504   HG11  VAL  59          1HG1      VAL  59  -6.945   2.273  -3.228
  505   HG12  VAL  59          2HG1      VAL  59  -6.030   0.784  -3.000
  506   HG13  VAL  59          3HG1      VAL  59  -5.644   1.857  -4.348
  507   HG21  VAL  59          1HG2      VAL  59  -3.675   0.857  -2.107
  508   HG22  VAL  59          2HG2      VAL  59  -2.919   2.405  -1.729
  509   HG23  VAL  59          3HG2      VAL  59  -3.147   1.925  -3.413
  510    H    GLU  60           H        GLU  60  -6.357   5.360  -4.432
  511    HA   GLU  60           HA       GLU  60  -8.280   6.334  -2.404
  512    HB2  GLU  60          2HB       GLU  60  -7.206   8.059  -3.783
  513    HB3  GLU  60          3HB       GLU  60  -7.684   7.234  -5.262
  514    HG2  GLU  60          2HG       GLU  60 -10.056   7.685  -4.735
  515    HG3  GLU  60          3HG       GLU  60  -9.580   8.537  -3.271
  516    H    ARG  61           H        ARG  61 -10.554   6.154  -2.836
  517    HA   ARG  61           HA       ARG  61 -11.330   3.730  -4.218
  518    HB2  ARG  61          2HB       ARG  61 -12.356   4.351  -2.066
  519    HB3  ARG  61          3HB       ARG  61 -13.043   5.808  -2.775
  520    HG2  ARG  61          2HG       ARG  61 -14.662   4.633  -3.972
  521    HG3  ARG  61          3HG       ARG  61 -13.714   3.145  -4.013
  522    HD2  ARG  61          2HD       ARG  61 -15.673   2.928  -2.564
  523    HD3  ARG  61          3HD       ARG  61 -14.174   2.751  -1.659
  524    HE   ARG  61           HE       ARG  61 -15.319   5.417  -1.636
  525   HH11  ARG  61          1HH1      ARG  61 -15.175   2.308   0.019
  526   HH12  ARG  61          2HH1      ARG  61 -15.707   2.954   1.538
  527   HH21  ARG  61          1HH2      ARG  61 -16.012   6.252   0.373
  528   HH22  ARG  61          2HH2      ARG  61 -16.181   5.194   1.738
  529    H    GLN  62           H        GLN  62 -12.358   3.511  -6.083
  530    HA   GLN  62           HA       GLN  62 -13.432   5.835  -7.572
  531    HB2  GLN  62          2HB       GLN  62 -11.302   4.946  -8.575
  532    HB3  GLN  62          3HB       GLN  62 -12.040   3.362  -8.729
  533    HG2  GLN  62          2HG       GLN  62 -13.678   4.243 -10.321
  534    HG3  GLN  62          3HG       GLN  62 -13.033   5.876 -10.114
  535   HE21  GLN  62          1HE2      GLN  62 -12.580   6.025 -12.346
  536   HE22  GLN  62          2HE2      GLN  62 -11.265   5.175 -13.080
  537    H    GLY  63           H        GLY  63 -15.608   5.567  -7.262
  538    HA2  GLY  63          2HA       GLY  63 -17.707   4.627  -7.240
  539    HA3  GLY  63          3HA       GLY  63 -17.055   3.270  -8.147
  540    H    ASN  64           H        ASN  64 -17.081   1.339  -7.103
  541    HA   ASN  64           HA       ASN  64 -17.048   1.249  -4.147
  542    HB2  ASN  64          2HB       ASN  64 -17.838  -1.033  -4.304
  543    HB3  ASN  64          3HB       ASN  64 -18.838  -0.042  -5.357
  544   HD21  ASN  64          1HD2      ASN  64 -16.445  -2.592  -5.235
  545   HD22  ASN  64          2HD2      ASN  64 -16.575  -3.060  -6.894
  546    H    THR  65           H        THR  65 -15.002   0.806  -6.866
  547    HA   THR  65           HA       THR  65 -13.304  -1.234  -5.643
  548    HB   THR  65           HB       THR  65 -12.021  -1.072  -7.829
  549    HG1  THR  65           HG1      THR  65 -13.122   1.187  -8.162
  550   HG21  THR  65          1HG2      THR  65 -15.002  -1.596  -8.123
  551   HG22  THR  65          2HG2      THR  65 -13.805  -2.763  -7.555
  552   HG23  THR  65          3HG2      THR  65 -13.735  -2.164  -9.212
  553    H    TRP  66           H        TRP  66 -10.817  -0.741  -6.035
  554    HA   TRP  66           HA       TRP  66 -10.191   1.951  -4.945
  555    HB2  TRP  66          2HB       TRP  66  -9.008  -0.743  -4.057
  556    HB3  TRP  66          3HB       TRP  66  -8.465   0.840  -3.497
  557    HD1  TRP  66           HD1      TRP  66 -11.284  -1.688  -3.036
  558    HE1  TRP  66           HE1      TRP  66 -12.771  -0.961  -1.062
  559    HE3  TRP  66           HE3      TRP  66  -9.268   2.938  -2.161
  560    HZ2  TRP  66           HZ2      TRP  66 -13.042   1.274   0.646
  561    HZ3  TRP  66           HZ3      TRP  66 -10.192   4.303  -0.332
  562    HH2  TRP  66           HH2      TRP  66 -12.041   3.486   1.043
  563    H    THR  67           H        THR  67  -8.073   2.746  -5.543
  564    HA   THR  67           HA       THR  67  -6.737   1.469  -7.801
  565    HB   THR  67           HB       THR  67  -8.639   2.656  -8.856
  566    HG1  THR  67           HG1      THR  67  -7.407   3.766 -10.370
  567   HG21  THR  67          1HG2      THR  67  -8.842   5.100  -8.842
  568   HG22  THR  67          2HG2      THR  67  -7.470   5.235  -7.741
  569   HG23  THR  67          3HG2      THR  67  -8.967   4.481  -7.191
  570    H    VAL  68           H        VAL  68  -4.623   2.040  -7.955
  571    HA   VAL  68           HA       VAL  68  -3.466   3.572  -5.759
  572    HB   VAL  68           HB       VAL  68  -2.207   1.864  -7.961
  573   HG11  VAL  68          1HG1      VAL  68  -0.762   3.236  -5.656
  574   HG12  VAL  68          2HG1      VAL  68  -0.583   3.599  -7.374
  575   HG13  VAL  68          3HG1      VAL  68  -0.055   2.040  -6.745
  576   HG21  VAL  68          1HG2      VAL  68  -3.450   0.591  -6.281
  577   HG22  VAL  68          2HG2      VAL  68  -2.535   1.356  -4.980
  578   HG23  VAL  68          3HG2      VAL  68  -1.721   0.290  -6.124
  579    H    LYS  69           H        LYS  69  -2.734   5.594  -5.912
  580    HA   LYS  69           HA       LYS  69  -2.746   7.066  -8.410
  581    HB2  LYS  69          2HB       LYS  69  -1.896   7.923  -5.600
  582    HB3  LYS  69          3HB       LYS  69  -2.064   9.003  -6.980
  583    HG2  LYS  69          2HG       LYS  69  -4.286   7.438  -5.648
  584    HG3  LYS  69          3HG       LYS  69  -3.997   9.173  -5.512
  585    HD2  LYS  69          2HD       LYS  69  -4.418   9.398  -7.966
  586    HD3  LYS  69          3HD       LYS  69  -4.771   7.670  -8.038
  587    HE2  LYS  69          2HE       LYS  69  -6.616   8.030  -6.405
  588    HE3  LYS  69          3HE       LYS  69  -6.307   9.765  -6.483
  589    HZ1  LYS  69          1HZ       LYS  69  -6.828   9.692  -8.850
  590    HZ2  LYS  69          2HZ       LYS  69  -8.128   9.128  -7.930
  591    HZ3  LYS  69          3HZ       LYS  69  -7.139   8.034  -8.755
  592    H    ARG  70           H        ARG  70  -0.342   6.090  -5.984
  593    HA   ARG  70           HA       ARG  70   1.758   5.665  -7.841
  594    HB2  ARG  70          2HB       ARG  70   3.256   7.489  -7.376
  595    HB3  ARG  70          3HB       ARG  70   1.704   8.224  -7.753
  596    HG2  ARG  70          2HG       ARG  70   1.274   8.511  -5.307
  597    HG3  ARG  70          3HG       ARG  70   2.875   7.843  -4.979
  598    HD2  ARG  70          2HD       ARG  70   3.818   9.743  -6.401
  599    HD3  ARG  70          3HD       ARG  70   2.201  10.456  -6.364
  600    HE   ARG  70           HE       ARG  70   4.148  10.488  -4.299
  601   HH11  ARG  70          1HH1      ARG  70   0.647  10.397  -4.715
  602   HH12  ARG  70          2HH1      ARG  70   0.350  11.088  -3.154
  603   HH21  ARG  70          1HH2      ARG  70   3.725  11.300  -2.271
  604   HH22  ARG  70          2HH2      ARG  70   2.088  11.600  -1.772
  605    H    ILE  71           H        ILE  71   3.822   5.189  -6.719
  606    HA   ILE  71           HA       ILE  71   3.499   4.306  -3.901
  607    HB   ILE  71           HB       ILE  71   5.255   3.102  -6.090
  608   HG12  ILE  71          2HG1      ILE  71   2.769   1.986  -4.704
  609   HG13  ILE  71          3HG1      ILE  71   2.874   2.509  -6.380
  610   HG21  ILE  71          1HG2      ILE  71   6.368   3.003  -3.901
  611   HG22  ILE  71          2HG2      ILE  71   5.882   1.394  -4.425
  612   HG23  ILE  71          3HG2      ILE  71   4.944   2.238  -3.190
  613   HD11  ILE  71          1HD1      ILE  71   4.542   0.697  -6.756
  614   HD12  ILE  71          2HD1      ILE  71   2.921   0.164  -6.332
  615   HD13  ILE  71          3HD1      ILE  71   4.195   0.126  -5.119
  616    H    THR  72           H        THR  72   4.488   5.828  -2.691
  617    HA   THR  72           HA       THR  72   7.006   7.075  -3.607
  618    HB   THR  72           HB       THR  72   5.215   7.863  -1.251
  619    HG1  THR  72           HG1      THR  72   5.440   9.101  -3.806
  620   HG21  THR  72          1HG2      THR  72   6.471   9.970  -1.275
  621   HG22  THR  72          2HG2      THR  72   7.460   9.403  -2.620
  622   HG23  THR  72          3HG2      THR  72   7.584   8.618  -1.042
  623    H    ARG  73           H        ARG  73   8.872   6.237  -2.788
  624    HA   ARG  73           HA       ARG  73   8.908   4.625  -0.357
  625    HB2  ARG  73          2HB       ARG  73  10.404   4.173  -2.370
  626    HB3  ARG  73          3HB       ARG  73  11.277   5.657  -2.000
  627    HG2  ARG  73          2HG       ARG  73  11.870   4.703   0.239
  628    HG3  ARG  73          3HG       ARG  73  11.088   3.188  -0.227
  629    HD2  ARG  73          2HD       ARG  73  13.489   2.999  -0.546
  630    HD3  ARG  73          3HD       ARG  73  12.707   2.990  -2.132
  631    HE   ARG  73           HE       ARG  73  13.357   5.623  -1.637
  632   HH11  ARG  73          1HH1      ARG  73  15.208   2.621  -1.899
  633   HH12  ARG  73          2HH1      ARG  73  16.644   3.434  -2.450
  634   HH21  ARG  73          1HH2      ARG  73  15.266   6.659  -2.327
  635   HH22  ARG  73          2HH2      ARG  73  16.670   5.706  -2.694
  636    H    THR  74           H        THR  74   9.810   5.294   1.620
  637    HA   THR  74           HA       THR  74   9.823   8.015   2.383
  638    HB   THR  74           HB       THR  74   9.473   6.180   4.002
  639    HG1  THR  74           HG1      THR  74  11.800   7.261   5.044
  640   HG21  THR  74          1HG2      THR  74  12.436   5.551   3.666
  641   HG22  THR  74          2HG2      THR  74  11.105   4.526   3.123
  642   HG23  THR  74          3HG2      THR  74  11.338   4.819   4.844
  643    H    VAL  75           H        VAL  75  11.622   9.411   2.890
  644    HA   VAL  75           HA       VAL  75  13.928   9.210   1.252
  645    HB   VAL  75           HB       VAL  75  13.168  11.404   1.966
  646   HG11  VAL  75          1HG1      VAL  75  13.888  10.665   4.820
  647   HG12  VAL  75          2HG1      VAL  75  12.264  10.911   4.176
  648   HG13  VAL  75          3HG1      VAL  75  13.390  12.265   4.259
  649   HG21  VAL  75          1HG2      VAL  75  15.318  12.422   2.632
  650   HG22  VAL  75          2HG2      VAL  75  15.548  11.173   1.406
  651   HG23  VAL  75          3HG2      VAL  75  15.936  10.832   3.093
  652    H    GLY  76           H        GLY  76  15.460   7.837   1.468
  653    HA2  GLY  76          2HA       GLY  76  17.167   7.035   3.370
  654    HA3  GLY  76          3HA       GLY  76  15.730   6.100   3.801
  655    H    SER  77           H        SER  77  18.305   5.101   2.815
  656    HA   SER  77           HA       SER  77  19.179   3.548   1.418
  657    HB2  SER  77          2HB       SER  77  16.960   2.403   1.921
  658    HB3  SER  77          3HB       SER  77  16.318   3.082   0.426
  659    HG   SER  77           HG       SER  77  17.197   1.457  -0.558
  660    H    LEU  78           H        LEU  78  19.078   6.300   0.630
  661    HA   LEU  78           HA       LEU  78  19.129   6.100  -2.327
  662    HB2  LEU  78          2HB       LEU  78  18.304   8.290  -2.602
  663    HB3  LEU  78          3HB       LEU  78  17.250   7.566  -1.407
  664    HG   LEU  78           HG       LEU  78  19.509   9.495  -0.708
  665   HD11  LEU  78          1HD1      LEU  78  17.843  10.650  -2.096
  666   HD12  LEU  78          2HD1      LEU  78  17.813  11.241  -0.438
  667   HD13  LEU  78          3HD1      LEU  78  16.554  10.135  -1.004
  668   HD21  LEU  78          1HD2      LEU  78  18.382   9.735   1.450
  669   HD22  LEU  78          2HD2      LEU  78  18.863   8.064   1.168
  670   HD23  LEU  78          3HD2      LEU  78  17.173   8.538   0.972
  671    H    GLU  79           H        GLU  79  20.485   8.082  -3.203
  672    HA   GLU  79           HA       GLU  79  23.162   7.893  -2.234
  673    HB2  GLU  79          2HB       GLU  79  22.728   8.315  -4.614
  674    HB3  GLU  79          3HB       GLU  79  21.888   9.815  -4.237
  675    HG2  GLU  79          2HG       GLU  79  24.021  10.780  -3.391
  676    HG3  GLU  79          3HG       GLU  79  24.847   9.280  -3.802
  677    H    HIS  80           H        HIS  80  23.863   8.850  -0.389
  678    HA   HIS  80           HA       HIS  80  22.736  11.226   0.772
  679    HB2  HIS  80          2HB       HIS  80  25.421   9.849   1.247
  680    HB3  HIS  80          3HB       HIS  80  24.848  11.224   2.186
  681    HD1  HIS  80           HD1      HIS  80  24.873   7.624   2.199
  682    HD2  HIS  80           HD2      HIS  80  22.307  10.568   3.620
  683    HE1  HIS  80           HE1      HIS  80  23.488   6.505   3.972
  684    HE2  HIS  80           HE2      HIS  80  22.017   8.335   4.878
  685    H    HIS  81           H        HIS  81  22.729  12.935  -0.624
  686    HA   HIS  81           HA       HIS  81  24.762  13.525  -2.527
  687    HB2  HIS  81          2HB       HIS  81  22.368  15.091  -1.508
  688    HB3  HIS  81          3HB       HIS  81  23.463  15.755  -2.718
  689    HD1  HIS  81           HD1      HIS  81  21.225  12.694  -2.264
  690    HD2  HIS  81           HD2      HIS  81  22.779  15.102  -5.279
  691    HE1  HIS  81           HE1      HIS  81  20.208  11.848  -4.393
  692    HE2  HIS  81           HE2      HIS  81  21.351  13.153  -6.208
  693    H    HIS  82           H        HIS  82  26.691  14.440  -2.173
  694    HA   HIS  82           HA       HIS  82  27.490  15.656   0.292
  695    HB2  HIS  82          2HB       HIS  82  28.857  15.892  -2.430
  696    HB3  HIS  82          3HB       HIS  82  29.595  16.224  -0.870
  697    HD1  HIS  82           HD1      HIS  82  30.300  14.012  -3.202
  698    HD2  HIS  82           HD2      HIS  82  28.797  13.376   0.620
  699    HE1  HIS  82           HE1      HIS  82  30.942  11.657  -2.613
  700    HE2  HIS  82           HE2      HIS  82  29.821  11.231  -0.402
  701    H    HIS  83           H        HIS  83  26.557  16.817  -2.879
  702    HA   HIS  83           HA       HIS  83  25.418  19.270  -1.904
  703    HB2  HIS  83          2HB       HIS  83  26.793  20.779  -3.338
  704    HB3  HIS  83          3HB       HIS  83  27.771  19.996  -2.104
  705    HD1  HIS  83           HD1      HIS  83  29.666  18.465  -2.900
  706    HD2  HIS  83           HD2      HIS  83  27.352  19.950  -6.021
  707    HE1  HIS  83           HE1      HIS  83  30.927  17.908  -5.000
  708    HE2  HIS  83           HE2      HIS  83  29.446  18.692  -6.871
  709    H    HIS  84           H        HIS  84  24.914  20.589  -4.235
  710    HA   HIS  84           HA       HIS  84  24.424  18.889  -6.498
  711    HB2  HIS  84          2HB       HIS  84  21.935  19.191  -6.573
  712    HB3  HIS  84          3HB       HIS  84  22.453  18.205  -5.214
  713    HD1  HIS  84           HD1      HIS  84  20.461  21.145  -6.043
  714    HD2  HIS  84           HD2      HIS  84  22.333  19.622  -2.658
  715    HE1  HIS  84           HE1      HIS  84  19.463  22.391  -4.105
  716    HE2  HIS  84           HE2      HIS  84  20.753  21.598  -2.102
  717    H    HIS  85           H        HIS  85  25.080  20.208  -8.123
  718    HA   HIS  85           HA       HIS  85  25.353  23.032  -7.714
  719    HB2  HIS  85          2HB       HIS  85  26.352  23.076 -10.031
  720    HB3  HIS  85          3HB       HIS  85  27.128  21.954  -8.930
  721    HD1  HIS  85           HD1      HIS  85  27.101  19.474  -9.562
  722    HD2  HIS  85           HD2      HIS  85  24.976  21.845 -12.231
  723    HE1  HIS  85           HE1      HIS  85  26.626  18.001 -11.538
  724    HE2  HIS  85           HE2      HIS  85  25.459  19.492 -13.192
  Start of MODEL   18
    1    H1   MET   1          1H        MET   1 -17.457  -3.554  -1.098
    2    H2   MET   1          2H        MET   1 -17.879  -5.025  -0.400
    3    H3   MET   1          3H        MET   1 -16.295  -4.761  -0.906
    4    HA   MET   1           HA       MET   1 -16.458  -4.609   1.475
    5    HB2  MET   1          2HB       MET   1 -16.066  -1.851   0.236
    6    HB3  MET   1          3HB       MET   1 -15.387  -2.414   1.760
    7    HG2  MET   1          2HG       MET   1 -13.950  -3.969   0.606
    8    HG3  MET   1          3HG       MET   1 -14.720  -3.600  -0.939
    9    HE1  MET   1          1HE       MET   1 -13.632   0.217  -1.330
   10    HE2  MET   1          2HE       MET   1 -15.064  -0.335  -0.459
   11    HE3  MET   1          3HE       MET   1 -14.638  -1.058  -2.009
   12    HA   PRO   2           HA       PRO   2 -20.749  -3.136   2.399
   13    HB2  PRO   2          2HB       PRO   2 -20.822  -4.261   4.946
   14    HB3  PRO   2          3HB       PRO   2 -21.223  -5.146   3.458
   15    HG2  PRO   2          2HG       PRO   2 -18.624  -5.098   4.972
   16    HG3  PRO   2          3HG       PRO   2 -19.497  -6.493   4.294
   17    HD2  PRO   2          2HD       PRO   2 -17.388  -5.446   3.009
   18    HD3  PRO   2          3HD       PRO   2 -18.800  -6.026   2.094
   19    H    SER   3           H        SER   3 -17.892  -2.879   4.573
   20    HA   SER   3           HA       SER   3 -18.697  -0.131   5.287
   21    HB2  SER   3          2HB       SER   3 -17.905  -2.258   7.318
   22    HB3  SER   3          3HB       SER   3 -18.190  -0.554   7.685
   23    HG   SER   3           HG       SER   3 -20.350  -0.978   6.717
   24    H    GLU   4           H        GLU   4 -16.762   0.646   6.920
   25    HA   GLU   4           HA       GLU   4 -14.774   1.296   5.024
   26    HB2  GLU   4          2HB       GLU   4 -13.832   2.776   6.659
   27    HB3  GLU   4          3HB       GLU   4 -15.579   2.857   6.828
   28    HG2  GLU   4          2HG       GLU   4 -13.750   1.249   8.659
   29    HG3  GLU   4          3HG       GLU   4 -14.318   2.882   8.999
   30    H    GLU   5           H        GLU   5 -14.742  -0.978   7.753
   31    HA   GLU   5           HA       GLU   5 -11.931  -1.312   7.975
   32    HB2  GLU   5          2HB       GLU   5 -13.484  -1.943   9.752
   33    HB3  GLU   5          3HB       GLU   5 -14.197  -3.197   8.740
   34    HG2  GLU   5          2HG       GLU   5 -12.097  -4.453   8.782
   35    HG3  GLU   5          3HG       GLU   5 -11.324  -3.165   9.706
   36    H    GLU   6           H        GLU   6 -14.320  -2.756   5.893
   37    HA   GLU   6           HA       GLU   6 -12.728  -4.913   4.920
   38    HB2  GLU   6          2HB       GLU   6 -15.301  -3.668   3.920
   39    HB3  GLU   6          3HB       GLU   6 -14.511  -4.993   3.075
   40    HG2  GLU   6          2HG       GLU   6 -16.279  -5.858   4.479
   41    HG3  GLU   6          3HG       GLU   6 -14.715  -6.417   5.068
   42    H    GLU   7           H        GLU   7 -13.084  -1.549   4.023
   43    HA   GLU   7           HA       GLU   7 -11.867  -1.461   1.511
   44    HB2  GLU   7          2HB       GLU   7 -11.481   0.517   3.800
   45    HB3  GLU   7          3HB       GLU   7 -11.070   0.820   2.111
   46    HG2  GLU   7          2HG       GLU   7 -13.466   0.652   1.513
   47    HG3  GLU   7          3HG       GLU   7 -13.860   0.386   3.217
   48    H    LYS   8           H        LYS   8 -10.431  -1.280   4.751
   49    HA   LYS   8           HA       LYS   8  -7.744  -0.975   4.057
   50    HB2  LYS   8          2HB       LYS   8  -9.003  -2.143   6.580
   51    HB3  LYS   8          3HB       LYS   8  -7.267  -1.910   6.407
   52    HG2  LYS   8          2HG       LYS   8  -8.138  -0.070   7.671
   53    HG3  LYS   8          3HG       LYS   8  -7.654   0.533   6.087
   54    HD2  LYS   8          2HD       LYS   8 -10.016   0.547   5.364
   55    HD3  LYS   8          3HD       LYS   8 -10.506  -0.108   6.927
   56    HE2  LYS   8          2HE       LYS   8  -9.181   2.592   6.497
   57    HE3  LYS   8          3HE       LYS   8 -10.907   2.327   6.764
   58    HZ1  LYS   8          1HZ       LYS   8  -9.703   2.981   8.779
   59    HZ2  LYS   8          2HZ       LYS   8  -8.772   1.579   8.681
   60    HZ3  LYS   8          3HZ       LYS   8 -10.434   1.469   8.940
   61    H    ARG   9           H        ARG   9  -9.676  -3.882   4.634
   62    HA   ARG   9           HA       ARG   9  -7.762  -5.909   4.537
   63    HB2  ARG   9          2HB       ARG   9 -10.611  -6.018   3.432
   64    HB3  ARG   9          3HB       ARG   9  -9.620  -7.417   3.855
   65    HG2  ARG   9          2HG       ARG   9  -9.641  -6.710   6.220
   66    HG3  ARG   9          3HG       ARG   9 -10.630  -5.308   5.793
   67    HD2  ARG   9          2HD       ARG   9 -12.395  -6.892   4.960
   68    HD3  ARG   9          3HD       ARG   9 -11.411  -8.238   5.545
   69    HE   ARG   9           HE       ARG   9 -12.856  -6.249   7.165
   70   HH11  ARG   9          1HH1      ARG   9 -10.971  -9.225   7.045
   71   HH12  ARG   9          2HH1      ARG   9 -11.360  -9.659   8.677
   72   HH21  ARG   9          1HH2      ARG   9 -13.310  -6.820   9.278
   73   HH22  ARG   9          2HH2      ARG   9 -12.682  -8.298   9.936
   74    H    GLN  10           H        GLN  10  -9.591  -4.364   1.888
   75    HA   GLN  10           HA       GLN  10  -8.409  -5.907  -0.220
   76    HB2  GLN  10          2HB       GLN  10  -9.823  -3.214  -0.507
   77    HB3  GLN  10          3HB       GLN  10  -9.542  -4.400  -1.781
   78    HG2  GLN  10          2HG       GLN  10 -11.389  -4.681   0.601
   79    HG3  GLN  10          3HG       GLN  10 -11.862  -4.498  -1.083
   80   HE21  GLN  10          1HE2      GLN  10 -12.523  -6.594   0.876
   81   HE22  GLN  10          2HE2      GLN  10 -12.016  -8.090   0.179
   82    H    VAL  11           H        VAL  11  -7.833  -2.605   1.029
   83    HA   VAL  11           HA       VAL  11  -6.231  -1.719  -1.109
   84    HB   VAL  11           HB       VAL  11  -6.343  -0.534   1.707
   85   HG11  VAL  11          1HG1      VAL  11  -5.639   1.585   0.630
   86   HG12  VAL  11          2HG1      VAL  11  -5.505   0.751  -0.921
   87   HG13  VAL  11          3HG1      VAL  11  -4.426   0.319   0.404
   88   HG21  VAL  11          1HG2      VAL  11  -8.588  -0.671   0.677
   89   HG22  VAL  11          2HG2      VAL  11  -7.996   0.205  -0.730
   90   HG23  VAL  11          3HG2      VAL  11  -8.054   1.001   0.847
   91    H    LYS  12           H        LYS  12  -5.374  -3.172   2.039
   92    HA   LYS  12           HA       LYS  12  -2.567  -2.783   1.939
   93    HB2  LYS  12          2HB       LYS  12  -4.153  -5.038   3.223
   94    HB3  LYS  12          3HB       LYS  12  -2.434  -4.757   3.493
   95    HG2  LYS  12          2HG       LYS  12  -2.909  -2.613   4.558
   96    HG3  LYS  12          3HG       LYS  12  -4.635  -2.789   4.210
   97    HD2  LYS  12          2HD       LYS  12  -2.977  -4.598   6.017
   98    HD3  LYS  12          3HD       LYS  12  -4.152  -3.394   6.554
   99    HE2  LYS  12          2HE       LYS  12  -5.983  -4.669   5.542
  100    HE3  LYS  12          3HE       LYS  12  -4.843  -5.816   4.838
  101    HZ1  LYS  12          1HZ       LYS  12  -5.331  -5.396   7.725
  102    HZ2  LYS  12          2HZ       LYS  12  -4.197  -6.456   7.074
  103    HZ3  LYS  12          3HZ       LYS  12  -5.842  -6.719   6.802
  104    H    GLN  13           H        GLN  13  -4.688  -5.355   0.739
  105    HA   GLN  13           HA       GLN  13  -2.666  -7.073  -0.288
  106    HB2  GLN  13          2HB       GLN  13  -4.914  -7.922   0.189
  107    HB3  GLN  13          3HB       GLN  13  -5.620  -6.839  -1.005
  108    HG2  GLN  13          2HG       GLN  13  -4.445  -8.054  -2.803
  109    HG3  GLN  13          3HG       GLN  13  -3.709  -9.117  -1.609
  110   HE21  GLN  13          1HE2      GLN  13  -7.095  -8.051  -1.457
  111   HE22  GLN  13          2HE2      GLN  13  -7.761  -9.608  -1.790
  112    H    VAL  14           H        VAL  14  -4.653  -4.511  -1.778
  113    HA   VAL  14           HA       VAL  14  -3.774  -4.739  -4.443
  114    HB   VAL  14           HB       VAL  14  -4.721  -2.229  -2.960
  115   HG11  VAL  14          1HG1      VAL  14  -3.560  -1.635  -5.047
  116   HG12  VAL  14          2HG1      VAL  14  -5.291  -1.323  -5.194
  117   HG13  VAL  14          3HG1      VAL  14  -4.585  -2.752  -5.953
  118   HG21  VAL  14          1HG2      VAL  14  -6.958  -2.694  -3.926
  119   HG22  VAL  14          2HG2      VAL  14  -6.425  -4.021  -2.895
  120   HG23  VAL  14          3HG2      VAL  14  -6.340  -4.184  -4.645
  121    H    ALA  15           H        ALA  15  -2.561  -2.940  -1.665
  122    HA   ALA  15           HA       ALA  15  -0.614  -1.365  -3.003
  123    HB1  ALA  15          1HB       ALA  15   0.090  -0.730  -0.733
  124    HB2  ALA  15          2HB       ALA  15  -0.913  -2.016  -0.053
  125    HB3  ALA  15          3HB       ALA  15  -1.663  -0.663  -0.902
  126    H    LYS  16           H        LYS  16  -0.448  -4.429  -1.159
  127    HA   LYS  16           HA       LYS  16   2.388  -4.584  -1.090
  128    HB2  LYS  16          2HB       LYS  16   2.157  -6.855  -0.295
  129    HB3  LYS  16          3HB       LYS  16   0.936  -5.865   0.488
  130    HG2  LYS  16          2HG       LYS  16  -0.808  -6.800  -0.854
  131    HG3  LYS  16          3HG       LYS  16   0.335  -7.595  -1.928
  132    HD2  LYS  16          2HD       LYS  16  -0.052  -8.279   1.012
  133    HD3  LYS  16          3HD       LYS  16  -0.783  -9.153  -0.337
  134    HE2  LYS  16          2HE       LYS  16   1.543  -9.645  -1.193
  135    HE3  LYS  16          3HE       LYS  16   2.185  -8.914   0.281
  136    HZ1  LYS  16          1HZ       LYS  16   2.044 -11.319   0.447
  137    HZ2  LYS  16          2HZ       LYS  16   0.375 -11.268   0.183
  138    HZ3  LYS  16          3HZ       LYS  16   1.030 -10.576   1.575
  139    H    GLU  17           H        GLU  17  -0.083  -5.753  -3.355
  140    HA   GLU  17           HA       GLU  17   1.463  -7.415  -5.010
  141    HB2  GLU  17          2HB       GLU  17  -0.927  -5.653  -5.724
  142    HB3  GLU  17          3HB       GLU  17  -0.231  -6.849  -6.817
  143    HG2  GLU  17          2HG       GLU  17  -0.833  -8.656  -5.293
  144    HG3  GLU  17          3HG       GLU  17  -1.440  -7.496  -4.114
  145    H    LYS  18           H        LYS  18   0.812  -3.916  -5.137
  146    HA   LYS  18           HA       LYS  18   2.129  -3.204  -7.492
  147    HB2  LYS  18          2HB       LYS  18   1.886  -1.566  -4.928
  148    HB3  LYS  18          3HB       LYS  18   2.256  -0.913  -6.522
  149    HG2  LYS  18          2HG       LYS  18  -0.331  -2.255  -5.702
  150    HG3  LYS  18          3HG       LYS  18  -0.083  -0.521  -5.886
  151    HD2  LYS  18          2HD       LYS  18   0.157  -2.565  -8.138
  152    HD3  LYS  18          3HD       LYS  18  -1.263  -1.569  -7.821
  153    HE2  LYS  18          2HE       LYS  18   0.002   0.466  -8.285
  154    HE3  LYS  18          3HE       LYS  18   1.487  -0.467  -8.493
  155    HZ1  LYS  18          1HZ       LYS  18  -0.942  -0.689 -10.186
  156    HZ2  LYS  18          2HZ       LYS  18   0.482  -1.573 -10.379
  157    HZ3  LYS  18          3HZ       LYS  18   0.495   0.096 -10.612
  158    H    LEU  19           H        LEU  19   3.343  -3.454  -4.176
  159    HA   LEU  19           HA       LEU  19   6.015  -2.606  -4.739
  160    HB2  LEU  19          2HB       LEU  19   4.955  -4.154  -2.348
  161    HB3  LEU  19          3HB       LEU  19   6.508  -3.332  -2.438
  162    HG   LEU  19           HG       LEU  19   3.750  -2.063  -2.362
  163   HD11  LEU  19          1HD1      LEU  19   4.614  -2.732  -0.195
  164   HD12  LEU  19          2HD1      LEU  19   4.579  -0.976  -0.326
  165   HD13  LEU  19          3HD1      LEU  19   6.112  -1.842  -0.482
  166   HD21  LEU  19          1HD2      LEU  19   5.033  -0.812  -4.009
  167   HD22  LEU  19          2HD2      LEU  19   6.394  -0.663  -2.896
  168   HD23  LEU  19          3HD2      LEU  19   4.865   0.142  -2.536
  169    H    LEU  20           H        LEU  20   4.379  -5.707  -4.736
  170    HA   LEU  20           HA       LEU  20   6.745  -7.331  -4.934
  171    HB2  LEU  20          2HB       LEU  20   3.816  -7.957  -5.469
  172    HB3  LEU  20          3HB       LEU  20   5.098  -9.156  -5.578
  173    HG   LEU  20           HG       LEU  20   4.353  -7.646  -3.038
  174   HD11  LEU  20          1HD1      LEU  20   3.703 -10.504  -3.809
  175   HD12  LEU  20          2HD1      LEU  20   2.559  -9.162  -3.688
  176   HD13  LEU  20          3HD1      LEU  20   3.380  -9.747  -2.244
  177   HD21  LEU  20          1HD2      LEU  20   6.715  -8.280  -3.046
  178   HD22  LEU  20          2HD2      LEU  20   6.294  -9.953  -3.425
  179   HD23  LEU  20          3HD2      LEU  20   5.817  -9.248  -1.878
  180    H    GLU  21           H        GLU  21   4.707  -5.608  -7.227
  181    HA   GLU  21           HA       GLU  21   5.577  -6.944  -9.598
  182    HB2  GLU  21          2HB       GLU  21   4.643  -4.047  -9.339
  183    HB3  GLU  21          3HB       GLU  21   4.752  -4.965 -10.837
  184    HG2  GLU  21          2HG       GLU  21   2.813  -5.363  -8.552
  185    HG3  GLU  21          3HG       GLU  21   2.449  -4.873 -10.202
  186    H    GLN  22           H        GLN  22   6.829  -4.333  -7.646
  187    HA   GLN  22           HA       GLN  22   9.022  -3.689  -9.459
  188    HB2  GLN  22          2HB       GLN  22   8.234  -2.583  -6.729
  189    HB3  GLN  22          3HB       GLN  22   9.532  -1.944  -7.741
  190    HG2  GLN  22          2HG       GLN  22   7.951  -1.282  -9.463
  191    HG3  GLN  22          3HG       GLN  22   6.625  -2.074  -8.613
  192   HE21  GLN  22          1HE2      GLN  22   5.720  -1.072  -6.818
  193   HE22  GLN  22          2HE2      GLN  22   6.020   0.580  -6.437
  194    H    SER  23           H        SER  23   8.464  -5.545  -6.522
  195    HA   SER  23           HA       SER  23  11.141  -6.677  -6.658
  196    HB2  SER  23          2HB       SER  23  11.469  -4.707  -5.169
  197    HB3  SER  23          3HB       SER  23  10.209  -5.309  -4.093
  198    HG   SER  23           HG       SER  23  12.510  -6.823  -4.759
  199    HA   PRO  24           HA       PRO  24   8.007  -9.881  -5.444
  200    HB2  PRO  24          2HB       PRO  24   8.612 -11.733  -7.330
  201    HB3  PRO  24          3HB       PRO  24   7.620 -10.310  -7.721
  202    HG2  PRO  24          2HG       PRO  24  10.550 -10.753  -8.245
  203    HG3  PRO  24          3HG       PRO  24   9.305 -10.085  -9.327
  204    HD2  PRO  24          2HD       PRO  24  11.047  -8.510  -7.875
  205    HD3  PRO  24          3HD       PRO  24   9.433  -7.966  -8.385
  206    H    ASN  25           H        ASN  25  11.384  -9.599  -5.445
  207    HA   ASN  25           HA       ASN  25  11.975 -12.266  -4.380
  208    HB2  ASN  25          2HB       ASN  25  13.817  -9.895  -4.930
  209    HB3  ASN  25          3HB       ASN  25  14.353 -11.487  -4.400
  210   HD21  ASN  25          1HD2      ASN  25  12.526 -12.998  -6.109
  211   HD22  ASN  25          2HD2      ASN  25  13.103 -12.806  -7.723
  212    H    SER  26           H        SER  26  10.599  -9.680  -3.016
  213    HA   SER  26           HA       SER  26  11.730 -10.299  -0.352
  214    HB2  SER  26          2HB       SER  26  12.583  -8.083  -1.073
  215    HB3  SER  26          3HB       SER  26  10.934  -7.527  -1.361
  216    HG   SER  26           HG       SER  26  12.311  -7.874   1.016
  217    H    LYS  27           H        LYS  27  10.208  -9.926   1.387
  218    HA   LYS  27           HA       LYS  27   7.399 -10.404   0.630
  219    HB2  LYS  27          2HB       LYS  27   8.487 -12.092   2.090
  220    HB3  LYS  27          3HB       LYS  27   8.848 -10.846   3.281
  221    HG2  LYS  27          2HG       LYS  27   6.458 -10.517   3.717
  222    HG3  LYS  27          3HG       LYS  27   6.040 -11.658   2.437
  223    HD2  LYS  27          2HD       LYS  27   7.566 -12.356   4.975
  224    HD3  LYS  27          3HD       LYS  27   5.844 -12.646   4.717
  225    HE2  LYS  27          2HE       LYS  27   6.391 -14.173   2.839
  226    HE3  LYS  27          3HE       LYS  27   8.111 -13.878   3.102
  227    HZ1  LYS  27          1HZ       LYS  27   7.870 -14.829   5.321
  228    HZ2  LYS  27          2HZ       LYS  27   7.444 -15.931   4.117
  229    HZ3  LYS  27          3HZ       LYS  27   6.243 -15.157   5.015
  230    H    VAL  28           H        VAL  28   5.865  -8.912   1.092
  231    HA   VAL  28           HA       VAL  28   6.667  -6.345   2.287
  232    HB   VAL  28           HB       VAL  28   4.124  -7.000   0.718
  233   HG11  VAL  28          1HG1      VAL  28   5.362  -4.335   1.502
  234   HG12  VAL  28          2HG1      VAL  28   3.902  -5.043   2.198
  235   HG13  VAL  28          3HG1      VAL  28   3.917  -4.535   0.506
  236   HG21  VAL  28          1HG2      VAL  28   6.103  -7.304  -0.728
  237   HG22  VAL  28          2HG2      VAL  28   6.678  -5.693  -0.295
  238   HG23  VAL  28          3HG2      VAL  28   5.182  -5.875  -1.216
  239    H    GLN  29           H        GLN  29   5.902  -5.759   4.219
  240    HA   GLN  29           HA       GLN  29   3.752  -7.265   5.577
  241    HB2  GLN  29          2HB       GLN  29   6.009  -5.556   6.733
  242    HB3  GLN  29          3HB       GLN  29   4.779  -6.382   7.683
  243    HG2  GLN  29          2HG       GLN  29   6.962  -7.677   6.015
  244    HG3  GLN  29          3HG       GLN  29   6.861  -7.627   7.774
  245   HE21  GLN  29          1HE2      GLN  29   5.690  -9.165   4.885
  246   HE22  GLN  29          2HE2      GLN  29   4.805 -10.426   5.667
  247    H    VAL  30           H        VAL  30   2.347  -5.947   6.967
  248    HA   VAL  30           HA       VAL  30   1.732  -3.285   5.906
  249    HB   VAL  30           HB       VAL  30  -0.189  -4.746   6.191
  250   HG11  VAL  30          1HG1      VAL  30   0.686  -6.290   7.911
  251   HG12  VAL  30          2HG1      VAL  30  -0.920  -5.697   8.336
  252   HG13  VAL  30          3HG1      VAL  30   0.506  -5.034   9.139
  253   HG21  VAL  30          1HG2      VAL  30  -1.640  -3.343   7.634
  254   HG22  VAL  30          2HG2      VAL  30  -0.573  -2.358   6.629
  255   HG23  VAL  30          3HG2      VAL  30  -0.206  -2.591   8.340
  256    H    ARG  31           H        ARG  31   2.633  -1.551   6.821
  257    HA   ARG  31           HA       ARG  31   3.865  -1.677   9.487
  258    HB2  ARG  31          2HB       ARG  31   5.203  -0.768   7.627
  259    HB3  ARG  31          3HB       ARG  31   3.982   0.454   7.304
  260    HG2  ARG  31          2HG       ARG  31   5.916   1.405   8.477
  261    HG3  ARG  31          3HG       ARG  31   4.454   1.537   9.458
  262    HD2  ARG  31          2HD       ARG  31   5.170  -0.368  10.829
  263    HD3  ARG  31          3HD       ARG  31   6.597  -0.602   9.807
  264    HE   ARG  31           HE       ARG  31   6.718   2.005  10.717
  265   HH11  ARG  31          1HH1      ARG  31   6.694  -1.167  12.254
  266   HH12  ARG  31          2HH1      ARG  31   7.636  -0.632  13.609
  267   HH21  ARG  31          1HH2      ARG  31   7.996   2.652  12.445
  268   HH22  ARG  31          2HH2      ARG  31   8.374   1.533  13.719
  269    H    ARG  32           H        ARG  32   1.755   0.624   7.714
  270    HA   ARG  32           HA       ARG  32  -0.191   0.719   9.884
  271    HB2  ARG  32          2HB       ARG  32   1.423   3.152   9.019
  272    HB3  ARG  32          3HB       ARG  32  -0.211   3.353   9.641
  273    HG2  ARG  32          2HG       ARG  32   2.112   2.106  11.143
  274    HG3  ARG  32          3HG       ARG  32   1.492   3.742  11.373
  275    HD2  ARG  32          2HD       ARG  32  -0.641   2.863  12.179
  276    HD3  ARG  32          3HD       ARG  32  -0.139   1.210  11.820
  277    HE   ARG  32           HE       ARG  32   1.738   2.204  13.591
  278   HH11  ARG  32          1HH1      ARG  32  -1.750   1.677  13.639
  279   HH12  ARG  32          2HH1      ARG  32  -1.800   1.394  15.350
  280   HH21  ARG  32          1HH2      ARG  32   1.655   1.792  15.818
  281   HH22  ARG  32          2HH2      ARG  32   0.136   1.459  16.585
  282    H    VAL  33           H        VAL  33  -2.175   1.830   9.203
  283    HA   VAL  33           HA       VAL  33  -2.475   2.287   6.287
  284    HB   VAL  33           HB       VAL  33  -4.605   0.951   8.041
  285   HG11  VAL  33          1HG1      VAL  33  -5.579   2.292   6.235
  286   HG12  VAL  33          2HG1      VAL  33  -5.806   0.576   5.894
  287   HG13  VAL  33          3HG1      VAL  33  -4.554   1.485   5.046
  288   HG21  VAL  33          1HG2      VAL  33  -2.767  -0.646   7.659
  289   HG22  VAL  33          2HG2      VAL  33  -2.864  -0.362   5.919
  290   HG23  VAL  33          3HG2      VAL  33  -4.211  -1.131   6.764
  291    H    GLN  34           H        GLN  34  -2.939   4.432   6.086
  292    HA   GLN  34           HA       GLN  34  -4.446   5.845   8.204
  293    HB2  GLN  34          2HB       GLN  34  -2.641   6.844   5.962
  294    HB3  GLN  34          3HB       GLN  34  -3.704   7.925   6.851
  295    HG2  GLN  34          2HG       GLN  34  -1.544   8.137   7.829
  296    HG3  GLN  34          3HG       GLN  34  -2.545   7.242   8.968
  297   HE21  GLN  34          1HE2      GLN  34  -0.630   6.505   9.977
  298   HE22  GLN  34          2HE2      GLN  34   0.351   5.267   9.284
  299    H    LYS  35           H        LYS  35  -6.522   6.282   7.897
  300    HA   LYS  35           HA       LYS  35  -7.816   6.127   5.254
  301    HB2  LYS  35          2HB       LYS  35  -8.857   4.851   7.061
  302    HB3  LYS  35          3HB       LYS  35  -8.886   6.255   8.113
  303    HG2  LYS  35          2HG       LYS  35 -11.125   5.791   7.313
  304    HG3  LYS  35          3HG       LYS  35 -10.569   7.320   6.625
  305    HD2  LYS  35          2HD       LYS  35 -10.081   6.190   4.486
  306    HD3  LYS  35          3HD       LYS  35 -10.569   4.640   5.178
  307    HE2  LYS  35          2HE       LYS  35 -12.860   5.467   5.455
  308    HE3  LYS  35          3HE       LYS  35 -12.381   7.050   4.842
  309    HZ1  LYS  35          1HZ       LYS  35 -12.341   4.504   3.317
  310    HZ2  LYS  35          2HZ       LYS  35 -11.837   6.005   2.727
  311    HZ3  LYS  35          3HZ       LYS  35 -13.452   5.763   3.142
  312    H    GLN  36           H        GLN  36  -7.756   8.043   4.157
  313    HA   GLN  36           HA       GLN  36  -8.480  10.551   5.591
  314    HB2  GLN  36          2HB       GLN  36  -6.677  10.370   3.129
  315    HB3  GLN  36          3HB       GLN  36  -7.164  11.849   3.939
  316    HG2  GLN  36          2HG       GLN  36  -5.138  11.691   4.940
  317    HG3  GLN  36          3HG       GLN  36  -5.945  10.553   6.009
  318   HE21  GLN  36          1HE2      GLN  36  -6.014   8.452   3.829
  319   HE22  GLN  36          2HE2      GLN  36  -4.399   7.866   3.765
  320    H    GLY  37           H        GLY  37 -10.630   9.656   5.128
  321    HA2  GLY  37          2HA       GLY  37 -12.638   9.736   4.057
  322    HA3  GLY  37          3HA       GLY  37 -11.962  11.041   3.099
  323    H    ASN  38           H        ASN  38 -11.494  10.669   0.989
  324    HA   ASN  38           HA       ASN  38 -12.448   8.242  -0.250
  325    HB2  ASN  38          2HB       ASN  38 -10.985  10.581  -1.570
  326    HB3  ASN  38          3HB       ASN  38 -11.965   9.359  -2.382
  327   HD21  ASN  38          1HD2      ASN  38 -14.269   9.417  -2.085
  328   HD22  ASN  38          2HD2      ASN  38 -15.054  10.873  -1.587
  329    H    THR  39           H        THR  39  -9.274   9.708   0.351
  330    HA   THR  39           HA       THR  39  -7.870   7.562  -1.090
  331    HB   THR  39           HB       THR  39  -6.745  10.092   0.183
  332    HG1  THR  39           HG1      THR  39  -6.987   9.785  -2.591
  333   HG21  THR  39          1HG2      THR  39  -4.772   9.685  -1.277
  334   HG22  THR  39          2HG2      THR  39  -5.485   8.165  -1.817
  335   HG23  THR  39          3HG2      THR  39  -5.007   8.354  -0.130
  336    H    ILE  40           H        ILE  40  -7.370   5.795   0.094
  337    HA   ILE  40           HA       ILE  40  -6.470   6.032   2.891
  338    HB   ILE  40           HB       ILE  40  -7.076   3.571   1.189
  339   HG12  ILE  40          2HG1      ILE  40  -8.520   4.840   3.558
  340   HG13  ILE  40          3HG1      ILE  40  -9.109   4.714   1.905
  341   HG21  ILE  40          1HG2      ILE  40  -6.668   2.207   3.220
  342   HG22  ILE  40          2HG2      ILE  40  -6.141   3.651   4.085
  343   HG23  ILE  40          3HG2      ILE  40  -5.204   3.058   2.714
  344   HD11  ILE  40          1HD1      ILE  40  -8.717   2.437   3.847
  345   HD12  ILE  40          2HD1      ILE  40  -9.233   2.268   2.165
  346   HD13  ILE  40          3HD1      ILE  40 -10.243   3.145   3.313
  347    H    ARG  41           H        ARG  41  -4.365   6.354   3.203
  348    HA   ARG  41           HA       ARG  41  -2.344   5.547   1.201
  349    HB2  ARG  41          2HB       ARG  41  -2.143   7.557   3.493
  350    HB3  ARG  41          3HB       ARG  41  -0.852   7.179   2.350
  351    HG2  ARG  41          2HG       ARG  41  -2.276   8.043   0.498
  352    HG3  ARG  41          3HG       ARG  41  -3.520   8.467   1.680
  353    HD2  ARG  41          2HD       ARG  41  -1.929  10.006   2.783
  354    HD3  ARG  41          3HD       ARG  41  -0.702   9.593   1.583
  355    HE   ARG  41           HE       ARG  41  -2.153  10.620  -0.113
  356   HH11  ARG  41          1HH1      ARG  41  -2.715  11.523   3.246
  357   HH12  ARG  41          2HH1      ARG  41  -3.473  13.030   2.836
  358   HH21  ARG  41          1HH2      ARG  41  -3.151  12.569  -0.631
  359   HH22  ARG  41          2HH2      ARG  41  -3.720  13.626   0.620
  360    H    VAL  42           H        VAL  42  -1.877   3.488   1.719
  361    HA   VAL  42           HA       VAL  42  -1.548   2.581   4.475
  362    HB   VAL  42           HB       VAL  42  -1.044   1.033   1.882
  363   HG11  VAL  42          1HG1      VAL  42  -1.527   0.015   4.712
  364   HG12  VAL  42          2HG1      VAL  42   0.020   0.003   3.862
  365   HG13  VAL  42          3HG1      VAL  42  -1.314  -0.997   3.275
  366   HG21  VAL  42          1HG2      VAL  42  -3.359   1.806   1.906
  367   HG22  VAL  42          2HG2      VAL  42  -3.580   1.167   3.541
  368   HG23  VAL  42          3HG2      VAL  42  -3.301   0.062   2.191
  369    H    GLU  43           H        GLU  43   0.386   2.772   5.481
  370    HA   GLU  43           HA       GLU  43   2.928   2.956   4.040
  371    HB2  GLU  43          2HB       GLU  43   2.372   2.716   7.039
  372    HB3  GLU  43          3HB       GLU  43   3.947   3.036   6.310
  373    HG2  GLU  43          2HG       GLU  43   3.017   5.175   5.377
  374    HG3  GLU  43          3HG       GLU  43   1.517   4.856   6.249
  375    H    LEU  44           H        LEU  44   3.951   1.133   3.389
  376    HA   LEU  44           HA       LEU  44   3.480  -1.429   4.818
  377    HB2  LEU  44          2HB       LEU  44   4.250  -1.151   1.890
  378    HB3  LEU  44          3HB       LEU  44   3.897  -2.634   2.759
  379    HG   LEU  44           HG       LEU  44   1.506  -1.465   3.119
  380   HD11  LEU  44          1HD1      LEU  44   2.067   0.658   2.087
  381   HD12  LEU  44          2HD1      LEU  44   0.797  -0.153   1.171
  382   HD13  LEU  44          3HD1      LEU  44   2.459  -0.151   0.570
  383   HD21  LEU  44          1HD2      LEU  44   1.847  -3.616   2.000
  384   HD22  LEU  44          2HD2      LEU  44   2.271  -2.782   0.504
  385   HD23  LEU  44          3HD2      LEU  44   0.637  -2.641   1.163
  386    H    GLU  45           H        GLU  45   5.359  -2.991   4.393
  387    HA   GLU  45           HA       GLU  45   7.940  -1.587   4.681
  388    HB2  GLU  45          2HB       GLU  45   6.867  -1.966   6.893
  389    HB3  GLU  45          3HB       GLU  45   6.778  -3.691   6.551
  390    HG2  GLU  45          2HG       GLU  45   9.213  -3.866   6.582
  391    HG3  GLU  45          3HG       GLU  45   9.366  -2.115   6.770
  392    H    LEU  46           H        LEU  46   8.879  -2.341   2.887
  393    HA   LEU  46           HA       LEU  46   9.000  -5.243   2.312
  394    HB2  LEU  46          2HB       LEU  46   7.974  -3.812   0.553
  395    HB3  LEU  46          3HB       LEU  46   9.421  -2.832   0.486
  396    HG   LEU  46           HG       LEU  46   9.508  -5.795  -0.233
  397   HD11  LEU  46          1HD1      LEU  46   9.170  -5.222  -2.584
  398   HD12  LEU  46          2HD1      LEU  46   8.902  -3.529  -2.156
  399   HD13  LEU  46          3HD1      LEU  46   7.760  -4.765  -1.627
  400   HD21  LEU  46          1HD2      LEU  46  11.438  -5.126  -1.637
  401   HD22  LEU  46          2HD2      LEU  46  11.700  -4.732   0.059
  402   HD23  LEU  46          3HD2      LEU  46  11.263  -3.457  -1.079
  403    H    ARG  47           H        ARG  47  11.046  -6.185   2.336
  404    HA   ARG  47           HA       ARG  47  13.205  -4.464   3.411
  405    HB2  ARG  47          2HB       ARG  47  12.604  -7.432   3.713
  406    HB3  ARG  47          3HB       ARG  47  14.168  -6.752   4.157
  407    HG2  ARG  47          2HG       ARG  47  13.183  -5.347   5.843
  408    HG3  ARG  47          3HG       ARG  47  11.550  -5.734   5.305
  409    HD2  ARG  47          2HD       ARG  47  11.731  -7.984   6.145
  410    HD3  ARG  47          3HD       ARG  47  13.459  -7.799   6.438
  411    HE   ARG  47           HE       ARG  47  12.998  -6.834   8.441
  412   HH11  ARG  47          1HH1      ARG  47  10.006  -6.672   6.574
  413   HH12  ARG  47          2HH1      ARG  47   9.085  -6.056   7.908
  414   HH21  ARG  47          1HH2      ARG  47  11.762  -5.984  10.146
  415   HH22  ARG  47          2HH2      ARG  47  10.070  -5.670   9.913
  416    H    THR  48           H        THR  48  14.182  -3.673   1.663
  417    HA   THR  48           HA       THR  48  14.867  -5.251  -0.677
  418    HB   THR  48           HB       THR  48  15.652  -2.380   0.028
  419    HG1  THR  48           HG1      THR  48  13.778  -1.779  -0.846
  420   HG21  THR  48          1HG2      THR  48  15.992  -2.110  -2.417
  421   HG22  THR  48          2HG2      THR  48  15.619  -3.817  -2.662
  422   HG23  THR  48          3HG2      THR  48  17.068  -3.351  -1.768
  423    H    ASN  49           H        ASN  49  16.476  -6.688  -0.418
  424    HA   ASN  49           HA       ASN  49  18.389  -7.765   0.143
  425    HB2  ASN  49          2HB       ASN  49  19.588  -4.999   0.677
  426    HB3  ASN  49          3HB       ASN  49  20.492  -6.496   0.504
  427   HD21  ASN  49          1HD2      ASN  49  18.779  -3.991  -1.184
  428   HD22  ASN  49          2HD2      ASN  49  19.246  -4.473  -2.775
  429    H    GLY  50           H        GLY  50  16.316  -6.824   2.204
  430    HA2  GLY  50          2HA       GLY  50  16.091  -7.536   4.452
  431    HA3  GLY  50          3HA       GLY  50  17.826  -7.408   4.675
  432    H    LYS  51           H        LYS  51  17.534  -4.623   3.218
  433    HA   LYS  51           HA       LYS  51  17.387  -3.013   5.579
  434    HB2  LYS  51          2HB       LYS  51  17.397  -2.199   2.635
  435    HB3  LYS  51          3HB       LYS  51  17.528  -1.061   3.969
  436    HG2  LYS  51          2HG       LYS  51  19.548  -3.279   3.842
  437    HG3  LYS  51          3HG       LYS  51  19.670  -1.994   2.648
  438    HD2  LYS  51          2HD       LYS  51  21.136  -1.480   4.501
  439    HD3  LYS  51          3HD       LYS  51  19.815  -0.317   4.492
  440    HE2  LYS  51          2HE       LYS  51  20.352  -1.005   6.779
  441    HE3  LYS  51          3HE       LYS  51  18.736  -1.565   6.351
  442    HZ1  LYS  51          1HZ       LYS  51  19.648  -3.763   5.943
  443    HZ2  LYS  51          2HZ       LYS  51  20.010  -3.258   7.515
  444    HZ3  LYS  51          3HZ       LYS  51  21.201  -3.217   6.319
  445    H    LYS  52           H        LYS  52  15.741  -1.744   6.362
  446    HA   LYS  52           HA       LYS  52  13.040  -2.507   5.678
  447    HB2  LYS  52          2HB       LYS  52  13.649  -2.256   8.036
  448    HB3  LYS  52          3HB       LYS  52  14.206  -0.608   7.764
  449    HG2  LYS  52          2HG       LYS  52  11.811   0.007   7.182
  450    HG3  LYS  52          3HG       LYS  52  11.337  -1.607   7.722
  451    HD2  LYS  52          2HD       LYS  52  12.103  -1.132   9.990
  452    HD3  LYS  52          3HD       LYS  52  12.807   0.406   9.477
  453    HE2  LYS  52          2HE       LYS  52  10.520   1.211   8.899
  454    HE3  LYS  52          3HE       LYS  52   9.853  -0.295   9.529
  455    HZ1  LYS  52          1HZ       LYS  52   9.726   1.462  11.153
  456    HZ2  LYS  52          2HZ       LYS  52  11.394   1.715  11.070
  457    HZ3  LYS  52          3HZ       LYS  52  10.793   0.266  11.687
  458    H    GLU  53           H        GLU  53  12.456  -1.654   3.736
  459    HA   GLU  53           HA       GLU  53  12.510   1.275   3.308
  460    HB2  GLU  53          2HB       GLU  53  11.983  -0.994   1.327
  461    HB3  GLU  53          3HB       GLU  53  11.978   0.725   0.930
  462    HG2  GLU  53          2HG       GLU  53  14.349  -0.933   1.838
  463    HG3  GLU  53          3HG       GLU  53  14.073  -0.281   0.221
  464    H    ASN  54           H        ASN  54  10.726   2.218   4.042
  465    HA   ASN  54           HA       ASN  54   8.128   0.876   4.027
  466    HB2  ASN  54          2HB       ASN  54   9.040   3.529   5.209
  467    HB3  ASN  54          3HB       ASN  54   7.365   2.983   5.245
  468   HD21  ASN  54          1HD2      ASN  54   7.859   0.209   5.769
  469   HD22  ASN  54          2HD2      ASN  54   8.477   0.092   7.379
  470    H    TYR  55           H        TYR  55   6.853   1.045   2.309
  471    HA   TYR  55           HA       TYR  55   7.038   3.407   0.524
  472    HB2  TYR  55          2HB       TYR  55   5.876   0.645  -0.046
  473    HB3  TYR  55          3HB       TYR  55   5.938   1.983  -1.186
  474    HD1  TYR  55           HD1      TYR  55   7.959   2.446  -2.451
  475    HD2  TYR  55           HD2      TYR  55   8.028  -0.509   0.644
  476    HE1  TYR  55           HE1      TYR  55  10.143   1.635  -3.261
  477    HE2  TYR  55           HE2      TYR  55  10.205  -1.304  -0.163
  478    HH   TYR  55           HH       TYR  55  11.534  -1.305  -2.197
  479    H    THR  56           H        THR  56   5.464   4.838   0.823
  480    HA   THR  56           HA       THR  56   2.880   4.146   1.978
  481    HB   THR  56           HB       THR  56   3.951   6.831   0.996
  482    HG1  THR  56           HG1      THR  56   4.117   5.455   3.447
  483   HG21  THR  56          1HG2      THR  56   1.542   6.217   2.758
  484   HG22  THR  56          2HG2      THR  56   1.464   6.771   1.083
  485   HG23  THR  56          3HG2      THR  56   2.130   7.828   2.330
  486    H    VAL  57           H        VAL  57   1.676   3.058   0.528
  487    HA   VAL  57           HA       VAL  57   1.517   3.878  -2.283
  488    HB   VAL  57           HB       VAL  57   0.278   1.478  -0.855
  489   HG11  VAL  57          1HG1      VAL  57  -0.213   0.624  -3.146
  490   HG12  VAL  57          2HG1      VAL  57   0.359   2.149  -3.825
  491   HG13  VAL  57          3HG1      VAL  57  -1.075   2.125  -2.804
  492   HG21  VAL  57          1HG2      VAL  57   2.746   1.344  -0.959
  493   HG22  VAL  57          2HG2      VAL  57   2.696   1.612  -2.705
  494   HG23  VAL  57          3HG2      VAL  57   2.004   0.138  -2.018
  495    H    GLU  58           H        GLU  58   0.227   5.507  -2.586
  496    HA   GLU  58           HA       GLU  58  -2.061   6.165  -0.907
  497    HB2  GLU  58          2HB       GLU  58  -0.908   7.617  -3.335
  498    HB3  GLU  58          3HB       GLU  58  -2.055   8.277  -2.167
  499    HG2  GLU  58          2HG       GLU  58  -0.344   8.169  -0.396
  500    HG3  GLU  58          3HG       GLU  58   0.797   7.434  -1.519
  501    H    VAL  59           H        VAL  59  -3.803   4.941  -1.388
  502    HA   VAL  59           HA       VAL  59  -4.626   4.480  -4.208
  503    HB   VAL  59           HB       VAL  59  -5.495   2.854  -1.766
  504   HG11  VAL  59          1HG1      VAL  59  -5.628   2.227  -4.732
  505   HG12  VAL  59          2HG1      VAL  59  -6.988   2.698  -3.708
  506   HG13  VAL  59          3HG1      VAL  59  -6.165   1.160  -3.430
  507   HG21  VAL  59          1HG2      VAL  59  -3.055   2.606  -1.949
  508   HG22  VAL  59          2HG2      VAL  59  -3.206   2.183  -3.659
  509   HG23  VAL  59          3HG2      VAL  59  -3.860   1.104  -2.422
  510    H    GLU  60           H        GLU  60  -6.600   5.394  -4.799
  511    HA   GLU  60           HA       GLU  60  -8.222   6.712  -2.693
  512    HB2  GLU  60          2HB       GLU  60  -7.013   8.228  -4.281
  513    HB3  GLU  60          3HB       GLU  60  -7.929   7.524  -5.610
  514    HG2  GLU  60          2HG       GLU  60 -10.032   8.339  -4.582
  515    HG3  GLU  60          3HG       GLU  60  -9.110   9.055  -3.258
  516    H    ARG  61           H        ARG  61 -10.494   6.698  -2.928
  517    HA   ARG  61           HA       ARG  61 -11.582   4.211  -3.830
  518    HB2  ARG  61          2HB       ARG  61 -12.405   5.291  -1.771
  519    HB3  ARG  61          3HB       ARG  61 -12.954   6.691  -2.688
  520    HG2  ARG  61          2HG       ARG  61 -14.895   5.371  -2.231
  521    HG3  ARG  61          3HG       ARG  61 -14.529   5.139  -3.939
  522    HD2  ARG  61          2HD       ARG  61 -14.929   2.946  -3.319
  523    HD3  ARG  61          3HD       ARG  61 -13.195   3.011  -3.027
  524    HE   ARG  61           HE       ARG  61 -13.594   3.077  -0.699
  525   HH11  ARG  61          1HH1      ARG  61 -16.599   2.800  -2.535
  526   HH12  ARG  61          2HH1      ARG  61 -17.514   2.276  -1.163
  527   HH21  ARG  61          1HH2      ARG  61 -14.848   2.368   1.047
  528   HH22  ARG  61          2HH2      ARG  61 -16.526   2.035   0.847
  529    H    GLN  62           H        GLN  62 -12.423   3.795  -5.726
  530    HA   GLN  62           HA       GLN  62 -13.673   5.894  -7.390
  531    HB2  GLN  62          2HB       GLN  62 -11.463   4.230  -8.103
  532    HB3  GLN  62          3HB       GLN  62 -12.828   3.516  -8.935
  533    HG2  GLN  62          2HG       GLN  62 -11.961   6.409  -9.160
  534    HG3  GLN  62          3HG       GLN  62 -11.566   5.145 -10.317
  535   HE21  GLN  62          1HE2      GLN  62 -12.560   6.138 -12.044
  536   HE22  GLN  62          2HE2      GLN  62 -14.274   6.344 -12.173
  537    H    GLY  63           H        GLY  63 -15.712   5.562  -6.513
  538    HA2  GLY  63          2HA       GLY  63 -17.815   4.676  -6.384
  539    HA3  GLY  63          3HA       GLY  63 -17.311   3.386  -7.463
  540    H    ASN  64           H        ASN  64 -16.986   1.379  -6.604
  541    HA   ASN  64           HA       ASN  64 -16.736   1.041  -3.654
  542    HB2  ASN  64          2HB       ASN  64 -18.141  -0.787  -5.659
  543    HB3  ASN  64          3HB       ASN  64 -17.773  -1.263  -4.003
  544   HD21  ASN  64          1HD2      ASN  64 -20.352  -1.027  -5.345
  545   HD22  ASN  64          2HD2      ASN  64 -21.280   0.083  -4.402
  546    H    THR  65           H        THR  65 -14.999   0.986  -6.411
  547    HA   THR  65           HA       THR  65 -13.190  -1.188  -5.487
  548    HB   THR  65           HB       THR  65 -12.224  -1.040  -7.869
  549    HG1  THR  65           HG1      THR  65 -13.812   0.987  -8.093
  550   HG21  THR  65          1HG2      THR  65 -15.080  -2.050  -7.562
  551   HG22  THR  65          2HG2      THR  65 -13.614  -2.944  -7.158
  552   HG23  THR  65          3HG2      THR  65 -13.954  -2.527  -8.838
  553    H    TRP  66           H        TRP  66 -10.840  -0.605  -6.381
  554    HA   TRP  66           HA       TRP  66 -10.169   2.066  -5.295
  555    HB2  TRP  66          2HB       TRP  66  -8.805  -0.638  -4.903
  556    HB3  TRP  66          3HB       TRP  66  -8.064   0.892  -4.436
  557    HD1  TRP  66           HD1      TRP  66 -10.538  -1.659  -3.184
  558    HE1  TRP  66           HE1      TRP  66 -11.582  -0.816  -0.990
  559    HE3  TRP  66           HE3      TRP  66  -8.773   3.135  -3.175
  560    HZ2  TRP  66           HZ2      TRP  66 -11.694   1.559   0.496
  561    HZ3  TRP  66           HZ3      TRP  66  -9.402   4.637  -1.329
  562    HH2  TRP  66           HH2      TRP  66 -10.840   3.854   0.479
  563    H    THR  67           H        THR  67  -8.338   3.089  -6.100
  564    HA   THR  67           HA       THR  67  -6.993   2.001  -8.476
  565    HB   THR  67           HB       THR  67  -8.645   3.461  -9.474
  566    HG1  THR  67           HG1      THR  67  -6.853   5.338  -9.886
  567   HG21  THR  67          1HG2      THR  67  -9.296   4.857  -7.542
  568   HG22  THR  67          2HG2      THR  67  -8.876   5.872  -8.924
  569   HG23  THR  67          3HG2      THR  67  -7.731   5.677  -7.595
  570    H    VAL  68           H        VAL  68  -4.895   1.932  -7.957
  571    HA   VAL  68           HA       VAL  68  -3.712   3.413  -5.820
  572    HB   VAL  68           HB       VAL  68  -2.329   1.871  -8.065
  573   HG11  VAL  68          1HG1      VAL  68  -0.350   1.817  -6.565
  574   HG12  VAL  68          2HG1      VAL  68  -1.189   2.858  -5.414
  575   HG13  VAL  68          3HG1      VAL  68  -0.773   3.473  -7.015
  576   HG21  VAL  68          1HG2      VAL  68  -2.133   0.038  -6.422
  577   HG22  VAL  68          2HG2      VAL  68  -3.822   0.432  -6.741
  578   HG23  VAL  68          3HG2      VAL  68  -3.054   0.980  -5.247
  579    H    LYS  69           H        LYS  69  -3.525   5.540  -5.963
  580    HA   LYS  69           HA       LYS  69  -3.254   7.067  -8.343
  581    HB2  LYS  69          2HB       LYS  69  -2.782   7.794  -5.415
  582    HB3  LYS  69          3HB       LYS  69  -2.758   8.964  -6.733
  583    HG2  LYS  69          2HG       LYS  69  -5.150   7.279  -5.918
  584    HG3  LYS  69          3HG       LYS  69  -4.900   8.980  -5.512
  585    HD2  LYS  69          2HD       LYS  69  -5.254   7.841  -8.320
  586    HD3  LYS  69          3HD       LYS  69  -6.456   8.755  -7.405
  587    HE2  LYS  69          2HE       LYS  69  -5.026  10.748  -7.460
  588    HE3  LYS  69          3HE       LYS  69  -3.757   9.845  -8.287
  589    HZ1  LYS  69          1HZ       LYS  69  -6.458  10.397  -9.364
  590    HZ2  LYS  69          2HZ       LYS  69  -5.235   9.546 -10.156
  591    HZ3  LYS  69          3HZ       LYS  69  -5.036  11.187  -9.812
  592    H    ARG  70           H        ARG  70  -0.941   6.320  -5.702
  593    HA   ARG  70           HA       ARG  70   1.315   6.546  -7.542
  594    HB2  ARG  70          2HB       ARG  70   0.925   8.896  -6.922
  595    HB3  ARG  70          3HB       ARG  70   0.919   8.480  -5.210
  596    HG2  ARG  70          2HG       ARG  70   3.304   7.814  -5.375
  597    HG3  ARG  70          3HG       ARG  70   3.306   8.264  -7.081
  598    HD2  ARG  70          2HD       ARG  70   2.955  10.599  -6.515
  599    HD3  ARG  70          3HD       ARG  70   2.726  10.191  -4.806
  600    HE   ARG  70           HE       ARG  70   5.207   9.196  -5.490
  601   HH11  ARG  70          1HH1      ARG  70   3.754  12.406  -5.408
  602   HH12  ARG  70          2HH1      ARG  70   5.270  13.195  -5.098
  603   HH21  ARG  70          1HH2      ARG  70   7.146  10.237  -5.105
  604   HH22  ARG  70          2HH2      ARG  70   7.190  11.963  -4.927
  605    H    ILE  71           H        ILE  71   3.005   5.276  -6.918
  606    HA   ILE  71           HA       ILE  71   3.117   4.159  -4.198
  607    HB   ILE  71           HB       ILE  71   5.115   3.681  -6.468
  608   HG12  ILE  71          2HG1      ILE  71   2.900   2.881  -7.222
  609   HG13  ILE  71          3HG1      ILE  71   3.962   1.517  -6.903
  610   HG21  ILE  71          1HG2      ILE  71   5.756   1.675  -5.105
  611   HG22  ILE  71          2HG2      ILE  71   4.624   2.179  -3.856
  612   HG23  ILE  71          3HG2      ILE  71   6.018   3.189  -4.241
  613   HD11  ILE  71          1HD1      ILE  71   1.793   2.521  -5.078
  614   HD12  ILE  71          2HD1      ILE  71   2.831   1.117  -4.796
  615   HD13  ILE  71          3HD1      ILE  71   1.701   1.126  -6.149
  616    H    THR  72           H        THR  72   3.850   5.739  -2.825
  617    HA   THR  72           HA       THR  72   6.211   7.351  -3.514
  618    HB   THR  72           HB       THR  72   4.406   7.454  -1.043
  619    HG1  THR  72           HG1      THR  72   3.156   8.350  -2.529
  620   HG21  THR  72          1HG2      THR  72   5.494   9.639  -0.600
  621   HG22  THR  72          2HG2      THR  72   6.561   9.393  -1.984
  622   HG23  THR  72          3HG2      THR  72   6.683   8.331  -0.580
  623    H    ARG  73           H        ARG  73   8.178   6.774  -2.773
  624    HA   ARG  73           HA       ARG  73   8.506   4.652  -0.751
  625    HB2  ARG  73          2HB       ARG  73   9.754   4.430  -2.899
  626    HB3  ARG  73          3HB       ARG  73  10.526   5.988  -2.620
  627    HG2  ARG  73          2HG       ARG  73  11.662   5.058  -0.620
  628    HG3  ARG  73          3HG       ARG  73  10.883   3.499  -0.910
  629    HD2  ARG  73          2HD       ARG  73  12.039   3.319  -3.072
  630    HD3  ARG  73          3HD       ARG  73  12.793   4.895  -2.808
  631    HE   ARG  73           HE       ARG  73  13.440   3.230  -0.632
  632   HH11  ARG  73          1HH1      ARG  73  14.145   3.471  -4.071
  633   HH12  ARG  73          2HH1      ARG  73  15.694   2.709  -3.935
  634   HH21  ARG  73          1HH2      ARG  73  15.481   2.241  -0.461
  635   HH22  ARG  73          2HH2      ARG  73  16.453   2.011  -1.887
  636    H    THR  74           H        THR  74   9.626   5.061   1.169
  637    HA   THR  74           HA       THR  74   9.789   7.641   2.294
  638    HB   THR  74           HB       THR  74   9.675   5.621   3.712
  639    HG1  THR  74           HG1      THR  74  10.599   6.888   5.088
  640   HG21  THR  74          1HG2      THR  74  11.034   4.056   2.357
  641   HG22  THR  74          2HG2      THR  74  11.595   4.099   4.032
  642   HG23  THR  74          3HG2      THR  74  12.490   4.959   2.775
  643    H    VAL  75           H        VAL  75  11.238   9.248   1.882
  644    HA   VAL  75           HA       VAL  75  13.457   8.836   0.101
  645    HB   VAL  75           HB       VAL  75  12.233  10.909  -0.111
  646   HG11  VAL  75          1HG1      VAL  75  11.401  11.202   2.182
  647   HG12  VAL  75          2HG1      VAL  75  12.157  12.686   1.593
  648   HG13  VAL  75          3HG1      VAL  75  13.020  11.642   2.727
  649   HG21  VAL  75          1HG2      VAL  75  14.626  11.012  -0.693
  650   HG22  VAL  75          2HG2      VAL  75  15.020  11.512   0.953
  651   HG23  VAL  75          3HG2      VAL  75  14.067  12.575  -0.083
  652    H    GLY  76           H        GLY  76  15.008   7.586   0.951
  653    HA2  GLY  76          2HA       GLY  76  16.199   8.195   3.596
  654    HA3  GLY  76          3HA       GLY  76  16.414   6.717   2.660
  655    H    SER  77           H        SER  77  18.468   6.554   1.958
  656    HA   SER  77           HA       SER  77  20.149   8.796   1.360
  657    HB2  SER  77          2HB       SER  77  20.443   5.843   0.665
  658    HB3  SER  77          3HB       SER  77  21.711   7.061   0.467
  659    HG   SER  77           HG       SER  77  20.986   7.381   2.904
  660    H    LEU  78           H        LEU  78  19.317  10.093  -0.169
  661    HA   LEU  78           HA       LEU  78  19.067   9.151  -2.932
  662    HB2  LEU  78          2HB       LEU  78  16.773   9.133  -1.676
  663    HB3  LEU  78          3HB       LEU  78  16.883  10.878  -1.683
  664    HG   LEU  78           HG       LEU  78  16.834   9.171  -4.220
  665   HD11  LEU  78          1HD1      LEU  78  14.482   9.806  -4.476
  666   HD12  LEU  78          2HD1      LEU  78  14.516  10.629  -2.913
  667   HD13  LEU  78          3HD1      LEU  78  14.739   8.879  -2.998
  668   HD21  LEU  78          1HD2      LEU  78  17.847  11.388  -4.585
  669   HD22  LEU  78          2HD2      LEU  78  16.425  12.170  -3.897
  670   HD23  LEU  78          3HD2      LEU  78  16.291  11.263  -5.407
  671    H    GLU  79           H        GLU  79  20.756  10.361  -3.669
  672    HA   GLU  79           HA       GLU  79  21.342  13.056  -2.955
  673    HB2  GLU  79          2HB       GLU  79  22.080  11.478  -5.476
  674    HB3  GLU  79          3HB       GLU  79  22.672  13.098  -5.139
  675    HG2  GLU  79          2HG       GLU  79  24.398  11.488  -4.610
  676    HG3  GLU  79          3HG       GLU  79  23.830  12.255  -3.125
  677    H    HIS  80           H        HIS  80  19.412  14.253  -3.052
  678    HA   HIS  80           HA       HIS  80  17.651  14.243  -5.287
  679    HB2  HIS  80          2HB       HIS  80  16.854  15.068  -3.119
  680    HB3  HIS  80          3HB       HIS  80  18.019  16.392  -3.152
  681    HD1  HIS  80           HD1      HIS  80  17.298  18.523  -4.333
  682    HD2  HIS  80           HD2      HIS  80  14.775  15.326  -5.187
  683    HE1  HIS  80           HE1      HIS  80  15.418  19.482  -5.693
  684    HE2  HIS  80           HE2      HIS  80  13.963  17.523  -6.261
  685    H    HIS  81           H        HIS  81  18.523  14.621  -7.199
  686    HA   HIS  81           HA       HIS  81  20.481  16.574  -7.893
  687    HB2  HIS  81          2HB       HIS  81  19.779  14.428  -9.190
  688    HB3  HIS  81          3HB       HIS  81  18.397  15.344  -9.769
  689    HD1  HIS  81           HD1      HIS  81  19.127  15.254 -12.205
  690    HD2  HIS  81           HD2      HIS  81  22.020  16.886  -9.709
  691    HE1  HIS  81           HE1      HIS  81  20.897  16.172 -13.723
  692    HE2  HIS  81           HE2      HIS  81  22.537  17.291 -12.194
  693    H    HIS  82           H        HIS  82  20.147  18.618  -8.870
  694    HA   HIS  82           HA       HIS  82  18.293  20.313  -7.766
  695    HB2  HIS  82          2HB       HIS  82  20.410  21.045  -8.848
  696    HB3  HIS  82          3HB       HIS  82  19.724  20.699 -10.432
  697    HD1  HIS  82           HD1      HIS  82  19.459  22.951 -11.461
  698    HD2  HIS  82           HD2      HIS  82  18.099  22.893  -7.534
  699    HE1  HIS  82           HE1      HIS  82  18.465  25.216 -11.055
  700    HE2  HIS  82           HE2      HIS  82  17.560  25.122  -8.713
  701    H    HIS  83           H        HIS  83  18.104  18.696 -10.925
  702    HA   HIS  83           HA       HIS  83  15.274  18.422 -10.673
  703    HB2  HIS  83          2HB       HIS  83  14.617  19.530 -12.792
  704    HB3  HIS  83          3HB       HIS  83  15.288  20.696 -11.668
  705    HD1  HIS  83           HD1      HIS  83  15.537  19.643 -15.117
  706    HD2  HIS  83           HD2      HIS  83  18.139  21.316 -12.352
  707    HE1  HIS  83           HE1      HIS  83  17.431  20.586 -16.456
  708    HE2  HIS  83           HE2      HIS  83  19.058  21.446 -14.753
  709    H    HIS  84           H        HIS  84  14.916  16.387 -11.364
  710    HA   HIS  84           HA       HIS  84  16.630  15.056 -13.302
  711    HB2  HIS  84          2HB       HIS  84  15.632  13.781 -11.388
  712    HB3  HIS  84          3HB       HIS  84  14.022  14.084 -12.036
  713    HD1  HIS  84           HD1      HIS  84  17.054  11.950 -12.521
  714    HD2  HIS  84           HD2      HIS  84  13.378  12.531 -14.370
  715    HE1  HIS  84           HE1      HIS  84  16.784  10.046 -14.125
  716    HE2  HIS  84           HE2      HIS  84  14.508  10.343 -15.119
  717    H    HIS  85           H        HIS  85  13.521  16.649 -13.164
  718    HA   HIS  85           HA       HIS  85  12.554  15.823 -15.729
  719    HB2  HIS  85          2HB       HIS  85  11.635  17.928 -13.736
  720    HB3  HIS  85          3HB       HIS  85  10.864  17.754 -15.311
  721    HD1  HIS  85           HD1      HIS  85  11.060  16.164 -11.947
  722    HD2  HIS  85           HD2      HIS  85   9.427  15.325 -15.672
  723    HE1  HIS  85           HE1      HIS  85   9.476  14.253 -11.587
  724    HE2  HIS  85           HE2      HIS  85   8.420  13.854 -13.823
  Start of MODEL   19
    1    H1   MET   1          1H        MET   1 -24.722  -3.773   6.057
    2    H2   MET   1          2H        MET   1 -24.841  -5.203   6.952
    3    H3   MET   1          3H        MET   1 -24.573  -5.269   5.282
    4    HA   MET   1           HA       MET   1 -22.722  -4.148   7.296
    5    HB2  MET   1          2HB       MET   1 -22.978  -6.671   7.290
    6    HB3  MET   1          3HB       MET   1 -22.423  -6.682   5.623
    7    HG2  MET   1          2HG       MET   1 -20.247  -5.784   6.331
    8    HG3  MET   1          3HG       MET   1 -20.809  -5.711   8.002
    9    HE1  MET   1          1HE       MET   1 -22.559  -8.585   7.977
   10    HE2  MET   1          2HE       MET   1 -21.608  -8.001   9.347
   11    HE3  MET   1          3HE       MET   1 -21.342  -9.625   8.693
   12    HA   PRO   2           HA       PRO   2 -21.765  -1.874   3.393
   13    HB2  PRO   2          2HB       PRO   2 -20.163   0.062   4.497
   14    HB3  PRO   2          3HB       PRO   2 -21.932   0.081   4.667
   15    HG2  PRO   2          2HG       PRO   2 -19.875  -0.950   6.612
   16    HG3  PRO   2          3HG       PRO   2 -21.249   0.145   6.911
   17    HD2  PRO   2          2HD       PRO   2 -21.425  -2.482   7.475
   18    HD3  PRO   2          3HD       PRO   2 -22.825  -1.589   6.839
   19    H    SER   3           H        SER   3 -19.629  -3.627   5.420
   20    HA   SER   3           HA       SER   3 -17.638  -4.643   5.203
   21    HB2  SER   3          2HB       SER   3 -17.760  -3.860   2.262
   22    HB3  SER   3          3HB       SER   3 -16.693  -5.079   2.966
   23    HG   SER   3           HG       SER   3 -19.537  -5.152   2.991
   24    H    GLU   4           H        GLU   4 -17.843  -1.978   6.039
   25    HA   GLU   4           HA       GLU   4 -15.943  -0.189   4.913
   26    HB2  GLU   4          2HB       GLU   4 -17.933   0.506   6.236
   27    HB3  GLU   4          3HB       GLU   4 -17.212  -0.192   7.682
   28    HG2  GLU   4          2HG       GLU   4 -15.311   1.455   7.450
   29    HG3  GLU   4          3HG       GLU   4 -16.178   2.203   6.109
   30    H    GLU   5           H        GLU   5 -15.662  -2.712   7.371
   31    HA   GLU   5           HA       GLU   5 -12.996  -1.810   8.194
   32    HB2  GLU   5          2HB       GLU   5 -14.524  -4.317   9.018
   33    HB3  GLU   5          3HB       GLU   5 -13.026  -3.717   9.740
   34    HG2  GLU   5          2HG       GLU   5 -14.282  -1.603  10.355
   35    HG3  GLU   5          3HG       GLU   5 -15.763  -2.409   9.829
   36    H    GLU   6           H        GLU   6 -14.480  -4.105   5.990
   37    HA   GLU   6           HA       GLU   6 -12.076  -5.671   5.587
   38    HB2  GLU   6          2HB       GLU   6 -14.319  -6.717   5.345
   39    HB3  GLU   6          3HB       GLU   6 -14.629  -5.710   3.929
   40    HG2  GLU   6          2HG       GLU   6 -12.752  -6.754   2.740
   41    HG3  GLU   6          3HG       GLU   6 -12.342  -7.705   4.167
   42    H    GLU   7           H        GLU   7 -13.491  -2.822   4.105
   43    HA   GLU   7           HA       GLU   7 -12.206  -2.914   1.602
   44    HB2  GLU   7          2HB       GLU   7 -12.549  -0.480   1.485
   45    HB3  GLU   7          3HB       GLU   7 -13.999  -1.308   2.043
   46    HG2  GLU   7          2HG       GLU   7 -13.628  -0.612   4.296
   47    HG3  GLU   7          3HG       GLU   7 -12.018  -0.015   3.917
   48    H    LYS   8           H        LYS   8 -11.020  -1.883   4.793
   49    HA   LYS   8           HA       LYS   8  -8.535  -0.766   3.988
   50    HB2  LYS   8          2HB       LYS   8  -9.404  -2.007   6.638
   51    HB3  LYS   8          3HB       LYS   8  -7.770  -1.408   6.390
   52    HG2  LYS   8          2HG       LYS   8  -8.968   0.311   7.520
   53    HG3  LYS   8          3HG       LYS   8  -8.729   0.850   5.853
   54    HD2  LYS   8          2HD       LYS   8 -11.082   0.064   5.354
   55    HD3  LYS   8          3HD       LYS   8 -11.285  -0.260   7.077
   56    HE2  LYS   8          2HE       LYS   8 -10.884   2.134   7.559
   57    HE3  LYS   8          3HE       LYS   8 -10.683   2.440   5.834
   58    HZ1  LYS   8          1HZ       LYS   8 -13.160   1.424   7.117
   59    HZ2  LYS   8          2HZ       LYS   8 -12.960   1.769   5.472
   60    HZ3  LYS   8          3HZ       LYS   8 -12.895   3.021   6.604
   61    H    ARG   9           H        ARG   9  -9.506  -4.043   4.926
   62    HA   ARG   9           HA       ARG   9  -7.053  -5.390   4.794
   63    HB2  ARG   9          2HB       ARG   9  -9.855  -6.421   4.185
   64    HB3  ARG   9          3HB       ARG   9  -8.446  -7.449   4.446
   65    HG2  ARG   9          2HG       ARG   9  -8.271  -6.760   6.746
   66    HG3  ARG   9          3HG       ARG   9  -9.506  -5.515   6.532
   67    HD2  ARG   9          2HD       ARG   9 -10.333  -7.576   7.701
   68    HD3  ARG   9          3HD       ARG   9 -11.230  -7.185   6.232
   69    HE   ARG   9           HE       ARG   9  -9.135  -8.992   5.635
   70   HH11  ARG   9          1HH1      ARG   9 -12.296  -9.009   7.207
   71   HH12  ARG   9          2HH1      ARG   9 -12.577 -10.681   6.855
   72   HH21  ARG   9          1HH2      ARG   9  -9.546 -11.148   5.155
   73   HH22  ARG   9          2HH2      ARG   9 -11.020 -11.895   5.692
   74    H    GLN  10           H        GLN  10  -9.471  -4.731   2.326
   75    HA   GLN  10           HA       GLN  10  -8.294  -6.079   0.146
   76    HB2  GLN  10          2HB       GLN  10 -10.282  -3.760   0.239
   77    HB3  GLN  10          3HB       GLN  10  -9.857  -4.629  -1.239
   78    HG2  GLN  10          2HG       GLN  10 -10.738  -6.714  -0.285
   79    HG3  GLN  10          3HG       GLN  10 -11.136  -5.879   1.217
   80   HE21  GLN  10          1HE2      GLN  10 -12.943  -4.516   1.263
   81   HE22  GLN  10          2HE2      GLN  10 -14.109  -4.466  -0.005
   82    H    VAL  11           H        VAL  11  -8.116  -2.702   1.231
   83    HA   VAL  11           HA       VAL  11  -6.646  -1.596  -0.904
   84    HB   VAL  11           HB       VAL  11  -7.117  -0.691   1.974
   85   HG11  VAL  11          1HG1      VAL  11  -5.683   0.904  -0.164
   86   HG12  VAL  11          2HG1      VAL  11  -4.968   0.290   1.316
   87   HG13  VAL  11          3HG1      VAL  11  -6.214   1.535   1.394
   88   HG21  VAL  11          1HG2      VAL  11  -8.142   0.399  -0.669
   89   HG22  VAL  11          2HG2      VAL  11  -8.602   0.958   0.940
   90   HG23  VAL  11          3HG2      VAL  11  -9.040  -0.663   0.412
   91    H    LYS  12           H        LYS  12  -5.588  -3.022   2.176
   92    HA   LYS  12           HA       LYS  12  -2.825  -2.397   2.035
   93    HB2  LYS  12          2HB       LYS  12  -4.252  -4.702   3.434
   94    HB3  LYS  12          3HB       LYS  12  -2.556  -4.298   3.677
   95    HG2  LYS  12          2HG       LYS  12  -3.213  -2.099   4.602
   96    HG3  LYS  12          3HG       LYS  12  -4.914  -2.511   4.370
   97    HD2  LYS  12          2HD       LYS  12  -2.943  -3.953   6.199
   98    HD3  LYS  12          3HD       LYS  12  -4.241  -2.873   6.718
   99    HE2  LYS  12          2HE       LYS  12  -5.920  -4.451   5.903
  100    HE3  LYS  12          3HE       LYS  12  -4.667  -5.501   5.244
  101    HZ1  LYS  12          1HZ       LYS  12  -3.848  -5.836   7.517
  102    HZ2  LYS  12          2HZ       LYS  12  -5.445  -6.363   7.330
  103    HZ3  LYS  12          3HZ       LYS  12  -5.122  -4.901   8.115
  104    H    GLN  13           H        GLN  13  -4.764  -5.092   0.811
  105    HA   GLN  13           HA       GLN  13  -2.601  -6.718  -0.119
  106    HB2  GLN  13          2HB       GLN  13  -4.864  -7.632   0.411
  107    HB3  GLN  13          3HB       GLN  13  -5.547  -6.738  -0.943
  108    HG2  GLN  13          2HG       GLN  13  -4.121  -8.053  -2.498
  109    HG3  GLN  13          3HG       GLN  13  -3.489  -8.963  -1.126
  110   HE21  GLN  13          1HE2      GLN  13  -6.881  -8.030  -1.524
  111   HE22  GLN  13          2HE2      GLN  13  -7.475  -9.633  -1.750
  112    H    VAL  14           H        VAL  14  -4.799  -4.388  -1.711
  113    HA   VAL  14           HA       VAL  14  -3.881  -4.532  -4.364
  114    HB   VAL  14           HB       VAL  14  -5.043  -2.129  -2.844
  115   HG11  VAL  14          1HG1      VAL  14  -5.626  -1.166  -5.050
  116   HG12  VAL  14          2HG1      VAL  14  -4.761  -2.480  -5.852
  117   HG13  VAL  14          3HG1      VAL  14  -3.878  -1.327  -4.851
  118   HG21  VAL  14          1HG2      VAL  14  -7.198  -2.729  -3.892
  119   HG22  VAL  14          2HG2      VAL  14  -6.575  -4.071  -2.933
  120   HG23  VAL  14          3HG2      VAL  14  -6.436  -4.115  -4.688
  121    H    ALA  15           H        ALA  15  -2.779  -2.628  -1.611
  122    HA   ALA  15           HA       ALA  15  -0.897  -0.955  -2.897
  123    HB1  ALA  15          1HB       ALA  15  -0.155  -0.417  -0.611
  124    HB2  ALA  15          2HB       ALA  15  -1.059  -1.800   0.020
  125    HB3  ALA  15          3HB       ALA  15  -1.916  -0.438  -0.708
  126    H    LYS  16           H        LYS  16  -0.507  -3.996  -1.042
  127    HA   LYS  16           HA       LYS  16   2.335  -4.058  -1.146
  128    HB2  LYS  16          2HB       LYS  16   2.227  -6.220  -0.120
  129    HB3  LYS  16          3HB       LYS  16   0.925  -5.266   0.572
  130    HG2  LYS  16          2HG       LYS  16  -0.689  -6.432  -0.895
  131    HG3  LYS  16          3HG       LYS  16   0.624  -7.409  -1.554
  132    HD2  LYS  16          2HD       LYS  16  -0.347  -7.386   1.337
  133    HD3  LYS  16          3HD       LYS  16  -0.604  -8.667   0.151
  134    HE2  LYS  16          2HE       LYS  16   1.801  -9.141   0.095
  135    HE3  LYS  16          3HE       LYS  16   2.118  -7.800   1.200
  136    HZ1  LYS  16          1HZ       LYS  16   0.601 -10.280   1.820
  137    HZ2  LYS  16          2HZ       LYS  16   0.736  -8.959   2.862
  138    HZ3  LYS  16          3HZ       LYS  16   2.117  -9.829   2.428
  139    H    GLU  17           H        GLU  17  -0.163  -5.257  -3.308
  140    HA   GLU  17           HA       GLU  17   1.331  -7.004  -4.932
  141    HB2  GLU  17          2HB       GLU  17  -1.105  -5.273  -5.470
  142    HB3  GLU  17          3HB       GLU  17  -0.398  -6.256  -6.754
  143    HG2  GLU  17          2HG       GLU  17  -0.845  -8.288  -5.563
  144    HG3  GLU  17          3HG       GLU  17  -1.301  -7.399  -4.105
  145    H    LYS  18           H        LYS  18   0.896  -3.474  -5.124
  146    HA   LYS  18           HA       LYS  18   2.344  -3.126  -7.576
  147    HB2  LYS  18          2HB       LYS  18   1.889  -0.960  -5.490
  148    HB3  LYS  18          3HB       LYS  18   2.077  -0.760  -7.233
  149    HG2  LYS  18          2HG       LYS  18  -0.285  -1.939  -5.749
  150    HG3  LYS  18          3HG       LYS  18  -0.242  -0.410  -6.628
  151    HD2  LYS  18          2HD       LYS  18  -0.110  -1.567  -8.761
  152    HD3  LYS  18          3HD       LYS  18   0.155  -3.120  -7.968
  153    HE2  LYS  18          2HE       LYS  18  -2.145  -2.927  -6.966
  154    HE3  LYS  18          3HE       LYS  18  -2.398  -1.482  -7.949
  155    HZ1  LYS  18          1HZ       LYS  18  -2.094  -2.808  -9.936
  156    HZ2  LYS  18          2HZ       LYS  18  -3.309  -3.491  -8.984
  157    HZ3  LYS  18          3HZ       LYS  18  -1.770  -4.186  -9.009
  158    H    LEU  19           H        LEU  19   3.176  -3.246  -4.199
  159    HA   LEU  19           HA       LEU  19   5.908  -2.396  -4.458
  160    HB2  LEU  19          2HB       LEU  19   4.528  -3.987  -2.267
  161    HB3  LEU  19          3HB       LEU  19   6.128  -3.273  -2.144
  162    HG   LEU  19           HG       LEU  19   3.445  -1.867  -2.231
  163   HD11  LEU  19          1HD1      LEU  19   4.215  -0.807  -0.174
  164   HD12  LEU  19          2HD1      LEU  19   5.742  -1.689  -0.272
  165   HD13  LEU  19          3HD1      LEU  19   4.227  -2.566  -0.039
  166   HD21  LEU  19          1HD2      LEU  19   4.800  -0.644  -3.815
  167   HD22  LEU  19          2HD2      LEU  19   6.143  -0.556  -2.671
  168   HD23  LEU  19          3HD2      LEU  19   4.633   0.300  -2.335
  169    H    LEU  20           H        LEU  20   4.227  -5.486  -4.687
  170    HA   LEU  20           HA       LEU  20   6.567  -7.141  -4.818
  171    HB2  LEU  20          2HB       LEU  20   3.682  -7.649  -5.639
  172    HB3  LEU  20          3HB       LEU  20   4.935  -8.881  -5.720
  173    HG   LEU  20           HG       LEU  20   3.982  -7.511  -3.172
  174   HD11  LEU  20          1HD1      LEU  20   3.427 -10.331  -4.132
  175   HD12  LEU  20          2HD1      LEU  20   2.269  -8.997  -4.079
  176   HD13  LEU  20          3HD1      LEU  20   2.942  -9.635  -2.581
  177   HD21  LEU  20          1HD2      LEU  20   5.344  -9.143  -1.973
  178   HD22  LEU  20          2HD2      LEU  20   6.340  -8.144  -3.025
  179   HD23  LEU  20          3HD2      LEU  20   5.945  -9.800  -3.497
  180    H    GLU  21           H        GLU  21   4.848  -5.184  -7.139
  181    HA   GLU  21           HA       GLU  21   5.847  -6.342  -9.545
  182    HB2  GLU  21          2HB       GLU  21   5.135  -3.413  -9.050
  183    HB3  GLU  21          3HB       GLU  21   5.268  -4.198 -10.623
  184    HG2  GLU  21          2HG       GLU  21   3.180  -4.752  -8.493
  185    HG3  GLU  21          3HG       GLU  21   2.932  -3.873  -9.995
  186    H    GLN  22           H        GLN  22   7.092  -4.012  -7.260
  187    HA   GLN  22           HA       GLN  22   9.456  -3.264  -8.755
  188    HB2  GLN  22          2HB       GLN  22   8.613  -2.739  -5.872
  189    HB3  GLN  22          3HB       GLN  22   9.984  -1.974  -6.677
  190    HG2  GLN  22          2HG       GLN  22   8.524  -0.785  -8.187
  191    HG3  GLN  22          3HG       GLN  22   7.117  -1.694  -7.630
  192   HE21  GLN  22          1HE2      GLN  22   6.192  -1.175  -5.668
  193   HE22  GLN  22          2HE2      GLN  22   6.582   0.250  -4.782
  194    H    SER  23           H        SER  23   8.653  -5.373  -6.019
  195    HA   SER  23           HA       SER  23  11.163  -6.818  -6.179
  196    HB2  SER  23          2HB       SER  23  11.665  -4.791  -4.728
  197    HB3  SER  23          3HB       SER  23  10.443  -5.354  -3.596
  198    HG   SER  23           HG       SER  23  11.965  -6.507  -2.759
  199    HA   PRO  24           HA       PRO  24   7.586  -9.528  -4.892
  200    HB2  PRO  24          2HB       PRO  24   8.207 -11.658  -6.495
  201    HB3  PRO  24          3HB       PRO  24   7.349 -10.226  -7.112
  202    HG2  PRO  24          2HG       PRO  24  10.272 -10.905  -7.330
  203    HG3  PRO  24          3HG       PRO  24   9.165 -10.292  -8.581
  204    HD2  PRO  24          2HD       PRO  24  10.883  -8.655  -7.234
  205    HD3  PRO  24          3HD       PRO  24   9.304  -8.098  -7.828
  206    H    ASN  25           H        ASN  25  11.032 -10.050  -5.025
  207    HA   ASN  25           HA       ASN  25  11.162 -12.580  -3.720
  208    HB2  ASN  25          2HB       ASN  25  12.926 -11.726  -5.233
  209    HB3  ASN  25          3HB       ASN  25  13.303 -10.443  -4.091
  210   HD21  ASN  25          1HD2      ASN  25  13.438 -13.900  -4.672
  211   HD22  ASN  25          2HD2      ASN  25  14.664 -14.242  -3.498
  212    H    SER  26           H        SER  26  10.966  -9.311  -2.592
  213    HA   SER  26           HA       SER  26  11.737  -9.863   0.157
  214    HB2  SER  26          2HB       SER  26  11.039  -7.443   0.478
  215    HB3  SER  26          3HB       SER  26  12.292  -7.682  -0.741
  216    HG   SER  26           HG       SER  26   9.600  -7.676  -1.559
  217    H    LYS  27           H        LYS  27  10.362 -10.225   1.856
  218    HA   LYS  27           HA       LYS  27   7.542 -10.723   1.369
  219    HB2  LYS  27          2HB       LYS  27   8.905 -12.215   2.870
  220    HB3  LYS  27          3HB       LYS  27   9.117 -10.879   3.982
  221    HG2  LYS  27          2HG       LYS  27   7.361 -11.867   5.069
  222    HG3  LYS  27          3HG       LYS  27   6.397 -10.935   3.928
  223    HD2  LYS  27          2HD       LYS  27   7.165 -13.874   3.704
  224    HD3  LYS  27          3HD       LYS  27   5.566 -13.233   4.076
  225    HE2  LYS  27          2HE       LYS  27   5.555 -12.185   1.774
  226    HE3  LYS  27          3HE       LYS  27   7.056 -13.048   1.439
  227    HZ1  LYS  27          1HZ       LYS  27   5.926 -15.130   1.738
  228    HZ2  LYS  27          2HZ       LYS  27   5.059 -14.209   0.622
  229    HZ3  LYS  27          3HZ       LYS  27   4.499 -14.358   2.207
  230    H    VAL  28           H        VAL  28   6.146  -9.089   1.372
  231    HA   VAL  28           HA       VAL  28   6.827  -6.502   2.603
  232    HB   VAL  28           HB       VAL  28   4.612  -7.140   0.584
  233   HG11  VAL  28          1HG1      VAL  28   4.562  -4.701   0.176
  234   HG12  VAL  28          2HG1      VAL  28   5.789  -4.461   1.422
  235   HG13  VAL  28          3HG1      VAL  28   4.195  -5.077   1.863
  236   HG21  VAL  28          1HG2      VAL  28   6.800  -7.645  -0.413
  237   HG22  VAL  28          2HG2      VAL  28   7.399  -6.048   0.036
  238   HG23  VAL  28          3HG2      VAL  28   6.107  -6.199  -1.159
  239    H    GLN  29           H        GLN  29   5.934  -6.061   4.502
  240    HA   GLN  29           HA       GLN  29   3.279  -7.133   5.283
  241    HB2  GLN  29          2HB       GLN  29   5.514  -5.960   7.008
  242    HB3  GLN  29          3HB       GLN  29   3.957  -6.528   7.618
  243    HG2  GLN  29          2HG       GLN  29   6.116  -8.209   6.307
  244    HG3  GLN  29          3HG       GLN  29   5.678  -8.201   8.016
  245   HE21  GLN  29          1HE2      GLN  29   5.686 -10.389   6.009
  246   HE22  GLN  29          2HE2      GLN  29   4.093 -11.057   6.028
  247    H    VAL  30           H        VAL  30   2.071  -5.518   6.723
  248    HA   VAL  30           HA       VAL  30   2.101  -2.824   5.505
  249    HB   VAL  30           HB       VAL  30  -0.071  -4.192   7.169
  250   HG11  VAL  30          1HG1      VAL  30  -0.153  -1.573   5.626
  251   HG12  VAL  30          2HG1      VAL  30  -0.179  -1.754   7.381
  252   HG13  VAL  30          3HG1      VAL  30  -1.533  -2.339   6.415
  253   HG21  VAL  30          1HG2      VAL  30   0.261  -5.309   4.983
  254   HG22  VAL  30          2HG2      VAL  30   0.029  -3.766   4.155
  255   HG23  VAL  30          3HG2      VAL  30  -1.301  -4.490   5.062
  256    H    ARG  31           H        ARG  31   2.865  -1.176   6.713
  257    HA   ARG  31           HA       ARG  31   3.747  -1.696   9.468
  258    HB2  ARG  31          2HB       ARG  31   5.343  -0.803   7.729
  259    HB3  ARG  31          3HB       ARG  31   4.378   0.663   7.629
  260    HG2  ARG  31          2HG       ARG  31   6.290   1.117   9.013
  261    HG3  ARG  31          3HG       ARG  31   4.863   1.093  10.053
  262    HD2  ARG  31          2HD       ARG  31   5.437  -1.265  10.708
  263    HD3  ARG  31          3HD       ARG  31   6.913  -1.137   9.740
  264    HE   ARG  31           HE       ARG  31   6.662   0.943  11.713
  265   HH11  ARG  31          1HH1      ARG  31   7.773  -2.387  11.239
  266   HH12  ARG  31          2HH1      ARG  31   8.853  -2.326  12.594
  267   HH21  ARG  31          1HH2      ARG  31   8.091   0.983  13.457
  268   HH22  ARG  31          2HH2      ARG  31   9.031  -0.418  13.843
  269    H    ARG  32           H        ARG  32   1.859   0.689   7.631
  270    HA   ARG  32           HA       ARG  32   0.333   1.551   9.957
  271    HB2  ARG  32          2HB       ARG  32   2.658   2.960   9.311
  272    HB3  ARG  32          3HB       ARG  32   1.468   3.841   8.373
  273    HG2  ARG  32          2HG       ARG  32   1.355   3.383  11.375
  274    HG3  ARG  32          3HG       ARG  32   1.934   4.849  10.586
  275    HD2  ARG  32          2HD       ARG  32  -0.332   5.222   9.642
  276    HD3  ARG  32          3HD       ARG  32  -0.899   3.750  10.443
  277    HE   ARG  32           HE       ARG  32   0.283   5.887  12.082
  278   HH11  ARG  32          1HH1      ARG  32  -2.648   4.133  11.143
  279   HH12  ARG  32          2HH1      ARG  32  -3.568   4.749  12.482
  280   HH21  ARG  32          1HH2      ARG  32  -0.954   6.698  13.789
  281   HH22  ARG  32          2HH2      ARG  32  -2.609   6.203  13.981
  282    H    VAL  33           H        VAL  33  -1.719   2.305   9.305
  283    HA   VAL  33           HA       VAL  33  -2.261   2.691   6.404
  284    HB   VAL  33           HB       VAL  33  -4.129   1.413   8.477
  285   HG11  VAL  33          1HG1      VAL  33  -4.703   2.021   5.549
  286   HG12  VAL  33          2HG1      VAL  33  -5.436   2.825   6.939
  287   HG13  VAL  33          3HG1      VAL  33  -5.761   1.118   6.638
  288   HG21  VAL  33          1HG2      VAL  33  -3.998  -0.611   7.065
  289   HG22  VAL  33          2HG2      VAL  33  -2.404  -0.141   7.658
  290   HG23  VAL  33          3HG2      VAL  33  -2.861   0.207   5.989
  291    H    GLN  34           H        GLN  34  -3.130   4.642   5.925
  292    HA   GLN  34           HA       GLN  34  -4.285   6.344   8.069
  293    HB2  GLN  34          2HB       GLN  34  -2.510   7.105   5.701
  294    HB3  GLN  34          3HB       GLN  34  -3.434   8.297   6.612
  295    HG2  GLN  34          2HG       GLN  34  -1.310   6.474   7.805
  296    HG3  GLN  34          3HG       GLN  34  -1.052   8.152   7.315
  297   HE21  GLN  34          1HE2      GLN  34  -2.661   6.065   9.630
  298   HE22  GLN  34          2HE2      GLN  34  -3.004   7.293  10.793
  299    H    LYS  35           H        LYS  35  -6.417   6.343   7.765
  300    HA   LYS  35           HA       LYS  35  -7.591   6.123   5.071
  301    HB2  LYS  35          2HB       LYS  35  -8.212   4.675   7.219
  302    HB3  LYS  35          3HB       LYS  35  -9.204   6.059   7.645
  303    HG2  LYS  35          2HG       LYS  35  -9.417   4.426   5.105
  304    HG3  LYS  35          3HG       LYS  35 -10.450   4.258   6.513
  305    HD2  LYS  35          2HD       LYS  35 -11.368   6.533   6.099
  306    HD3  LYS  35          3HD       LYS  35 -10.318   6.693   4.683
  307    HE2  LYS  35          2HE       LYS  35 -11.438   4.777   3.613
  308    HE3  LYS  35          3HE       LYS  35 -12.458   4.551   5.035
  309    HZ1  LYS  35          1HZ       LYS  35 -13.454   6.707   4.613
  310    HZ2  LYS  35          2HZ       LYS  35 -13.613   5.705   3.257
  311    HZ3  LYS  35          3HZ       LYS  35 -12.457   6.940   3.273
  312    H    GLN  36           H        GLN  36  -7.984   8.053   4.125
  313    HA   GLN  36           HA       GLN  36  -8.910  10.369   5.742
  314    HB2  GLN  36          2HB       GLN  36  -7.020  10.437   3.338
  315    HB3  GLN  36          3HB       GLN  36  -7.591  11.840   4.238
  316    HG2  GLN  36          2HG       GLN  36  -6.307  11.198   6.182
  317    HG3  GLN  36          3HG       GLN  36  -5.901   9.640   5.457
  318   HE21  GLN  36          1HE2      GLN  36  -5.280  13.095   5.353
  319   HE22  GLN  36          2HE2      GLN  36  -3.821  12.992   4.434
  320    H    GLY  37           H        GLY  37 -11.075   9.737   5.179
  321    HA2  GLY  37          2HA       GLY  37 -13.042  10.114   4.092
  322    HA3  GLY  37          3HA       GLY  37 -12.182  11.290   3.129
  323    H    ASN  38           H        ASN  38 -11.079  10.510   1.204
  324    HA   ASN  38           HA       ASN  38 -12.600   8.386  -0.178
  325    HB2  ASN  38          2HB       ASN  38 -11.064  10.783  -1.288
  326    HB3  ASN  38          3HB       ASN  38 -11.859   9.563  -2.282
  327   HD21  ASN  38          1HD2      ASN  38 -13.291  11.022  -3.232
  328   HD22  ASN  38          2HD2      ASN  38 -14.587  11.775  -2.373
  329    H    THR  39           H        THR  39  -9.291   9.646   0.309
  330    HA   THR  39           HA       THR  39  -8.121   7.293  -1.040
  331    HB   THR  39           HB       THR  39  -6.648   9.798  -0.124
  332    HG1  THR  39           HG1      THR  39  -7.434   9.379  -2.799
  333   HG21  THR  39          1HG2      THR  39  -5.933   7.690  -2.208
  334   HG22  THR  39          2HG2      THR  39  -5.180   7.865  -0.618
  335   HG23  THR  39          3HG2      THR  39  -4.986   9.127  -1.840
  336    H    ILE  40           H        ILE  40  -7.040   5.765   0.079
  337    HA   ILE  40           HA       ILE  40  -6.377   6.185   2.937
  338    HB   ILE  40           HB       ILE  40  -6.700   3.511   1.488
  339   HG12  ILE  40          2HG1      ILE  40  -8.683   4.965   3.302
  340   HG13  ILE  40          3HG1      ILE  40  -8.880   4.644   1.583
  341   HG21  ILE  40          1HG2      ILE  40  -6.446   4.125   4.458
  342   HG22  ILE  40          2HG2      ILE  40  -5.191   3.422   3.438
  343   HG23  ILE  40          3HG2      ILE  40  -6.676   2.525   3.749
  344   HD11  ILE  40          1HD1      ILE  40  -8.777   2.542   3.753
  345   HD12  ILE  40          2HD1      ILE  40  -9.013   2.258   2.027
  346   HD13  ILE  40          3HD1      ILE  40 -10.222   3.148   2.944
  347    H    ARG  41           H        ARG  41  -4.267   6.802   3.065
  348    HA   ARG  41           HA       ARG  41  -2.207   5.809   1.246
  349    HB2  ARG  41          2HB       ARG  41  -1.874   7.627   3.681
  350    HB3  ARG  41          3HB       ARG  41  -0.691   7.347   2.401
  351    HG2  ARG  41          2HG       ARG  41  -2.367   8.407   0.797
  352    HG3  ARG  41          3HG       ARG  41  -3.308   8.867   2.222
  353    HD2  ARG  41          2HD       ARG  41  -0.458   9.716   1.569
  354    HD3  ARG  41          3HD       ARG  41  -1.899  10.734   1.509
  355    HE   ARG  41           HE       ARG  41  -2.009  10.124   4.034
  356   HH11  ARG  41          1HH1      ARG  41   0.990  10.781   2.255
  357   HH12  ARG  41          2HH1      ARG  41   1.808  11.373   3.666
  358   HH21  ARG  41          1HH2      ARG  41  -0.903  10.950   5.824
  359   HH22  ARG  41          2HH2      ARG  41   0.744  11.467   5.673
  360    H    VAL  42           H        VAL  42  -1.942   3.648   1.714
  361    HA   VAL  42           HA       VAL  42  -1.396   2.743   4.450
  362    HB   VAL  42           HB       VAL  42  -1.472   1.119   1.855
  363   HG11  VAL  42          1HG1      VAL  42  -1.421   0.156   4.744
  364   HG12  VAL  42          2HG1      VAL  42  -0.093   0.028   3.592
  365   HG13  VAL  42          3HG1      VAL  42  -1.584  -0.873   3.317
  366   HG21  VAL  42          1HG2      VAL  42  -3.580   1.469   4.016
  367   HG22  VAL  42          2HG2      VAL  42  -3.676   0.321   2.675
  368   HG23  VAL  42          3HG2      VAL  42  -3.666   2.056   2.348
  369    H    GLU  43           H        GLU  43   0.585   2.963   5.184
  370    HA   GLU  43           HA       GLU  43   2.979   2.979   3.493
  371    HB2  GLU  43          2HB       GLU  43   2.549   3.414   6.483
  372    HB3  GLU  43          3HB       GLU  43   4.101   3.585   5.666
  373    HG2  GLU  43          2HG       GLU  43   3.124   5.405   4.263
  374    HG3  GLU  43          3HG       GLU  43   1.593   5.220   5.119
  375    H    LEU  44           H        LEU  44   3.892   1.021   3.054
  376    HA   LEU  44           HA       LEU  44   3.508  -1.223   4.964
  377    HB2  LEU  44          2HB       LEU  44   4.131  -1.423   1.995
  378    HB3  LEU  44          3HB       LEU  44   3.762  -2.742   3.088
  379    HG   LEU  44           HG       LEU  44   1.452  -1.369   3.375
  380   HD11  LEU  44          1HD1      LEU  44   2.282  -0.626   0.564
  381   HD12  LEU  44          2HD1      LEU  44   2.102   0.484   1.925
  382   HD13  LEU  44          3HD1      LEU  44   0.693  -0.366   1.294
  383   HD21  LEU  44          1HD2      LEU  44   1.583  -3.700   2.679
  384   HD22  LEU  44          2HD2      LEU  44   1.996  -3.212   1.034
  385   HD23  LEU  44          3HD2      LEU  44   0.407  -2.821   1.702
  386    H    GLU  45           H        GLU  45   5.300  -2.764   5.144
  387    HA   GLU  45           HA       GLU  45   7.944  -1.467   4.890
  388    HB2  GLU  45          2HB       GLU  45   7.178  -2.096   7.189
  389    HB3  GLU  45          3HB       GLU  45   7.088  -3.778   6.682
  390    HG2  GLU  45          2HG       GLU  45   9.525  -3.756   6.215
  391    HG3  GLU  45          3HG       GLU  45   9.611  -2.085   6.771
  392    H    LEU  46           H        LEU  46   8.789  -2.069   3.013
  393    HA   LEU  46           HA       LEU  46   8.874  -4.916   2.179
  394    HB2  LEU  46          2HB       LEU  46   7.804  -3.318   0.579
  395    HB3  LEU  46          3HB       LEU  46   9.265  -2.360   0.549
  396    HG   LEU  46           HG       LEU  46   9.202  -5.242  -0.458
  397   HD11  LEU  46          1HD1      LEU  46   7.554  -3.987  -1.742
  398   HD12  LEU  46          2HD1      LEU  46   8.953  -4.370  -2.740
  399   HD13  LEU  46          3HD1      LEU  46   8.744  -2.733  -2.101
  400   HD21  LEU  46          1HD2      LEU  46  11.164  -4.590  -1.788
  401   HD22  LEU  46          2HD2      LEU  46  11.460  -4.384  -0.066
  402   HD23  LEU  46          3HD2      LEU  46  11.124  -2.974  -1.074
  403    H    ARG  47           H        ARG  47  10.840  -5.865   2.431
  404    HA   ARG  47           HA       ARG  47  13.181  -4.155   3.060
  405    HB2  ARG  47          2HB       ARG  47  12.564  -7.074   3.704
  406    HB3  ARG  47          3HB       ARG  47  14.098  -6.289   4.083
  407    HG2  ARG  47          2HG       ARG  47  13.129  -4.897   5.735
  408    HG3  ARG  47          3HG       ARG  47  11.494  -5.129   5.115
  409    HD2  ARG  47          2HD       ARG  47  13.145  -7.297   6.468
  410    HD3  ARG  47          3HD       ARG  47  11.929  -6.307   7.283
  411    HE   ARG  47           HE       ARG  47  10.367  -7.244   5.472
  412   HH11  ARG  47          1HH1      ARG  47  12.994  -9.151   6.878
  413   HH12  ARG  47          2HH1      ARG  47  12.186 -10.659   6.593
  414   HH21  ARG  47          1HH2      ARG  47   9.353  -9.212   5.135
  415   HH22  ARG  47          2HH2      ARG  47  10.133 -10.692   5.605
  416    H    THR  48           H        THR  48  13.971  -3.653   1.083
  417    HA   THR  48           HA       THR  48  14.090  -5.393  -1.178
  418    HB   THR  48           HB       THR  48  15.533  -2.739  -0.705
  419    HG1  THR  48           HG1      THR  48  13.729  -1.788  -1.350
  420   HG21  THR  48          1HG2      THR  48  15.608  -2.567  -3.182
  421   HG22  THR  48          2HG2      THR  48  14.910  -4.184  -3.317
  422   HG23  THR  48          3HG2      THR  48  16.517  -3.967  -2.617
  423    H    ASN  49           H        ASN  49  15.319  -7.186  -0.945
  424    HA   ASN  49           HA       ASN  49  17.071  -8.599  -0.771
  425    HB2  ASN  49          2HB       ASN  49  18.667  -6.071  -1.377
  426    HB3  ASN  49          3HB       ASN  49  19.351  -7.694  -1.392
  427   HD21  ASN  49          1HD2      ASN  49  18.716  -9.152  -3.035
  428   HD22  ASN  49          2HD2      ASN  49  17.973  -8.604  -4.496
  429    H    GLY  50           H        GLY  50  16.065  -7.236   1.653
  430    HA2  GLY  50          2HA       GLY  50  16.562  -7.849   3.887
  431    HA3  GLY  50          3HA       GLY  50  18.270  -7.923   3.491
  432    H    LYS  51           H        LYS  51  17.086  -5.090   2.134
  433    HA   LYS  51           HA       LYS  51  17.814  -3.447   4.493
  434    HB2  LYS  51          2HB       LYS  51  17.564  -2.653   1.549
  435    HB3  LYS  51          3HB       LYS  51  18.063  -1.577   2.851
  436    HG2  LYS  51          2HG       LYS  51  19.571  -4.017   1.850
  437    HG3  LYS  51          3HG       LYS  51  19.985  -2.330   1.530
  438    HD2  LYS  51          2HD       LYS  51  20.011  -3.697   4.259
  439    HD3  LYS  51          3HD       LYS  51  21.429  -3.307   3.284
  440    HE2  LYS  51          2HE       LYS  51  21.032  -0.926   3.553
  441    HE3  LYS  51          3HE       LYS  51  19.493  -1.224   4.362
  442    HZ1  LYS  51          1HZ       LYS  51  20.751  -2.357   6.143
  443    HZ2  LYS  51          2HZ       LYS  51  21.150  -0.720   5.995
  444    HZ3  LYS  51          3HZ       LYS  51  22.193  -1.904   5.393
  445    H    LYS  52           H        LYS  52  16.197  -2.373   5.580
  446    HA   LYS  52           HA       LYS  52  13.449  -2.748   4.756
  447    HB2  LYS  52          2HB       LYS  52  13.879  -3.027   7.118
  448    HB3  LYS  52          3HB       LYS  52  14.710  -1.478   7.221
  449    HG2  LYS  52          2HG       LYS  52  12.606  -0.279   6.858
  450    HG3  LYS  52          3HG       LYS  52  11.737  -1.802   6.656
  451    HD2  LYS  52          2HD       LYS  52  12.038  -2.364   8.991
  452    HD3  LYS  52          3HD       LYS  52  13.184  -1.037   9.226
  453    HE2  LYS  52          2HE       LYS  52  11.440   0.609   8.954
  454    HE3  LYS  52          3HE       LYS  52  10.277  -0.618   8.447
  455    HZ1  LYS  52          1HZ       LYS  52  11.528  -0.538  11.136
  456    HZ2  LYS  52          2HZ       LYS  52  10.255  -1.532  10.628
  457    HZ3  LYS  52          3HZ       LYS  52  10.020   0.139  10.772
  458    H    GLU  53           H        GLU  53  12.441  -1.427   3.452
  459    HA   GLU  53           HA       GLU  53  12.722   1.506   3.642
  460    HB2  GLU  53          2HB       GLU  53  12.479  -0.097   1.044
  461    HB3  GLU  53          3HB       GLU  53  12.465   1.664   1.168
  462    HG2  GLU  53          2HG       GLU  53  14.779   1.603   2.058
  463    HG3  GLU  53          3HG       GLU  53  14.789  -0.151   1.902
  464    H    ASN  54           H        ASN  54  10.759   2.326   4.163
  465    HA   ASN  54           HA       ASN  54   8.311   0.777   3.774
  466    HB2  ASN  54          2HB       ASN  54   8.819   3.428   5.202
  467    HB3  ASN  54          3HB       ASN  54   7.233   2.666   5.086
  468   HD21  ASN  54          1HD2      ASN  54   6.895   0.663   6.172
  469   HD22  ASN  54          2HD2      ASN  54   7.892   0.190   7.500
  470    H    TYR  55           H        TYR  55   6.664   1.329   2.393
  471    HA   TYR  55           HA       TYR  55   7.104   3.580   0.505
  472    HB2  TYR  55          2HB       TYR  55   5.837   0.860  -0.048
  473    HB3  TYR  55          3HB       TYR  55   5.876   2.195  -1.189
  474    HD1  TYR  55           HD1      TYR  55   7.572   2.190  -2.813
  475    HD2  TYR  55           HD2      TYR  55   8.261   0.058   0.824
  476    HE1  TYR  55           HE1      TYR  55   9.666   1.271  -3.737
  477    HE2  TYR  55           HE2      TYR  55  10.344  -0.847  -0.095
  478    HH   TYR  55           HH       TYR  55  11.408  -1.279  -2.160
  479    H    THR  56           H        THR  56   5.581   5.093   0.685
  480    HA   THR  56           HA       THR  56   3.000   4.586   1.960
  481    HB   THR  56           HB       THR  56   4.067   7.210   0.811
  482    HG1  THR  56           HG1      THR  56   4.313   6.067   3.401
  483   HG21  THR  56          1HG2      THR  56   1.614   7.241   1.149
  484   HG22  THR  56          2HG2      THR  56   2.412   8.276   2.330
  485   HG23  THR  56          3HG2      THR  56   1.834   6.685   2.820
  486    H    VAL  57           H        VAL  57   1.655   3.555   0.640
  487    HA   VAL  57           HA       VAL  57   1.395   4.232  -2.222
  488    HB   VAL  57           HB       VAL  57   0.272   1.828  -0.697
  489   HG11  VAL  57          1HG1      VAL  57  -0.173   0.880  -2.957
  490   HG12  VAL  57          2HG1      VAL  57   0.339   2.404  -3.685
  491   HG13  VAL  57          3HG1      VAL  57  -1.091   2.356  -2.653
  492   HG21  VAL  57          1HG2      VAL  57   2.028   0.485  -1.806
  493   HG22  VAL  57          2HG2      VAL  57   2.726   1.721  -0.758
  494   HG23  VAL  57          3HG2      VAL  57   2.715   1.955  -2.508
  495    H    GLU  58           H        GLU  58  -0.182   5.678  -2.638
  496    HA   GLU  58           HA       GLU  58  -2.443   6.075  -0.813
  497    HB2  GLU  58          2HB       GLU  58  -1.795   7.577  -3.391
  498    HB3  GLU  58          3HB       GLU  58  -2.904   8.082  -2.118
  499    HG2  GLU  58          2HG       GLU  58  -0.915   8.239  -0.565
  500    HG3  GLU  58          3HG       GLU  58   0.124   7.914  -1.952
  501    H    VAL  59           H        VAL  59  -3.910   4.437  -1.107
  502    HA   VAL  59           HA       VAL  59  -4.871   3.772  -3.830
  503    HB   VAL  59           HB       VAL  59  -5.477   2.270  -1.248
  504   HG11  VAL  59          1HG1      VAL  59  -6.109   0.400  -2.743
  505   HG12  VAL  59          2HG1      VAL  59  -5.794   1.424  -4.147
  506   HG13  VAL  59          3HG1      VAL  59  -7.092   1.839  -3.026
  507   HG21  VAL  59          1HG2      VAL  59  -3.275   1.613  -3.246
  508   HG22  VAL  59          2HG2      VAL  59  -3.761   0.604  -1.876
  509   HG23  VAL  59          3HG2      VAL  59  -3.045   2.192  -1.591
  510    H    GLU  60           H        GLU  60  -6.588   4.929  -4.407
  511    HA   GLU  60           HA       GLU  60  -8.354   6.221  -2.443
  512    HB2  GLU  60          2HB       GLU  60  -7.090   7.658  -3.978
  513    HB3  GLU  60          3HB       GLU  60  -7.739   6.797  -5.366
  514    HG2  GLU  60          2HG       GLU  60  -9.989   7.661  -4.869
  515    HG3  GLU  60          3HG       GLU  60  -9.360   8.510  -3.448
  516    H    ARG  61           H        ARG  61 -10.579   6.040  -2.574
  517    HA   ARG  61           HA       ARG  61 -11.767   3.740  -3.782
  518    HB2  ARG  61          2HB       ARG  61 -12.626   4.691  -1.655
  519    HB3  ARG  61          3HB       ARG  61 -13.063   6.183  -2.478
  520    HG2  ARG  61          2HG       ARG  61 -15.075   4.942  -2.192
  521    HG3  ARG  61          3HG       ARG  61 -14.668   4.845  -3.900
  522    HD2  ARG  61          2HD       ARG  61 -15.296   2.652  -3.394
  523    HD3  ARG  61          3HD       ARG  61 -13.538   2.571  -3.259
  524    HE   ARG  61           HE       ARG  61 -14.108   3.040  -0.743
  525   HH11  ARG  61          1HH1      ARG  61 -15.843   0.864  -2.933
  526   HH12  ARG  61          2HH1      ARG  61 -16.362  -0.187  -1.656
  527   HH21  ARG  61          1HH2      ARG  61 -14.817   1.618   0.906
  528   HH22  ARG  61          2HH2      ARG  61 -15.780   0.238   0.498
  529    H    GLN  62           H        GLN  62 -11.855   3.686  -5.951
  530    HA   GLN  62           HA       GLN  62 -12.769   5.997  -7.525
  531    HB2  GLN  62          2HB       GLN  62 -10.687   4.648  -8.197
  532    HB3  GLN  62          3HB       GLN  62 -11.766   3.313  -8.582
  533    HG2  GLN  62          2HG       GLN  62 -11.171   4.592 -10.600
  534    HG3  GLN  62          3HG       GLN  62 -12.902   4.674 -10.269
  535   HE21  GLN  62          1HE2      GLN  62 -13.292   6.598 -11.326
  536   HE22  GLN  62          2HE2      GLN  62 -12.652   8.123 -10.818
  537    H    GLY  63           H        GLY  63 -14.918   5.974  -6.884
  538    HA2  GLY  63          2HA       GLY  63 -17.146   5.506  -7.018
  539    HA3  GLY  63          3HA       GLY  63 -16.784   4.313  -8.257
  540    H    ASN  64           H        ASN  64 -16.742   2.196  -7.718
  541    HA   ASN  64           HA       ASN  64 -17.394   1.356  -4.961
  542    HB2  ASN  64          2HB       ASN  64 -17.706  -0.075  -7.646
  543    HB3  ASN  64          3HB       ASN  64 -18.039  -0.834  -6.090
  544   HD21  ASN  64          1HD2      ASN  64 -19.782  -0.141  -8.423
  545   HD22  ASN  64          2HD2      ASN  64 -21.102   0.736  -7.736
  546    H    THR  65           H        THR  65 -15.025   1.043  -7.519
  547    HA   THR  65           HA       THR  65 -13.494  -1.080  -6.214
  548    HB   THR  65           HB       THR  65 -11.935  -0.711  -8.220
  549    HG1  THR  65           HG1      THR  65 -12.474   1.369  -8.831
  550   HG21  THR  65          1HG2      THR  65 -14.828  -1.389  -8.851
  551   HG22  THR  65          2HG2      THR  65 -13.605  -2.514  -8.259
  552   HG23  THR  65          3HG2      THR  65 -13.430  -1.792  -9.859
  553    H    TRP  66           H        TRP  66 -11.011  -0.650  -6.238
  554    HA   TRP  66           HA       TRP  66 -10.353   2.032  -5.164
  555    HB2  TRP  66          2HB       TRP  66  -9.033  -0.688  -4.675
  556    HB3  TRP  66          3HB       TRP  66  -8.423   0.845  -4.052
  557    HD1  TRP  66           HD1      TRP  66 -11.092  -1.788  -3.368
  558    HE1  TRP  66           HE1      TRP  66 -12.384  -1.161  -1.235
  559    HE3  TRP  66           HE3      TRP  66  -9.167   2.881  -2.580
  560    HZ2  TRP  66           HZ2      TRP  66 -12.578   1.023   0.525
  561    HZ3  TRP  66           HZ3      TRP  66  -9.962   4.177  -0.644
  562    HH2  TRP  66           HH2      TRP  66 -11.636   3.258   0.881
  563    H    THR  67           H        THR  67  -8.216   2.846  -5.771
  564    HA   THR  67           HA       THR  67  -6.930   1.735  -8.155
  565    HB   THR  67           HB       THR  67  -8.667   3.290  -9.062
  566    HG1  THR  67           HG1      THR  67  -7.245   3.668 -10.545
  567   HG21  THR  67          1HG2      THR  67  -8.779   4.910  -7.169
  568   HG22  THR  67          2HG2      THR  67  -8.538   5.707  -8.722
  569   HG23  THR  67          3HG2      THR  67  -7.177   5.517  -7.616
  570    H    VAL  68           H        VAL  68  -4.744   2.116  -8.138
  571    HA   VAL  68           HA       VAL  68  -3.604   3.469  -5.815
  572    HB   VAL  68           HB       VAL  68  -2.239   1.910  -8.055
  573   HG11  VAL  68          1HG1      VAL  68  -0.206   1.955  -6.636
  574   HG12  VAL  68          2HG1      VAL  68  -1.024   3.019  -5.488
  575   HG13  VAL  68          3HG1      VAL  68  -0.685   3.584  -7.126
  576   HG21  VAL  68          1HG2      VAL  68  -3.660   0.506  -6.621
  577   HG22  VAL  68          2HG2      VAL  68  -2.857   1.131  -5.177
  578   HG23  VAL  68          3HG2      VAL  68  -1.956   0.154  -6.336
  579    H    LYS  69           H        LYS  69  -3.271   5.528  -5.894
  580    HA   LYS  69           HA       LYS  69  -3.275   7.142  -8.257
  581    HB2  LYS  69          2HB       LYS  69  -2.629   7.904  -5.370
  582    HB3  LYS  69          3HB       LYS  69  -3.019   9.022  -6.678
  583    HG2  LYS  69          2HG       LYS  69  -4.906   6.951  -5.502
  584    HG3  LYS  69          3HG       LYS  69  -4.920   8.679  -5.137
  585    HD2  LYS  69          2HD       LYS  69  -5.478   7.412  -7.852
  586    HD3  LYS  69          3HD       LYS  69  -6.681   8.076  -6.745
  587    HE2  LYS  69          2HE       LYS  69  -4.522   9.626  -8.218
  588    HE3  LYS  69          3HE       LYS  69  -6.261   9.680  -8.508
  589    HZ1  LYS  69          1HZ       LYS  69  -4.915  10.572  -6.014
  590    HZ2  LYS  69          2HZ       LYS  69  -6.576  10.641  -6.331
  591    HZ3  LYS  69          3HZ       LYS  69  -5.506  11.582  -7.238
  592    H    ARG  70           H        ARG  70  -0.867   6.360  -5.754
  593    HA   ARG  70           HA       ARG  70   1.293   6.375  -7.662
  594    HB2  ARG  70          2HB       ARG  70   2.685   8.062  -6.571
  595    HB3  ARG  70          3HB       ARG  70   1.187   8.797  -7.120
  596    HG2  ARG  70          2HG       ARG  70   0.328   8.949  -4.892
  597    HG3  ARG  70          3HG       ARG  70   1.597   7.905  -4.253
  598    HD2  ARG  70          2HD       ARG  70   1.928  10.310  -3.700
  599    HD3  ARG  70          3HD       ARG  70   3.274   9.618  -4.604
  600    HE   ARG  70           HE       ARG  70   2.620  10.856  -6.510
  601   HH11  ARG  70          1HH1      ARG  70   0.649  11.678  -3.692
  602   HH12  ARG  70          2HH1      ARG  70   0.104  13.179  -4.371
  603   HH21  ARG  70          1HH2      ARG  70   1.901  12.833  -7.372
  604   HH22  ARG  70          2HH2      ARG  70   0.812  13.828  -6.455
  605    H    ILE  71           H        ILE  71   3.212   5.582  -6.855
  606    HA   ILE  71           HA       ILE  71   3.287   4.354  -4.158
  607    HB   ILE  71           HB       ILE  71   5.018   3.699  -6.607
  608   HG12  ILE  71          2HG1      ILE  71   2.681   2.970  -7.026
  609   HG13  ILE  71          3HG1      ILE  71   3.770   1.597  -6.876
  610   HG21  ILE  71          1HG2      ILE  71   5.784   1.749  -5.322
  611   HG22  ILE  71          2HG2      ILE  71   4.804   2.244  -3.941
  612   HG23  ILE  71          3HG2      ILE  71   6.153   3.252  -4.478
  613   HD11  ILE  71          1HD1      ILE  71   1.941   2.606  -4.715
  614   HD12  ILE  71          2HD1      ILE  71   2.954   1.159  -4.651
  615   HD13  ILE  71          3HD1      ILE  71   1.616   1.257  -5.795
  616    H    THR  72           H        THR  72   4.606   5.616  -2.802
  617    HA   THR  72           HA       THR  72   7.051   6.783  -4.007
  618    HB   THR  72           HB       THR  72   5.516   8.649  -3.474
  619    HG1  THR  72           HG1      THR  72   7.420   8.960  -1.464
  620   HG21  THR  72          1HG2      THR  72   4.949   9.242  -1.148
  621   HG22  THR  72          2HG2      THR  72   5.665   7.737  -0.577
  622   HG23  THR  72          3HG2      THR  72   4.228   7.685  -1.597
  623    H    ARG  73           H        ARG  73   8.881   6.242  -3.047
  624    HA   ARG  73           HA       ARG  73   8.892   4.466  -0.708
  625    HB2  ARG  73          2HB       ARG  73  10.217   3.925  -2.794
  626    HB3  ARG  73          3HB       ARG  73  11.176   5.377  -2.527
  627    HG2  ARG  73          2HG       ARG  73  11.916   4.370  -0.320
  628    HG3  ARG  73          3HG       ARG  73  11.074   2.887  -0.787
  629    HD2  ARG  73          2HD       ARG  73  13.402   4.177  -2.262
  630    HD3  ARG  73          3HD       ARG  73  13.472   2.723  -1.264
  631    HE   ARG  73           HE       ARG  73  11.629   2.563  -3.491
  632   HH11  ARG  73          1HH1      ARG  73  14.977   1.947  -2.493
  633   HH12  ARG  73          2HH1      ARG  73  15.248   0.813  -3.777
  634   HH21  ARG  73          1HH2      ARG  73  12.039   1.043  -5.121
  635   HH22  ARG  73          2HH2      ARG  73  13.601   0.308  -5.249
  636    H    THR  74           H        THR  74   9.720   5.137   1.297
  637    HA   THR  74           HA       THR  74  10.287   7.891   1.812
  638    HB   THR  74           HB       THR  74   9.349   6.434   3.601
  639    HG1  THR  74           HG1      THR  74  10.461   8.282   4.254
  640   HG21  THR  74          1HG2      THR  74  10.728   4.818   4.854
  641   HG22  THR  74          2HG2      THR  74  12.084   5.094   3.761
  642   HG23  THR  74          3HG2      THR  74  10.617   4.326   3.161
  643    H    VAL  75           H        VAL  75  12.147   8.948   1.492
  644    HA   VAL  75           HA       VAL  75  14.351   7.664   0.227
  645    HB   VAL  75           HB       VAL  75  13.754   9.917  -0.455
  646   HG11  VAL  75          1HG1      VAL  75  14.534  10.914   2.301
  647   HG12  VAL  75          2HG1      VAL  75  12.903  10.851   1.635
  648   HG13  VAL  75          3HG1      VAL  75  14.103  11.928   0.919
  649   HG21  VAL  75          1HG2      VAL  75  16.093   9.241  -0.780
  650   HG22  VAL  75          2HG2      VAL  75  16.529   9.897   0.800
  651   HG23  VAL  75          3HG2      VAL  75  15.991  10.979  -0.488
  652    H    GLY  76           H        GLY  76  15.767   6.497   1.216
  653    HA2  GLY  76          2HA       GLY  76  16.959   7.242   3.830
  654    HA3  GLY  76          3HA       GLY  76  16.404   5.598   3.509
  655    H    SER  77           H        SER  77  17.158   5.325   0.848
  656    HA   SER  77           HA       SER  77  19.989   6.045   0.590
  657    HB2  SER  77          2HB       SER  77  19.907   3.712   1.531
  658    HB3  SER  77          3HB       SER  77  18.935   3.208   0.149
  659    HG   SER  77           HG       SER  77  21.377   2.933   0.164
  660    H    LEU  78           H        LEU  78  19.983   7.211  -1.235
  661    HA   LEU  78           HA       LEU  78  18.088   7.046  -3.348
  662    HB2  LEU  78          2HB       LEU  78  19.380   8.675  -4.517
  663    HB3  LEU  78          3HB       LEU  78  19.503   9.094  -2.821
  664    HG   LEU  78           HG       LEU  78  21.710   7.629  -4.349
  665   HD11  LEU  78          1HD1      LEU  78  21.538  10.607  -3.766
  666   HD12  LEU  78          2HD1      LEU  78  21.368   9.848  -5.350
  667   HD13  LEU  78          3HD1      LEU  78  22.907   9.762  -4.498
  668   HD21  LEU  78          1HD2      LEU  78  23.170   8.272  -2.482
  669   HD22  LEU  78          2HD2      LEU  78  21.813   7.304  -1.905
  670   HD23  LEU  78          3HD2      LEU  78  21.812   9.053  -1.664
  671    H    GLU  79           H        GLU  79  18.638   6.495  -5.649
  672    HA   GLU  79           HA       GLU  79  19.701   3.880  -5.935
  673    HB2  GLU  79          2HB       GLU  79  19.041   5.973  -8.042
  674    HB3  GLU  79          3HB       GLU  79  19.442   4.295  -8.405
  675    HG2  GLU  79          2HG       GLU  79  17.418   3.558  -7.188
  676    HG3  GLU  79          3HG       GLU  79  17.030   5.244  -6.824
  677    H    HIS  80           H        HIS  80  21.847   4.154  -4.990
  678    HA   HIS  80           HA       HIS  80  23.926   5.420  -6.565
  679    HB2  HIS  80          2HB       HIS  80  24.264   5.112  -4.118
  680    HB3  HIS  80          3HB       HIS  80  24.135   3.368  -4.299
  681    HD1  HIS  80           HD1      HIS  80  26.498   6.232  -4.799
  682    HD2  HIS  80           HD2      HIS  80  26.485   2.104  -5.311
  683    HE1  HIS  80           HE1      HIS  80  28.889   5.589  -5.212
  684    HE2  HIS  80           HE2      HIS  80  28.848   3.105  -5.565
  685    H    HIS  81           H        HIS  81  23.506   4.611  -8.607
  686    HA   HIS  81           HA       HIS  81  23.192   1.847  -9.218
  687    HB2  HIS  81          2HB       HIS  81  23.770   4.275 -10.952
  688    HB3  HIS  81          3HB       HIS  81  23.663   2.655 -11.634
  689    HD1  HIS  81           HD1      HIS  81  21.312   1.475 -11.502
  690    HD2  HIS  81           HD2      HIS  81  21.314   5.486 -10.418
  691    HE1  HIS  81           HE1      HIS  81  18.908   2.192 -11.552
  692    HE2  HIS  81           HE2      HIS  81  18.925   4.604 -10.849
  693    H    HIS  82           H        HIS  82  24.641   0.363  -9.837
  694    HA   HIS  82           HA       HIS  82  27.153   0.546  -8.537
  695    HB2  HIS  82          2HB       HIS  82  25.918  -1.624 -10.287
  696    HB3  HIS  82          3HB       HIS  82  27.451  -1.830  -9.439
  697    HD1  HIS  82           HD1      HIS  82  26.815  -3.510  -7.682
  698    HD2  HIS  82           HD2      HIS  82  24.140  -0.340  -7.830
  699    HE1  HIS  82           HE1      HIS  82  25.282  -3.823  -5.724
  700    HE2  HIS  82           HE2      HIS  82  23.816  -1.784  -5.731
  701    H    HIS  83           H        HIS  83  26.187   0.698 -11.919
  702    HA   HIS  83           HA       HIS  83  27.236   1.170 -13.858
  703    HB2  HIS  83          2HB       HIS  83  28.991   2.798 -11.978
  704    HB3  HIS  83          3HB       HIS  83  29.157   2.866 -13.727
  705    HD1  HIS  83           HD1      HIS  83  27.361   4.410 -10.977
  706    HD2  HIS  83           HD2      HIS  83  26.714   3.862 -15.045
  707    HE1  HIS  83           HE1      HIS  83  25.616   6.096 -11.620
  708    HE2  HIS  83           HE2      HIS  83  25.436   5.897 -14.118
  709    H    HIS  84           H        HIS  84  27.766  -1.040 -14.171
  710    HA   HIS  84           HA       HIS  84  30.647  -1.677 -13.989
  711    HB2  HIS  84          2HB       HIS  84  30.181  -3.935 -13.202
  712    HB3  HIS  84          3HB       HIS  84  29.429  -2.792 -12.099
  713    HD1  HIS  84           HD1      HIS  84  28.630  -5.516 -14.520
  714    HD2  HIS  84           HD2      HIS  84  26.575  -2.806 -12.125
  715    HE1  HIS  84           HE1      HIS  84  26.247  -6.311 -14.476
  716    HE2  HIS  84           HE2      HIS  84  25.009  -4.602 -13.113
  717    H    HIS  85           H        HIS  85  31.346  -3.278 -15.497
  718    HA   HIS  85           HA       HIS  85  30.101  -2.939 -18.094
  719    HB2  HIS  85          2HB       HIS  85  32.205  -4.150 -18.904
  720    HB3  HIS  85          3HB       HIS  85  32.465  -2.623 -18.084
  721    HD1  HIS  85           HD1      HIS  85  33.489  -2.737 -15.648
  722    HD2  HIS  85           HD2      HIS  85  33.476  -6.341 -17.731
  723    HE1  HIS  85           HE1      HIS  85  35.050  -4.257 -14.396
  724    HE2  HIS  85           HE2      HIS  85  34.917  -6.452 -15.598
  Start of MODEL   20
    1    H1   MET   1          1H        MET   1 -24.903  -4.906   5.101
    2    H2   MET   1          2H        MET   1 -25.263  -3.841   6.365
    3    H3   MET   1          3H        MET   1 -25.415  -5.510   6.591
    4    HA   MET   1           HA       MET   1 -23.436  -4.726   7.661
    5    HB2  MET   1          2HB       MET   1 -22.880  -6.351   5.135
    6    HB3  MET   1          3HB       MET   1 -21.768  -6.216   6.494
    7    HG2  MET   1          2HG       MET   1 -22.944  -8.337   6.577
    8    HG3  MET   1          3HG       MET   1 -23.426  -7.335   7.947
    9    HE1  MET   1          1HE       MET   1 -25.610  -8.856   8.426
   10    HE2  MET   1          2HE       MET   1 -25.025  -9.911   7.138
   11    HE3  MET   1          3HE       MET   1 -26.701  -9.365   7.138
   12    HA   PRO   2           HA       PRO   2 -21.767  -1.020   5.738
   13    HB2  PRO   2          2HB       PRO   2 -19.628  -0.547   7.398
   14    HB3  PRO   2          3HB       PRO   2 -21.313  -0.304   7.906
   15    HG2  PRO   2          2HG       PRO   2 -19.532  -2.676   8.409
   16    HG3  PRO   2          3HG       PRO   2 -20.563  -1.785   9.556
   17    HD2  PRO   2          2HD       PRO   2 -21.378  -4.105   8.457
   18    HD3  PRO   2          3HD       PRO   2 -22.524  -2.784   8.777
   19    H    SER   3           H        SER   3 -19.709  -3.828   6.236
   20    HA   SER   3           HA       SER   3 -17.879  -4.709   5.274
   21    HB2  SER   3          2HB       SER   3 -18.684  -3.003   2.878
   22    HB3  SER   3          3HB       SER   3 -17.505  -4.318   2.832
   23    HG   SER   3           HG       SER   3 -19.086  -5.683   2.712
   24    H    GLU   4           H        GLU   4 -17.628  -2.133   6.793
   25    HA   GLU   4           HA       GLU   4 -15.855  -0.311   5.639
   26    HB2  GLU   4          2HB       GLU   4 -17.154   0.067   7.773
   27    HB3  GLU   4          3HB       GLU   4 -16.020  -0.994   8.604
   28    HG2  GLU   4          2HG       GLU   4 -14.180   0.631   7.743
   29    HG3  GLU   4          3HG       GLU   4 -15.505   1.741   7.411
   30    H    GLU   5           H        GLU   5 -15.152  -3.027   7.827
   31    HA   GLU   5           HA       GLU   5 -12.364  -2.742   7.971
   32    HB2  GLU   5          2HB       GLU   5 -14.017  -5.285   8.249
   33    HB3  GLU   5          3HB       GLU   5 -12.357  -5.080   8.805
   34    HG2  GLU   5          2HG       GLU   5 -13.068  -3.419  10.447
   35    HG3  GLU   5          3HG       GLU   5 -14.723  -3.496   9.846
   36    H    GLU   6           H        GLU   6 -14.424  -4.620   5.816
   37    HA   GLU   6           HA       GLU   6 -12.523  -6.085   4.386
   38    HB2  GLU   6          2HB       GLU   6 -14.912  -6.591   4.365
   39    HB3  GLU   6          3HB       GLU   6 -15.275  -5.082   3.535
   40    HG2  GLU   6          2HG       GLU   6 -14.049  -5.889   1.547
   41    HG3  GLU   6          3HG       GLU   6 -13.655  -7.384   2.393
   42    H    GLU   7           H        GLU   7 -13.713  -2.784   3.951
   43    HA   GLU   7           HA       GLU   7 -12.637  -2.218   1.431
   44    HB2  GLU   7          2HB       GLU   7 -12.936  -0.310   3.787
   45    HB3  GLU   7          3HB       GLU   7 -12.681   0.166   2.115
   46    HG2  GLU   7          2HG       GLU   7 -15.100  -1.393   3.046
   47    HG3  GLU   7          3HG       GLU   7 -15.048   0.360   2.978
   48    H    LYS   8           H        LYS   8 -11.159  -1.619   4.663
   49    HA   LYS   8           HA       LYS   8  -8.636  -0.812   3.629
   50    HB2  LYS   8          2HB       LYS   8  -9.355  -1.857   6.397
   51    HB3  LYS   8          3HB       LYS   8  -7.769  -1.230   5.967
   52    HG2  LYS   8          2HG       LYS   8  -8.728   0.627   6.970
   53    HG3  LYS   8          3HG       LYS   8  -9.077   0.938   5.273
   54    HD2  LYS   8          2HD       LYS   8 -11.062   1.450   6.522
   55    HD3  LYS   8          3HD       LYS   8 -11.381  -0.060   5.662
   56    HE2  LYS   8          2HE       LYS   8 -12.218  -0.161   7.967
   57    HE3  LYS   8          3HE       LYS   8 -10.935  -1.342   7.712
   58    HZ1  LYS   8          1HZ       LYS   8 -10.649   1.287   9.071
   59    HZ2  LYS   8          2HZ       LYS   8  -9.392   0.191   8.812
   60    HZ3  LYS   8          3HZ       LYS   8 -10.680  -0.224   9.824
   61    H    ARG   9           H        ARG   9  -9.943  -3.990   4.475
   62    HA   ARG   9           HA       ARG   9  -7.505  -5.467   4.429
   63    HB2  ARG   9          2HB       ARG   9 -10.375  -6.378   3.959
   64    HB3  ARG   9          3HB       ARG   9  -9.007  -7.483   4.072
   65    HG2  ARG   9          2HG       ARG   9  -8.571  -6.760   6.378
   66    HG3  ARG   9          3HG       ARG   9  -9.893  -5.593   6.273
   67    HD2  ARG   9          2HD       ARG   9 -10.645  -7.551   7.491
   68    HD3  ARG   9          3HD       ARG   9 -11.488  -7.483   5.943
   69    HE   ARG   9           HE       ARG   9  -9.701  -9.163   5.196
   70   HH11  ARG   9          1HH1      ARG   9 -10.978  -9.081   8.484
   71   HH12  ARG   9          2HH1      ARG   9 -10.684 -10.768   8.762
   72   HH21  ARG   9          1HH2      ARG   9  -9.328 -11.375   5.593
   73   HH22  ARG   9          2HH2      ARG   9  -9.752 -12.061   7.134
   74    H    GLN  10           H        GLN  10  -9.799  -4.529   1.916
   75    HA   GLN  10           HA       GLN  10  -8.539  -5.837  -0.285
   76    HB2  GLN  10          2HB       GLN  10 -10.344  -3.380  -0.155
   77    HB3  GLN  10          3HB       GLN  10  -9.771  -4.069  -1.668
   78    HG2  GLN  10          2HG       GLN  10 -10.997  -6.126  -1.273
   79    HG3  GLN  10          3HG       GLN  10 -11.451  -5.589   0.347
   80   HE21  GLN  10          1HE2      GLN  10 -13.048  -3.995   0.568
   81   HE22  GLN  10          2HE2      GLN  10 -14.097  -3.538  -0.723
   82    H    VAL  11           H        VAL  11  -8.257  -2.561   1.127
   83    HA   VAL  11           HA       VAL  11  -6.657  -1.453  -0.924
   84    HB   VAL  11           HB       VAL  11  -7.035  -0.535   1.966
   85   HG11  VAL  11          1HG1      VAL  11  -6.301   1.686   1.208
   86   HG12  VAL  11          2HG1      VAL  11  -5.961   1.038  -0.392
   87   HG13  VAL  11          3HG1      VAL  11  -5.020   0.495   0.989
   88   HG21  VAL  11          1HG2      VAL  11  -8.693   1.017   1.060
   89   HG22  VAL  11          2HG2      VAL  11  -9.132  -0.637   0.652
   90   HG23  VAL  11          3HG2      VAL  11  -8.415   0.406  -0.572
   91    H    LYS  12           H        LYS  12  -5.720  -2.776   2.275
   92    HA   LYS  12           HA       LYS  12  -2.940  -2.205   2.126
   93    HB2  LYS  12          2HB       LYS  12  -4.379  -4.388   3.693
   94    HB3  LYS  12          3HB       LYS  12  -2.712  -3.888   3.962
   95    HG2  LYS  12          2HG       LYS  12  -3.440  -1.686   4.704
   96    HG3  LYS  12          3HG       LYS  12  -5.120  -2.077   4.324
   97    HD2  LYS  12          2HD       LYS  12  -3.419  -3.517   6.400
   98    HD3  LYS  12          3HD       LYS  12  -4.617  -2.271   6.760
   99    HE2  LYS  12          2HE       LYS  12  -6.397  -3.719   5.816
  100    HE3  LYS  12          3HE       LYS  12  -5.192  -4.966   5.474
  101    HZ1  LYS  12          1HZ       LYS  12  -6.377  -5.412   7.533
  102    HZ2  LYS  12          2HZ       LYS  12  -5.887  -3.927   8.169
  103    HZ3  LYS  12          3HZ       LYS  12  -4.741  -5.124   7.849
  104    H    GLN  13           H        GLN  13  -4.918  -4.937   1.131
  105    HA   GLN  13           HA       GLN  13  -2.836  -6.738   0.400
  106    HB2  GLN  13          2HB       GLN  13  -5.169  -7.465   0.815
  107    HB3  GLN  13          3HB       GLN  13  -5.730  -6.529  -0.565
  108    HG2  GLN  13          2HG       GLN  13  -4.377  -8.007  -2.062
  109    HG3  GLN  13          3HG       GLN  13  -3.929  -8.969  -0.651
  110   HE21  GLN  13          1HE2      GLN  13  -7.122  -7.542  -1.278
  111   HE22  GLN  13          2HE2      GLN  13  -7.958  -9.043  -1.432
  112    H    VAL  14           H        VAL  14  -4.921  -4.603  -1.623
  113    HA   VAL  14           HA       VAL  14  -3.679  -4.922  -4.094
  114    HB   VAL  14           HB       VAL  14  -5.028  -2.419  -2.952
  115   HG11  VAL  14          1HG1      VAL  14  -5.335  -1.653  -5.290
  116   HG12  VAL  14          2HG1      VAL  14  -4.353  -3.001  -5.865
  117   HG13  VAL  14          3HG1      VAL  14  -3.628  -1.752  -4.853
  118   HG21  VAL  14          1HG2      VAL  14  -6.522  -4.374  -3.045
  119   HG22  VAL  14          2HG2      VAL  14  -6.168  -4.593  -4.758
  120   HG23  VAL  14          3HG2      VAL  14  -7.024  -3.149  -4.210
  121    H    ALA  15           H        ALA  15  -2.922  -2.729  -1.438
  122    HA   ALA  15           HA       ALA  15  -0.913  -1.162  -2.584
  123    HB1  ALA  15          1HB       ALA  15  -2.054  -0.624  -0.467
  124    HB2  ALA  15          2HB       ALA  15  -0.302  -0.612  -0.264
  125    HB3  ALA  15          3HB       ALA  15  -1.254  -1.981   0.324
  126    H    LYS  16           H        LYS  16  -0.683  -4.246  -0.775
  127    HA   LYS  16           HA       LYS  16   2.190  -4.324  -0.899
  128    HB2  LYS  16          2HB       LYS  16   2.108  -6.402   0.236
  129    HB3  LYS  16          3HB       LYS  16   0.840  -5.423   0.938
  130    HG2  LYS  16          2HG       LYS  16  -0.861  -6.696  -0.170
  131    HG3  LYS  16          3HG       LYS  16   0.323  -7.532  -1.170
  132    HD2  LYS  16          2HD       LYS  16   0.116  -7.793   1.860
  133    HD3  LYS  16          3HD       LYS  16  -0.534  -8.946   0.692
  134    HE2  LYS  16          2HE       LYS  16   1.745  -9.367  -0.168
  135    HE3  LYS  16          3HE       LYS  16   2.399  -8.216   1.002
  136    HZ1  LYS  16          1HZ       LYS  16   1.664  -9.610   2.789
  137    HZ2  LYS  16          2HZ       LYS  16   2.592 -10.538   1.724
  138    HZ3  LYS  16          3HZ       LYS  16   0.910 -10.678   1.720
  139    H    GLU  17           H        GLU  17  -0.419  -5.525  -2.929
  140    HA   GLU  17           HA       GLU  17   1.072  -7.362  -4.503
  141    HB2  GLU  17          2HB       GLU  17  -1.343  -5.717  -5.391
  142    HB3  GLU  17          3HB       GLU  17  -0.715  -7.147  -6.197
  143    HG2  GLU  17          2HG       GLU  17  -2.067  -7.029  -3.502
  144    HG3  GLU  17          3HG       GLU  17  -2.716  -7.709  -4.979
  145    H    LYS  18           H        LYS  18   0.551  -3.881  -4.661
  146    HA   LYS  18           HA       LYS  18   1.871  -3.429  -7.171
  147    HB2  LYS  18          2HB       LYS  18   1.364  -1.439  -4.924
  148    HB3  LYS  18          3HB       LYS  18   1.757  -1.045  -6.593
  149    HG2  LYS  18          2HG       LYS  18  -0.800  -2.207  -5.505
  150    HG3  LYS  18          3HG       LYS  18  -0.568  -0.663  -6.304
  151    HD2  LYS  18          2HD       LYS  18  -0.363  -3.398  -7.619
  152    HD3  LYS  18          3HD       LYS  18  -1.720  -2.283  -7.759
  153    HE2  LYS  18          2HE       LYS  18  -0.325  -0.666  -8.939
  154    HE3  LYS  18          3HE       LYS  18   1.099  -1.693  -8.725
  155    HZ1  LYS  18          1HZ       LYS  18   0.008  -3.405 -10.064
  156    HZ2  LYS  18          2HZ       LYS  18   0.162  -1.961 -10.930
  157    HZ3  LYS  18          3HZ       LYS  18  -1.336  -2.401 -10.284
  158    H    LEU  19           H        LEU  19   2.866  -3.482  -3.808
  159    HA   LEU  19           HA       LEU  19   5.569  -2.660  -4.278
  160    HB2  LEU  19          2HB       LEU  19   4.180  -4.006  -1.937
  161    HB3  LEU  19          3HB       LEU  19   5.895  -3.638  -1.919
  162    HG   LEU  19           HG       LEU  19   3.587  -1.660  -2.000
  163   HD11  LEU  19          1HD1      LEU  19   4.573  -0.804   0.080
  164   HD12  LEU  19          2HD1      LEU  19   5.835  -2.038   0.000
  165   HD13  LEU  19          3HD1      LEU  19   4.149  -2.509   0.216
  166   HD21  LEU  19          1HD2      LEU  19   6.538  -1.022  -2.348
  167   HD22  LEU  19          2HD2      LEU  19   5.247   0.161  -2.116
  168   HD23  LEU  19          3HD2      LEU  19   5.272  -0.835  -3.566
  169    H    LEU  20           H        LEU  20   3.870  -5.723  -4.427
  170    HA   LEU  20           HA       LEU  20   6.239  -7.355  -4.737
  171    HB2  LEU  20          2HB       LEU  20   3.302  -7.920  -5.297
  172    HB3  LEU  20          3HB       LEU  20   4.571  -9.120  -5.485
  173    HG   LEU  20           HG       LEU  20   3.899  -7.759  -2.841
  174   HD11  LEU  20          1HD1      LEU  20   2.000  -9.127  -3.575
  175   HD12  LEU  20          2HD1      LEU  20   2.782  -9.817  -2.156
  176   HD13  LEU  20          3HD1      LEU  20   3.060 -10.532  -3.749
  177   HD21  LEU  20          1HD2      LEU  20   5.682 -10.147  -3.410
  178   HD22  LEU  20          2HD2      LEU  20   5.273  -9.519  -1.811
  179   HD23  LEU  20          3HD2      LEU  20   6.209  -8.532  -2.929
  180    H    GLU  21           H        GLU  21   4.301  -5.364  -6.828
  181    HA   GLU  21           HA       GLU  21   5.235  -6.351  -9.352
  182    HB2  GLU  21          2HB       GLU  21   4.224  -3.589  -8.535
  183    HB3  GLU  21          3HB       GLU  21   4.601  -4.036 -10.193
  184    HG2  GLU  21          2HG       GLU  21   2.504  -5.384  -8.483
  185    HG3  GLU  21          3HG       GLU  21   2.184  -4.127  -9.672
  186    H    GLN  22           H        GLN  22   6.435  -3.953  -7.048
  187    HA   GLN  22           HA       GLN  22   8.727  -3.166  -8.610
  188    HB2  GLN  22          2HB       GLN  22   8.141  -2.750  -5.642
  189    HB3  GLN  22          3HB       GLN  22   9.432  -1.967  -6.550
  190    HG2  GLN  22          2HG       GLN  22   7.732  -0.862  -7.984
  191    HG3  GLN  22          3HG       GLN  22   6.458  -1.602  -7.018
  192   HE21  GLN  22          1HE2      GLN  22   7.915  -1.180  -4.463
  193   HE22  GLN  22          2HE2      GLN  22   7.773   0.508  -4.135
  194    H    SER  23           H        SER  23   8.054  -5.541  -6.093
  195    HA   SER  23           HA       SER  23  10.519  -6.966  -6.563
  196    HB2  SER  23          2HB       SER  23  11.301  -5.227  -4.979
  197    HB3  SER  23          3HB       SER  23  10.047  -5.693  -3.828
  198    HG   SER  23           HG       SER  23  12.038  -6.659  -3.325
  199    HA   PRO  24           HA       PRO  24   7.007  -9.755  -5.404
  200    HB2  PRO  24          2HB       PRO  24   7.584 -11.795  -7.109
  201    HB3  PRO  24          3HB       PRO  24   6.864 -10.276  -7.684
  202    HG2  PRO  24          2HG       PRO  24   9.731 -11.150  -7.788
  203    HG3  PRO  24          3HG       PRO  24   8.748 -10.375  -9.051
  204    HD2  PRO  24          2HD       PRO  24  10.504  -8.990  -7.457
  205    HD3  PRO  24          3HD       PRO  24   9.057  -8.255  -8.178
  206    H    ASN  25           H        ASN  25  10.397 -10.145  -5.134
  207    HA   ASN  25           HA       ASN  25  10.376 -12.818  -3.952
  208    HB2  ASN  25          2HB       ASN  25  12.672 -10.865  -4.455
  209    HB3  ASN  25          3HB       ASN  25  12.843 -12.548  -3.949
  210   HD21  ASN  25          1HD2      ASN  25  12.534 -14.196  -5.483
  211   HD22  ASN  25          2HD2      ASN  25  12.403 -13.879  -7.178
  212    H    SER  26           H        SER  26  10.223  -9.555  -2.912
  213    HA   SER  26           HA       SER  26  11.679  -9.851  -0.424
  214    HB2  SER  26          2HB       SER  26  11.051  -7.479  -0.070
  215    HB3  SER  26          3HB       SER  26  11.754  -7.731  -1.667
  216    HG   SER  26           HG       SER  26   9.686  -7.671  -2.541
  217    H    LYS  27           H        LYS  27  10.805  -9.519   1.683
  218    HA   LYS  27           HA       LYS  27   8.054 -10.291   2.138
  219    HB2  LYS  27          2HB       LYS  27   9.714 -11.019   3.750
  220    HB3  LYS  27          3HB       LYS  27  10.267  -9.373   4.028
  221    HG2  LYS  27          2HG       LYS  27   8.896 -10.237   5.893
  222    HG3  LYS  27          3HG       LYS  27   8.173  -8.815   5.141
  223    HD2  LYS  27          2HD       LYS  27   6.448 -10.460   5.645
  224    HD3  LYS  27          3HD       LYS  27   6.608 -10.288   3.899
  225    HE2  LYS  27          2HE       LYS  27   7.929 -12.371   3.816
  226    HE3  LYS  27          3HE       LYS  27   7.791 -12.533   5.568
  227    HZ1  LYS  27          1HZ       LYS  27   5.378 -12.683   5.301
  228    HZ2  LYS  27          2HZ       LYS  27   6.176 -13.911   4.468
  229    HZ3  LYS  27          3HZ       LYS  27   5.546 -12.596   3.624
  230    H    VAL  28           H        VAL  28   6.423  -8.899   1.936
  231    HA   VAL  28           HA       VAL  28   6.797  -6.036   2.616
  232    HB   VAL  28           HB       VAL  28   4.485  -7.266   1.027
  233   HG11  VAL  28          1HG1      VAL  28   5.284  -4.357   1.434
  234   HG12  VAL  28          2HG1      VAL  28   3.903  -5.171   2.171
  235   HG13  VAL  28          3HG1      VAL  28   3.953  -4.925   0.424
  236   HG21  VAL  28          1HG2      VAL  28   6.569  -7.527  -0.259
  237   HG22  VAL  28          2HG2      VAL  28   6.919  -5.807  -0.078
  238   HG23  VAL  28          3HG2      VAL  28   5.516  -6.329  -1.016
  239    H    GLN  29           H        GLN  29   6.184  -5.665   4.658
  240    HA   GLN  29           HA       GLN  29   3.895  -7.109   5.888
  241    HB2  GLN  29          2HB       GLN  29   5.994  -7.387   7.126
  242    HB3  GLN  29          3HB       GLN  29   6.296  -5.655   7.096
  243    HG2  GLN  29          2HG       GLN  29   5.572  -6.347   9.314
  244    HG3  GLN  29          3HG       GLN  29   4.369  -5.280   8.590
  245   HE21  GLN  29          1HE2      GLN  29   2.622  -5.996   9.775
  246   HE22  GLN  29          2HE2      GLN  29   1.976  -7.596   9.667
  247    H    VAL  30           H        VAL  30   2.159  -5.827   6.729
  248    HA   VAL  30           HA       VAL  30   1.886  -3.106   5.864
  249    HB   VAL  30           HB       VAL  30  -0.109  -4.527   6.145
  250   HG11  VAL  30          1HG1      VAL  30  -1.004  -5.137   8.363
  251   HG12  VAL  30          2HG1      VAL  30   0.453  -4.497   9.129
  252   HG13  VAL  30          3HG1      VAL  30   0.561  -5.893   8.055
  253   HG21  VAL  30          1HG2      VAL  30  -0.147  -2.123   8.018
  254   HG22  VAL  30          2HG2      VAL  30  -1.568  -2.895   7.306
  255   HG23  VAL  30          3HG2      VAL  30  -0.392  -2.087   6.269
  256    H    ARG  31           H        ARG  31   2.563  -1.279   6.872
  257    HA   ARG  31           HA       ARG  31   3.843  -1.474   9.524
  258    HB2  ARG  31          2HB       ARG  31   5.176  -0.479   7.701
  259    HB3  ARG  31          3HB       ARG  31   3.932   0.733   7.411
  260    HG2  ARG  31          2HG       ARG  31   5.742   1.756   8.634
  261    HG3  ARG  31          3HG       ARG  31   4.339   1.651   9.695
  262    HD2  ARG  31          2HD       ARG  31   5.383  -0.483  10.643
  263    HD3  ARG  31          3HD       ARG  31   6.852  -0.055   9.752
  264    HE   ARG  31           HE       ARG  31   5.627   1.791  11.721
  265   HH11  ARG  31          1HH1      ARG  31   8.459  -0.041  10.662
  266   HH12  ARG  31          2HH1      ARG  31   9.504   0.707  11.829
  267   HH21  ARG  31          1HH2      ARG  31   7.031   2.773  13.199
  268   HH22  ARG  31          2HH2      ARG  31   8.699   2.289  13.253
  269    H    ARG  32           H        ARG  32   1.718   0.869   7.826
  270    HA   ARG  32           HA       ARG  32  -0.047   1.171  10.111
  271    HB2  ARG  32          2HB       ARG  32   1.776   3.434   9.206
  272    HB3  ARG  32          3HB       ARG  32   0.247   3.770   9.999
  273    HG2  ARG  32          2HG       ARG  32   2.492   2.158  11.261
  274    HG3  ARG  32          3HG       ARG  32   2.256   3.891  11.492
  275    HD2  ARG  32          2HD       ARG  32   1.297   2.837  13.398
  276    HD3  ARG  32          3HD       ARG  32  -0.061   3.349  12.394
  277    HE   ARG  32           HE       ARG  32   0.950   0.556  12.489
  278   HH11  ARG  32          1HH1      ARG  32  -1.774   2.796  12.437
  279   HH12  ARG  32          2HH1      ARG  32  -2.963   1.532  12.450
  280   HH21  ARG  32          1HH2      ARG  32  -0.651  -1.092  12.490
  281   HH22  ARG  32          2HH2      ARG  32  -2.335  -0.654  12.474
  282    H    VAL  33           H        VAL  33  -1.929   2.637   9.569
  283    HA   VAL  33           HA       VAL  33  -2.516   2.853   6.672
  284    HB   VAL  33           HB       VAL  33  -4.372   1.453   8.686
  285   HG11  VAL  33          1HG1      VAL  33  -4.840   2.031   5.731
  286   HG12  VAL  33          2HG1      VAL  33  -5.689   2.771   7.090
  287   HG13  VAL  33          3HG1      VAL  33  -5.885   1.051   6.762
  288   HG21  VAL  33          1HG2      VAL  33  -2.529  -0.010   7.972
  289   HG22  VAL  33          2HG2      VAL  33  -2.916   0.295   6.278
  290   HG23  VAL  33          3HG2      VAL  33  -4.065  -0.568   7.304
  291    H    GLN  34           H        GLN  34  -3.205   4.888   6.304
  292    HA   GLN  34           HA       GLN  34  -4.671   6.410   8.392
  293    HB2  GLN  34          2HB       GLN  34  -2.743   7.547   6.300
  294    HB3  GLN  34          3HB       GLN  34  -3.615   8.469   7.517
  295    HG2  GLN  34          2HG       GLN  34  -1.464   8.316   8.406
  296    HG3  GLN  34          3HG       GLN  34  -2.339   7.041   9.252
  297   HE21  GLN  34          1HE2      GLN  34  -0.545   5.855   9.704
  298   HE22  GLN  34          2HE2      GLN  34   0.424   5.071   8.508
  299    H    LYS  35           H        LYS  35  -6.762   6.571   7.738
  300    HA   LYS  35           HA       LYS  35  -7.532   6.526   4.925
  301    HB2  LYS  35          2HB       LYS  35  -8.736   5.393   6.943
  302    HB3  LYS  35          3HB       LYS  35  -9.364   6.982   7.331
  303    HG2  LYS  35          2HG       LYS  35  -9.826   5.717   4.616
  304    HG3  LYS  35          3HG       LYS  35 -10.848   5.333   5.998
  305    HD2  LYS  35          2HD       LYS  35 -11.456   7.736   6.201
  306    HD3  LYS  35          3HD       LYS  35 -10.458   8.098   4.789
  307    HE2  LYS  35          2HE       LYS  35 -11.892   6.721   3.366
  308    HE3  LYS  35          3HE       LYS  35 -12.837   6.201   4.764
  309    HZ1  LYS  35          1HZ       LYS  35 -12.649   9.011   3.808
  310    HZ2  LYS  35          2HZ       LYS  35 -13.642   8.437   5.049
  311    HZ3  LYS  35          3HZ       LYS  35 -13.916   7.952   3.455
  312    H    GLN  36           H        GLN  36  -7.176   8.377   3.820
  313    HA   GLN  36           HA       GLN  36  -7.596  11.024   5.120
  314    HB2  GLN  36          2HB       GLN  36  -5.552  10.265   2.965
  315    HB3  GLN  36          3HB       GLN  36  -5.779  11.877   3.631
  316    HG2  GLN  36          2HG       GLN  36  -4.803   9.449   5.173
  317    HG3  GLN  36          3HG       GLN  36  -3.793  10.761   4.568
  318   HE21  GLN  36          1HE2      GLN  36  -4.180   9.819   7.312
  319   HE22  GLN  36          2HE2      GLN  36  -4.699  11.188   8.216
  320    H    GLY  37           H        GLY  37  -9.701  11.331   4.398
  321    HA2  GLY  37          2HA       GLY  37 -11.276  12.263   3.005
  322    HA3  GLY  37          3HA       GLY  37 -10.052  12.377   1.749
  323    H    ASN  38           H        ASN  38  -9.960  10.830   0.177
  324    HA   ASN  38           HA       ASN  38 -11.768   8.468   0.338
  325    HB2  ASN  38          2HB       ASN  38 -10.828   9.926  -2.186
  326    HB3  ASN  38          3HB       ASN  38 -11.888   8.516  -2.130
  327   HD21  ASN  38          1HD2      ASN  38 -14.034   8.790  -1.503
  328   HD22  ASN  38          2HD2      ASN  38 -14.793  10.340  -1.426
  329    H    THR  39           H        THR  39  -8.567   9.624   0.098
  330    HA   THR  39           HA       THR  39  -7.422   7.230  -1.128
  331    HB   THR  39           HB       THR  39  -5.960   9.710  -0.107
  332    HG1  THR  39           HG1      THR  39  -7.681   9.727  -2.065
  333   HG21  THR  39          1HG2      THR  39  -4.219   9.041  -1.733
  334   HG22  THR  39          2HG2      THR  39  -5.155   7.607  -2.161
  335   HG23  THR  39          3HG2      THR  39  -4.489   7.777  -0.534
  336    H    ILE  40           H        ILE  40  -7.384   5.575   0.380
  337    HA   ILE  40           HA       ILE  40  -6.421   5.987   3.089
  338    HB   ILE  40           HB       ILE  40  -6.907   3.391   1.539
  339   HG12  ILE  40          2HG1      ILE  40  -8.650   4.878   3.555
  340   HG13  ILE  40          3HG1      ILE  40  -8.986   4.680   1.840
  341   HG21  ILE  40          1HG2      ILE  40  -6.820   2.264   3.736
  342   HG22  ILE  40          2HG2      ILE  40  -6.423   3.796   4.516
  343   HG23  ILE  40          3HG2      ILE  40  -5.289   3.068   3.376
  344   HD11  ILE  40          1HD1      ILE  40  -8.957   2.483   3.916
  345   HD12  ILE  40          2HD1      ILE  40  -9.278   2.270   2.193
  346   HD13  ILE  40          3HD1      ILE  40 -10.374   3.230   3.180
  347    H    ARG  41           H        ARG  41  -4.368   6.579   3.253
  348    HA   ARG  41           HA       ARG  41  -2.196   5.634   1.589
  349    HB2  ARG  41          2HB       ARG  41  -2.332   7.378   4.086
  350    HB3  ARG  41          3HB       ARG  41  -0.803   6.907   3.354
  351    HG2  ARG  41          2HG       ARG  41  -1.530   8.035   1.242
  352    HG3  ARG  41          3HG       ARG  41  -2.964   8.619   2.089
  353    HD2  ARG  41          2HD       ARG  41  -1.703  10.040   3.496
  354    HD3  ARG  41          3HD       ARG  41  -0.198   9.165   3.192
  355    HE   ARG  41           HE       ARG  41  -1.153  10.293   0.774
  356   HH11  ARG  41          1HH1      ARG  41   0.360  11.302   3.796
  357   HH12  ARG  41          2HH1      ARG  41   1.119  12.686   3.082
  358   HH21  ARG  41          1HH2      ARG  41  -0.081  12.047  -0.159
  359   HH22  ARG  41          2HH2      ARG  41   0.872  13.114   0.833
  360    H    VAL  42           H        VAL  42  -1.945   3.434   1.882
  361    HA   VAL  42           HA       VAL  42  -1.544   2.374   4.598
  362    HB   VAL  42           HB       VAL  42  -1.275   0.878   1.943
  363   HG11  VAL  42          1HG1      VAL  42  -1.528  -1.149   3.315
  364   HG12  VAL  42          2HG1      VAL  42  -1.636  -0.173   4.781
  365   HG13  VAL  42          3HG1      VAL  42  -0.135  -0.207   3.849
  366   HG21  VAL  42          1HG2      VAL  42  -3.549   1.746   2.125
  367   HG22  VAL  42          2HG2      VAL  42  -3.707   1.066   3.750
  368   HG23  VAL  42          3HG2      VAL  42  -3.536  -0.004   2.353
  369    H    GLU  43           H        GLU  43   0.373   2.981   5.390
  370    HA   GLU  43           HA       GLU  43   2.862   2.906   3.927
  371    HB2  GLU  43          2HB       GLU  43   2.385   2.886   6.950
  372    HB3  GLU  43          3HB       GLU  43   3.926   3.183   6.150
  373    HG2  GLU  43          2HG       GLU  43   2.899   5.242   5.104
  374    HG3  GLU  43          3HG       GLU  43   1.467   4.952   6.088
  375    H    LEU  44           H        LEU  44   3.988   1.080   3.455
  376    HA   LEU  44           HA       LEU  44   3.774  -1.283   5.231
  377    HB2  LEU  44          2HB       LEU  44   4.168  -1.691   2.238
  378    HB3  LEU  44          3HB       LEU  44   3.713  -2.847   3.467
  379    HG   LEU  44           HG       LEU  44   1.498  -1.344   3.623
  380   HD11  LEU  44          1HD1      LEU  44   0.809  -0.479   1.437
  381   HD12  LEU  44          2HD1      LEU  44   2.397  -0.857   0.767
  382   HD13  LEU  44          3HD1      LEU  44   2.238   0.363   2.034
  383   HD21  LEU  44          1HD2      LEU  44   0.379  -2.834   2.037
  384   HD22  LEU  44          2HD2      LEU  44   1.492  -3.723   3.077
  385   HD23  LEU  44          3HD2      LEU  44   1.945  -3.360   1.408
  386    H    GLU  45           H        GLU  45   5.663  -2.655   5.127
  387    HA   GLU  45           HA       GLU  45   8.165  -1.148   4.680
  388    HB2  GLU  45          2HB       GLU  45   7.381  -1.414   7.074
  389    HB3  GLU  45          3HB       GLU  45   7.519  -3.161   6.897
  390    HG2  GLU  45          2HG       GLU  45   9.928  -2.991   6.620
  391    HG3  GLU  45          3HG       GLU  45   9.839  -1.231   6.573
  392    H    LEU  46           H        LEU  46   9.118  -2.009   2.980
  393    HA   LEU  46           HA       LEU  46   8.867  -4.875   2.251
  394    HB2  LEU  46          2HB       LEU  46   7.928  -3.106   0.725
  395    HB3  LEU  46          3HB       LEU  46   9.516  -2.413   0.562
  396    HG   LEU  46           HG       LEU  46   8.867  -5.229  -0.425
  397   HD11  LEU  46          1HD1      LEU  46   7.391  -3.633  -1.566
  398   HD12  LEU  46          2HD1      LEU  46   8.591  -4.287  -2.669
  399   HD13  LEU  46          3HD1      LEU  46   8.779  -2.647  -2.032
  400   HD21  LEU  46          1HD2      LEU  46  11.096  -3.323  -1.211
  401   HD22  LEU  46          2HD2      LEU  46  10.793  -4.919  -1.908
  402   HD23  LEU  46          3HD2      LEU  46  11.271  -4.774  -0.223
  403    H    ARG  47           H        ARG  47  10.806  -6.078   1.911
  404    HA   ARG  47           HA       ARG  47  13.332  -4.717   2.701
  405    HB2  ARG  47          2HB       ARG  47  12.930  -7.731   2.456
  406    HB3  ARG  47          3HB       ARG  47  14.198  -6.872   3.319
  407    HG2  ARG  47          2HG       ARG  47  12.401  -6.027   4.899
  408    HG3  ARG  47          3HG       ARG  47  11.289  -7.139   4.100
  409    HD2  ARG  47          2HD       ARG  47  13.797  -7.854   5.652
  410    HD3  ARG  47          3HD       ARG  47  12.124  -8.193   6.107
  411    HE   ARG  47           HE       ARG  47  12.917  -9.368   3.595
  412   HH11  ARG  47          1HH1      ARG  47  12.830  -9.911   7.076
  413   HH12  ARG  47          2HH1      ARG  47  12.923 -11.637   6.924
  414   HH21  ARG  47          1HH2      ARG  47  13.056 -11.609   3.411
  415   HH22  ARG  47          2HH2      ARG  47  13.054 -12.605   4.833
  416    H    THR  48           H        THR  48  14.004  -3.799   0.801
  417    HA   THR  48           HA       THR  48  13.980  -5.212  -1.744
  418    HB   THR  48           HB       THR  48  15.246  -2.475  -1.178
  419    HG1  THR  48           HG1      THR  48  12.912  -2.757  -0.540
  420   HG21  THR  48          1HG2      THR  48  14.707  -2.035  -3.551
  421   HG22  THR  48          2HG2      THR  48  14.021  -3.650  -3.712
  422   HG23  THR  48          3HG2      THR  48  15.752  -3.456  -3.410
  423    H    ASN  49           H        ASN  49  15.486  -6.873  -1.669
  424    HA   ASN  49           HA       ASN  49  17.471  -7.880  -2.121
  425    HB2  ASN  49          2HB       ASN  49  17.799  -5.911  -3.642
  426    HB3  ASN  49          3HB       ASN  49  18.569  -5.031  -2.331
  427   HD21  ASN  49          1HD2      ASN  49  20.485  -4.746  -3.487
  428   HD22  ASN  49          2HD2      ASN  49  21.557  -6.047  -3.841
  429    H    GLY  50           H        GLY  50  16.649  -6.981   0.669
  430    HA2  GLY  50          2HA       GLY  50  17.587  -7.709   2.724
  431    HA3  GLY  50          3HA       GLY  50  19.205  -7.497   2.067
  432    H    LYS  51           H        LYS  51  18.050  -4.755   1.011
  433    HA   LYS  51           HA       LYS  51  18.374  -3.202   3.486
  434    HB2  LYS  51          2HB       LYS  51  18.116  -2.460   0.536
  435    HB3  LYS  51          3HB       LYS  51  17.981  -1.239   1.791
  436    HG2  LYS  51          2HG       LYS  51  20.405  -3.021   1.412
  437    HG3  LYS  51          3HG       LYS  51  20.248  -1.397   0.744
  438    HD2  LYS  51          2HD       LYS  51  20.226  -2.116   3.701
  439    HD3  LYS  51          3HD       LYS  51  21.566  -1.372   2.826
  440    HE2  LYS  51          2HE       LYS  51  20.204   0.632   2.390
  441    HE3  LYS  51          3HE       LYS  51  18.820  -0.113   3.195
  442    HZ1  LYS  51          1HZ       LYS  51  20.017   1.464   4.617
  443    HZ2  LYS  51          2HZ       LYS  51  21.408   0.509   4.515
  444    HZ3  LYS  51          3HZ       LYS  51  20.019  -0.098   5.259
  445    H    LYS  52           H        LYS  52  16.599  -2.621   4.680
  446    HA   LYS  52           HA       LYS  52  13.933  -3.181   3.530
  447    HB2  LYS  52          2HB       LYS  52  14.575  -4.421   5.593
  448    HB3  LYS  52          3HB       LYS  52  14.763  -2.899   6.465
  449    HG2  LYS  52          2HG       LYS  52  12.407  -2.440   6.366
  450    HG3  LYS  52          3HG       LYS  52  12.139  -3.706   5.163
  451    HD2  LYS  52          2HD       LYS  52  11.310  -4.472   7.307
  452    HD3  LYS  52          3HD       LYS  52  12.734  -5.421   6.887
  453    HE2  LYS  52          2HE       LYS  52  14.096  -4.070   8.438
  454    HE3  LYS  52          3HE       LYS  52  12.682  -3.081   8.825
  455    HZ1  LYS  52          1HZ       LYS  52  12.870  -6.009   9.286
  456    HZ2  LYS  52          2HZ       LYS  52  11.580  -5.003   9.717
  457    HZ3  LYS  52          3HZ       LYS  52  13.082  -4.825  10.479
  458    H    GLU  53           H        GLU  53  12.650  -1.541   3.011
  459    HA   GLU  53           HA       GLU  53  13.169   1.167   4.068
  460    HB2  GLU  53          2HB       GLU  53  14.065   0.851   1.726
  461    HB3  GLU  53          3HB       GLU  53  12.442   0.474   1.181
  462    HG2  GLU  53          2HG       GLU  53  12.946   2.752   0.593
  463    HG3  GLU  53          3HG       GLU  53  11.717   2.769   1.855
  464    H    ASN  54           H        ASN  54  11.413   2.522   4.282
  465    HA   ASN  54           HA       ASN  54   8.787   1.256   4.537
  466    HB2  ASN  54          2HB       ASN  54   9.730   4.057   5.307
  467    HB3  ASN  54          3HB       ASN  54   8.156   3.369   5.691
  468   HD21  ASN  54          1HD2      ASN  54   9.007   0.764   6.452
  469   HD22  ASN  54          2HD2      ASN  54   9.898   0.900   7.923
  470    H    TYR  55           H        TYR  55   7.455   1.307   2.847
  471    HA   TYR  55           HA       TYR  55   7.396   3.606   0.970
  472    HB2  TYR  55          2HB       TYR  55   6.325   0.759   0.607
  473    HB3  TYR  55          3HB       TYR  55   6.205   2.051  -0.586
  474    HD1  TYR  55           HD1      TYR  55   8.105   2.608  -2.013
  475    HD2  TYR  55           HD2      TYR  55   8.575  -0.223   1.152
  476    HE1  TYR  55           HE1      TYR  55  10.310   1.970  -2.908
  477    HE2  TYR  55           HE2      TYR  55  10.773  -0.864   0.261
  478    HH   TYR  55           HH       TYR  55  12.019  -0.797  -1.854
  479    H    THR  56           H        THR  56   5.161   4.127   0.162
  480    HA   THR  56           HA       THR  56   2.936   3.525   1.989
  481    HB   THR  56           HB       THR  56   3.723   6.388   1.222
  482    HG1  THR  56           HG1      THR  56   4.221   4.852   3.525
  483   HG21  THR  56          1HG2      THR  56   1.491   5.372   3.030
  484   HG22  THR  56          2HG2      THR  56   1.278   6.100   1.435
  485   HG23  THR  56          3HG2      THR  56   1.913   7.065   2.767
  486    H    VAL  57           H        VAL  57   1.656   2.543   0.493
  487    HA   VAL  57           HA       VAL  57   1.410   3.638  -2.217
  488    HB   VAL  57           HB       VAL  57   0.131   1.115  -1.058
  489   HG11  VAL  57          1HG1      VAL  57   0.477   1.990  -3.951
  490   HG12  VAL  57          2HG1      VAL  57  -1.038   1.986  -3.047
  491   HG13  VAL  57          3HG1      VAL  57  -0.224   0.463  -3.407
  492   HG21  VAL  57          1HG2      VAL  57   2.579   0.921  -0.980
  493   HG22  VAL  57          2HG2      VAL  57   2.686   1.356  -2.688
  494   HG23  VAL  57          3HG2      VAL  57   1.906  -0.153  -2.207
  495    H    GLU  58           H        GLU  58   0.165   5.312  -2.223
  496    HA   GLU  58           HA       GLU  58  -2.144   5.800  -0.578
  497    HB2  GLU  58          2HB       GLU  58  -1.136   7.293  -3.049
  498    HB3  GLU  58          3HB       GLU  58  -2.243   7.920  -1.833
  499    HG2  GLU  58          2HG       GLU  58  -0.442   7.902  -0.157
  500    HG3  GLU  58          3HG       GLU  58   0.664   7.194  -1.328
  501    H    VAL  59           H        VAL  59  -3.936   4.566  -1.021
  502    HA   VAL  59           HA       VAL  59  -4.723   4.050  -3.843
  503    HB   VAL  59           HB       VAL  59  -5.424   2.395  -1.369
  504   HG11  VAL  59          1HG1      VAL  59  -5.884   1.807  -4.312
  505   HG12  VAL  59          2HG1      VAL  59  -7.120   2.212  -3.116
  506   HG13  VAL  59          3HG1      VAL  59  -6.223   0.700  -2.978
  507   HG21  VAL  59          1HG2      VAL  59  -3.019   2.195  -1.819
  508   HG22  VAL  59          2HG2      VAL  59  -3.348   1.763  -3.500
  509   HG23  VAL  59          3HG2      VAL  59  -3.848   0.681  -2.195
  510    H    GLU  60           H        GLU  60  -6.377   5.352  -4.409
  511    HA   GLU  60           HA       GLU  60  -8.371   6.265  -2.415
  512    HB2  GLU  60          2HB       GLU  60  -7.198   8.051  -3.621
  513    HB3  GLU  60          3HB       GLU  60  -7.631   7.347  -5.172
  514    HG2  GLU  60          2HG       GLU  60  -9.911   7.967  -4.943
  515    HG3  GLU  60          3HG       GLU  60  -9.741   8.318  -3.230
  516    H    ARG  61           H        ARG  61 -10.583   6.099  -2.852
  517    HA   ARG  61           HA       ARG  61 -11.442   3.759  -4.205
  518    HB2  ARG  61          2HB       ARG  61 -12.529   4.751  -2.179
  519    HB3  ARG  61          3HB       ARG  61 -13.127   6.082  -3.164
  520    HG2  ARG  61          2HG       ARG  61 -14.892   4.437  -2.795
  521    HG3  ARG  61          3HG       ARG  61 -14.455   4.479  -4.505
  522    HD2  ARG  61          2HD       ARG  61 -13.108   2.447  -4.242
  523    HD3  ARG  61          3HD       ARG  61 -13.448   2.419  -2.508
  524    HE   ARG  61           HE       ARG  61 -15.588   2.170  -4.532
  525   HH11  ARG  61          1HH1      ARG  61 -13.922   0.901  -1.727
  526   HH12  ARG  61          2HH1      ARG  61 -15.082  -0.356  -1.438
  527   HH21  ARG  61          1HH2      ARG  61 -17.160   0.561  -4.101
  528   HH22  ARG  61          2HH2      ARG  61 -16.917  -0.548  -2.792
  529    H    GLN  62           H        GLN  62 -12.061   3.466  -6.250
  530    HA   GLN  62           HA       GLN  62 -12.761   5.765  -7.999
  531    HB2  GLN  62          2HB       GLN  62 -10.580   4.588  -8.534
  532    HB3  GLN  62          3HB       GLN  62 -11.480   3.106  -8.826
  533    HG2  GLN  62          2HG       GLN  62 -10.959   4.130 -10.941
  534    HG3  GLN  62          3HG       GLN  62 -12.695   4.273 -10.676
  535   HE21  GLN  62          1HE2      GLN  62 -12.887   6.010 -12.119
  536   HE22  GLN  62          2HE2      GLN  62 -12.261   7.585 -11.769
  537    H    GLY  63           H        GLY  63 -14.945   5.500  -7.196
  538    HA2  GLY  63          2HA       GLY  63 -17.137   4.915  -7.552
  539    HA3  GLY  63          3HA       GLY  63 -16.598   3.907  -8.889
  540    H    ASN  64           H        ASN  64 -16.434   1.706  -8.588
  541    HA   ASN  64           HA       ASN  64 -17.428   0.574  -6.042
  542    HB2  ASN  64          2HB       ASN  64 -17.191  -0.703  -8.814
  543    HB3  ASN  64          3HB       ASN  64 -17.849  -1.494  -7.380
  544   HD21  ASN  64          1HD2      ASN  64 -19.845  -1.836  -8.411
  545   HD22  ASN  64          2HD2      ASN  64 -20.962  -0.558  -8.735
  546    H    THR  65           H        THR  65 -14.648   0.681  -8.133
  547    HA   THR  65           HA       THR  65 -13.226  -1.445  -6.647
  548    HB   THR  65           HB       THR  65 -13.229  -1.666  -9.103
  549    HG1  THR  65           HG1      THR  65 -11.403  -2.508  -8.329
  550   HG21  THR  65          1HG2      THR  65 -11.746   0.995  -9.180
  551   HG22  THR  65          2HG2      THR  65 -13.385   0.711  -9.772
  552   HG23  THR  65          3HG2      THR  65 -12.020  -0.083 -10.553
  553    H    TRP  66           H        TRP  66 -10.810  -0.943  -6.293
  554    HA   TRP  66           HA       TRP  66 -10.402   1.850  -5.361
  555    HB2  TRP  66          2HB       TRP  66  -9.074  -0.784  -4.539
  556    HB3  TRP  66          3HB       TRP  66  -8.510   0.797  -4.011
  557    HD1  TRP  66           HD1      TRP  66 -11.333  -1.732  -3.384
  558    HE1  TRP  66           HE1      TRP  66 -12.622  -1.027  -1.264
  559    HE3  TRP  66           HE3      TRP  66  -9.177   2.852  -2.605
  560    HZ2  TRP  66           HZ2      TRP  66 -12.709   1.175   0.491
  561    HZ3  TRP  66           HZ3      TRP  66  -9.918   4.195  -0.679
  562    HH2  TRP  66           HH2      TRP  66 -11.649   3.370   0.840
  563    H    THR  67           H        THR  67  -8.350   2.881  -5.902
  564    HA   THR  67           HA       THR  67  -6.754   1.637  -8.046
  565    HB   THR  67           HB       THR  67  -8.461   3.091  -9.170
  566    HG1  THR  67           HG1      THR  67  -6.705   4.454 -10.240
  567   HG21  THR  67          1HG2      THR  67  -7.061   5.409  -7.770
  568   HG22  THR  67          2HG2      THR  67  -8.709   4.865  -7.445
  569   HG23  THR  67          3HG2      THR  67  -8.301   5.545  -9.021
  570    H    VAL  68           H        VAL  68  -4.651   2.470  -8.268
  571    HA   VAL  68           HA       VAL  68  -3.532   3.442  -5.734
  572    HB   VAL  68           HB       VAL  68  -2.165   2.241  -8.193
  573   HG11  VAL  68          1HG1      VAL  68  -0.993   2.815  -5.443
  574   HG12  VAL  68          2HG1      VAL  68  -0.594   3.649  -6.947
  575   HG13  VAL  68          3HG1      VAL  68  -0.180   1.945  -6.745
  576   HG21  VAL  68          1HG2      VAL  68  -3.711   0.669  -7.051
  577   HG22  VAL  68          2HG2      VAL  68  -2.823   0.899  -5.541
  578   HG23  VAL  68          3HG2      VAL  68  -2.028   0.164  -6.933
  579    H    LYS  69           H        LYS  69  -3.386   5.592  -5.611
  580    HA   LYS  69           HA       LYS  69  -3.150   7.416  -7.777
  581    HB2  LYS  69          2HB       LYS  69  -2.558   7.878  -4.821
  582    HB3  LYS  69          3HB       LYS  69  -2.870   9.131  -6.018
  583    HG2  LYS  69          2HG       LYS  69  -4.857   7.020  -5.135
  584    HG3  LYS  69          3HG       LYS  69  -4.813   8.675  -4.541
  585    HD2  LYS  69          2HD       LYS  69  -5.283   7.907  -7.449
  586    HD3  LYS  69          3HD       LYS  69  -6.562   8.265  -6.289
  587    HE2  LYS  69          2HE       LYS  69  -5.472  10.548  -5.969
  588    HE3  LYS  69          3HE       LYS  69  -4.460  10.165  -7.359
  589    HZ1  LYS  69          1HZ       LYS  69  -6.426  11.477  -7.939
  590    HZ2  LYS  69          2HZ       LYS  69  -7.429  10.229  -7.393
  591    HZ3  LYS  69          3HZ       LYS  69  -6.414   9.983  -8.725
  592    H    ARG  70           H        ARG  70  -0.826   6.510  -5.196
  593    HA   ARG  70           HA       ARG  70   1.433   6.558  -6.989
  594    HB2  ARG  70          2HB       ARG  70   1.164   8.990  -6.558
  595    HB3  ARG  70          3HB       ARG  70   1.217   8.704  -4.823
  596    HG2  ARG  70          2HG       ARG  70   3.363   9.582  -5.627
  597    HG3  ARG  70          3HG       ARG  70   3.557   7.944  -5.001
  598    HD2  ARG  70          2HD       ARG  70   3.454   7.086  -7.355
  599    HD3  ARG  70          3HD       ARG  70   3.396   8.759  -7.922
  600    HE   ARG  70           HE       ARG  70   5.663   8.475  -6.295
  601   HH11  ARG  70          1HH1      ARG  70   4.481   7.259  -9.386
  602   HH12  ARG  70          2HH1      ARG  70   6.069   7.057 -10.055
  603   HH21  ARG  70          1HH2      ARG  70   7.759   8.246  -7.224
  604   HH22  ARG  70          2HH2      ARG  70   7.925   7.615  -8.835
  605    H    ILE  71           H        ILE  71   2.917   5.114  -6.273
  606    HA   ILE  71           HA       ILE  71   3.067   4.312  -3.462
  607    HB   ILE  71           HB       ILE  71   4.862   3.508  -5.816
  608   HG12  ILE  71          2HG1      ILE  71   2.492   1.994  -4.614
  609   HG13  ILE  71          3HG1      ILE  71   2.514   2.771  -6.193
  610   HG21  ILE  71          1HG2      ILE  71   5.964   3.214  -3.632
  611   HG22  ILE  71          2HG2      ILE  71   5.603   1.649  -4.358
  612   HG23  ILE  71          3HG2      ILE  71   4.592   2.265  -3.050
  613   HD11  ILE  71          1HD1      ILE  71   4.122   0.375  -5.325
  614   HD12  ILE  71          2HD1      ILE  71   4.326   1.207  -6.870
  615   HD13  ILE  71          3HD1      ILE  71   2.792   0.433  -6.483
  616    H    THR  72           H        THR  72   3.890   5.958  -2.269
  617    HA   THR  72           HA       THR  72   6.244   7.480  -3.173
  618    HB   THR  72           HB       THR  72   4.374   7.942  -0.794
  619    HG1  THR  72           HG1      THR  72   3.212   8.618  -2.459
  620   HG21  THR  72          1HG2      THR  72   5.462  10.132  -0.553
  621   HG22  THR  72          2HG2      THR  72   6.577   9.755  -1.866
  622   HG23  THR  72          3HG2      THR  72   6.654   8.843  -0.358
  623    H    ARG  73           H        ARG  73   8.101   6.518  -2.658
  624    HA   ARG  73           HA       ARG  73   8.642   4.948  -0.307
  625    HB2  ARG  73          2HB       ARG  73   9.972   4.743  -2.401
  626    HB3  ARG  73          3HB       ARG  73  10.486   6.420  -2.260
  627    HG2  ARG  73          2HG       ARG  73  11.662   5.819  -0.124
  628    HG3  ARG  73          3HG       ARG  73  11.249   4.130  -0.419
  629    HD2  ARG  73          2HD       ARG  73  12.563   4.151  -2.498
  630    HD3  ARG  73          3HD       ARG  73  12.918   5.869  -2.275
  631    HE   ARG  73           HE       ARG  73  13.819   4.736   0.024
  632   HH11  ARG  73          1HH1      ARG  73  14.523   4.096  -3.372
  633   HH12  ARG  73          2HH1      ARG  73  16.137   3.543  -3.050
  634   HH21  ARG  73          1HH2      ARG  73  15.896   3.976   0.440
  635   HH22  ARG  73          2HH2      ARG  73  16.923   3.470  -0.874
  636    H    THR  74           H        THR  74   9.563   5.690   1.685
  637    HA   THR  74           HA       THR  74   9.408   8.460   2.398
  638    HB   THR  74           HB       THR  74   9.195   6.664   4.109
  639    HG1  THR  74           HG1      THR  74   9.813   8.699   4.853
  640   HG21  THR  74          1HG2      THR  74  12.184   6.233   3.723
  641   HG22  THR  74          2HG2      THR  74  10.913   5.086   3.297
  642   HG23  THR  74          3HG2      THR  74  11.188   5.503   4.986
  643    H    VAL  75           H        VAL  75  11.081   9.999   2.564
  644    HA   VAL  75           HA       VAL  75  13.168   9.790   0.617
  645    HB   VAL  75           HB       VAL  75  12.884  11.929   2.777
  646   HG11  VAL  75          1HG1      VAL  75  14.207  12.074   0.040
  647   HG12  VAL  75          2HG1      VAL  75  15.041  11.982   1.591
  648   HG13  VAL  75          3HG1      VAL  75  14.072  13.403   1.199
  649   HG21  VAL  75          1HG2      VAL  75  10.743  11.711   1.579
  650   HG22  VAL  75          2HG2      VAL  75  11.566  11.916   0.031
  651   HG23  VAL  75          3HG2      VAL  75  11.527  13.244   1.195
  652    H    GLY  76           H        GLY  76  14.651   8.222   1.111
  653    HA2  GLY  76          2HA       GLY  76  15.811   7.714   3.666
  654    HA3  GLY  76          3HA       GLY  76  16.412   7.143   2.114
  655    H    SER  77           H        SER  77  17.227   9.076   0.725
  656    HA   SER  77           HA       SER  77  18.452  11.274   2.139
  657    HB2  SER  77          2HB       SER  77  20.228   9.238   0.695
  658    HB3  SER  77          3HB       SER  77  20.763  10.817   1.267
  659    HG   SER  77           HG       SER  77  19.813   9.908   3.386
  660    H    LEU  78           H        LEU  78  19.291  12.859   0.698
  661    HA   LEU  78           HA       LEU  78  19.060  12.593  -2.164
  662    HB2  LEU  78          2HB       LEU  78  17.437  14.285  -2.602
  663    HB3  LEU  78          3HB       LEU  78  16.695  13.200  -1.449
  664    HG   LEU  78           HG       LEU  78  17.846  15.945  -0.775
  665   HD11  LEU  78          1HD1      LEU  78  15.852  16.166  -2.164
  666   HD12  LEU  78          2HD1      LEU  78  15.492  16.659  -0.512
  667   HD13  LEU  78          3HD1      LEU  78  14.948  15.085  -1.099
  668   HD21  LEU  78          1HD2      LEU  78  16.732  15.689   1.410
  669   HD22  LEU  78          2HD2      LEU  78  17.960  14.450   1.167
  670   HD23  LEU  78          3HD2      LEU  78  16.253  14.045   0.981
  671    H    GLU  79           H        GLU  79  19.654  14.827  -3.179
  672    HA   GLU  79           HA       GLU  79  21.560  16.322  -1.498
  673    HB2  GLU  79          2HB       GLU  79  23.313  16.181  -3.235
  674    HB3  GLU  79          3HB       GLU  79  22.920  14.599  -2.593
  675    HG2  GLU  79          2HG       GLU  79  21.894  15.665  -5.233
  676    HG3  GLU  79          3HG       GLU  79  23.326  14.658  -5.061
  677    H    HIS  80           H        HIS  80  21.772  18.461  -2.048
  678    HA   HIS  80           HA       HIS  80  19.737  19.625  -3.740
  679    HB2  HIS  80          2HB       HIS  80  20.644  21.801  -3.012
  680    HB3  HIS  80          3HB       HIS  80  20.394  20.742  -1.634
  681    HD1  HIS  80           HD1      HIS  80  22.369  20.381  -0.103
  682    HD2  HIS  80           HD2      HIS  80  23.457  22.209  -3.677
  683    HE1  HIS  80           HE1      HIS  80  24.746  21.128   0.204
  684    HE2  HIS  80           HE2      HIS  80  25.423  22.103  -2.004
  685    H    HIS  81           H        HIS  81  20.327  21.260  -5.436
  686    HA   HIS  81           HA       HIS  81  22.357  20.295  -7.261
  687    HB2  HIS  81          2HB       HIS  81  20.453  22.675  -7.414
  688    HB3  HIS  81          3HB       HIS  81  21.564  22.224  -8.709
  689    HD1  HIS  81           HD1      HIS  81  18.154  21.926  -8.030
  690    HD2  HIS  81           HD2      HIS  81  21.020  19.179  -9.264
  691    HE1  HIS  81           HE1      HIS  81  16.873  20.043  -9.087
  692    HE2  HIS  81           HE2      HIS  81  18.621  18.374  -9.761
  693    H    HIS  82           H        HIS  82  24.277  21.351  -7.824
  694    HA   HIS  82           HA       HIS  82  25.711  22.438  -5.656
  695    HB2  HIS  82          2HB       HIS  82  27.633  22.550  -7.167
  696    HB3  HIS  82          3HB       HIS  82  26.741  21.061  -7.453
  697    HD1  HIS  82           HD1      HIS  82  27.380  24.444  -9.016
  698    HD2  HIS  82           HD2      HIS  82  25.825  20.726 -10.054
  699    HE1  HIS  82           HE1      HIS  82  27.012  24.531 -11.499
  700    HE2  HIS  82           HE2      HIS  82  26.195  22.240 -12.115
  701    H    HIS  83           H        HIS  83  23.839  24.042  -8.031
  702    HA   HIS  83           HA       HIS  83  24.711  26.677  -7.013
  703    HB2  HIS  83          2HB       HIS  83  25.533  26.309  -9.350
  704    HB3  HIS  83          3HB       HIS  83  23.884  26.004  -9.884
  705    HD1  HIS  83           HD1      HIS  83  23.017  27.997 -11.106
  706    HD2  HIS  83           HD2      HIS  83  25.527  29.108  -7.977
  707    HE1  HIS  83           HE1      HIS  83  23.072  30.513 -11.142
  708    HE2  HIS  83           HE2      HIS  83  24.492  31.144  -9.171
  709    H    HIS  84           H        HIS  84  23.031  27.099  -5.631
  710    HA   HIS  84           HA       HIS  84  20.281  27.052  -6.739
  711    HB2  HIS  84          2HB       HIS  84  20.552  25.160  -5.131
  712    HB3  HIS  84          3HB       HIS  84  21.032  26.298  -3.877
  713    HD1  HIS  84           HD1      HIS  84  18.039  24.979  -5.680
  714    HD2  HIS  84           HD2      HIS  84  18.863  27.849  -2.783
  715    HE1  HIS  84           HE1      HIS  84  15.815  25.600  -4.688
  716    HE2  HIS  84           HE2      HIS  84  16.357  27.223  -2.846
  717    H    HIS  85           H        HIS  85  20.102  29.189  -7.135
  718    HA   HIS  85           HA       HIS  85  20.511  31.193  -5.057
  719    HB2  HIS  85          2HB       HIS  85  20.995  31.852  -7.364
  720    HB3  HIS  85          3HB       HIS  85  19.401  31.342  -7.900
  721    HD1  HIS  85           HD1      HIS  85  21.108  34.096  -5.963
  722    HD2  HIS  85           HD2      HIS  85  17.384  33.258  -7.617
  723    HE1  HIS  85           HE1      HIS  85  19.793  36.230  -5.799
  724    HE2  HIS  85           HE2      HIS  85  17.536  35.688  -6.753